NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 61 L 4.6259 8.0433 120.6088 54.6919 43.8772 175.0665 62 I 4.5084 8.4387 124.7302 58.7940 40.4732 173.0580 63 G 2.8837 8.6799 115.2063 44.3929 0.0000 171.8312 64 L 5.0215 8.4015 129.0706 53.1698 44.3195 174.7878 65 L 4.9872 9.2713 129.7338 53.4563 44.0701 174.8988 66 L 4.3206 8.6584 127.7126 53.2456 43.1821 176.5992 67 P 4.3051 0.0000 0.0000 64.7228 32.8947 175.4479 68 D 4.5247 7.2943 119.7168 53.1473 41.6881 174.8376 69 M 4.4513 9.9106 123.4801 56.2185 31.6142 178.1934 70 S 4.2584 8.1892 114.3669 60.1860 63.8516 173.7068 71 N 4.7544 8.2798 121.6758 52.1509 39.3284 173.9394 72 P 4.6582 0.0000 0.0000 64.3749 31.2672 178.1958 73 F 4.1549 8.5731 120.3506 61.4731 39.1266 177.0469 74 F 4.2358 8.0930 117.4047 60.3779 38.6749 177.9809 75 T 3.9624 7.9521 108.9329 64.2814 68.7223 176.4595 76 L 4.0158 7.8521 123.3987 57.9424 42.0257 178.7791 77 I 3.6749 7.3432 119.5804 64.4390 37.0429 178.0575 78 A 3.9904 8.3149 124.0892 55.8445 18.0097 180.5947 79 R 3.9690 8.1044 119.0704 61.4963 29.6962 181.1277 80 G 3.2051 7.5996 107.1226 47.4586 0.0000 175.7096 81 V 3.4352 7.7111 120.9782 65.5043 31.5220 177.6396 82 E 3.9357 8.4045 118.6590 59.7036 29.4032 179.3630 83 D 4.3490 8.2850 118.7503 57.3252 40.4229 179.0129 84 V 3.5592 7.5901 117.9931 65.9219 31.5044 177.5356 85 A 4.0376 8.2158 120.9263 55.5631 18.1497 179.7099 86 L 4.1673 8.6088 118.6235 57.3307 41.4962 179.4099 87 A 4.0574 7.8365 119.6473 54.5837 18.2212 177.7842 88 H 4.6836 7.7977 111.1607 55.5322 29.4330 174.9867 89 G 3.8170 8.5376 107.4472 45.7680 0.0000 173.0139 90 Y 4.6797 8.3690 117.0670 56.1977 40.8297 174.9524 91 Q 4.8590 8.5904 119.9642 54.3438 32.3618 174.4790 92 V 4.7652 8.1717 120.9766 61.2497 33.3755 174.9024 93 L 4.5061 8.4803 128.4448 54.1208 43.1950 175.7282 94 I 4.8848 8.4468 123.7093 59.4874 39.5390 175.1715 95 G 2.8470 8.9442 113.3737 43.8138 0.0000 171.1141 96 N 5.3497 8.3605 122.6277 51.6550 39.8770 175.0230 97 S 4.2604 9.5206 124.7696 59.8857 63.5580 175.3194 98 D 4.5458 8.9604 117.9680 54.0234 36.8568 178.2656 99 N 4.0888 7.9815 113.2768 55.3295 36.6590 174.2483 100 D 4.8899 7.9602 116.8668 52.0597 44.3859 175.7610 101 I 3.9000 8.5945 130.1167 64.8602 37.2053 179.1297 102 K 3.9171 8.1324 124.0921 59.8411 31.7417 181.0570 103 K 3.9978 8.3268 119.8473 59.1664 31.9313 179.3243 104 A 4.0547 8.1883 120.8406 55.2961 18.3730 179.2541 105 Q 3.9745 8.6343 118.6346 59.4509 29.0039 178.8904 106 G 3.4600 8.2537 106.9206 48.0618 0.0000 175.2098 107 Y 3.7504 7.6436 118.4940 60.0608 37.8683 177.5097 108 L 4.1146 7.9970 121.3194 58.2615 42.0671 179.0166 109 A 3.9283 7.8376 120.2142 55.5144 18.3749 179.2566 110 T 3.9194 8.1723 114.5319 67.2943 68.5360 176.6020 111 F 4.6181 8.8807 120.3085 60.6657 38.9764 178.0761 112 V 3.5825 8.6627 118.1722 66.0886 31.1678 177.8979 113 S 4.1825 8.4475 114.0213 62.1245 62.7742 176.1131 114 H 4.6799 8.1601 115.7012 55.3294 29.0776 174.9118 115 N 4.2628 8.2645 115.9218 53.8921 36.5763 174.5971 116 C 4.1655 7.7484 114.5721 61.0567 28.6094 174.5957 117 T 4.2645 9.0390 114.0740 63.0063 69.2556 174.6534 118 G 4.0705 7.3564 107.3356 45.8753 0.0000 171.9380 119 M 5.2680 8.4985 120.8510 53.4697 35.8315 174.3736 120 I 5.1173 8.6466 125.9295 59.8688 40.8730 174.9757 121 S 5.0626 8.9432 120.2034 59.2144 66.4204 173.8966 122 T 4.9385 8.4896 109.2365 60.6276 70.4806 174.7911 123 A 3.2133 9.0631 123.4811 52.2509 18.6339 179.1551 124 F 3.9680 7.5763 119.1299 61.0718 39.5232 176.0929 125 N 4.7870 8.1267 118.1560 53.6120 39.0425 176.9480 126 E 3.7923 8.0137 121.9074 61.5943 29.4313 182.1733 127 N 4.4590 7.8521 116.0059 56.4616 38.8493 177.3318 128 I 3.7005 7.5943 119.4810 63.9717 38.0599 177.5959 129 I 3.6426 7.9074 123.2916 64.8564 36.9873 178.4384 130 E 3.4834 8.2393 119.0377 61.4253 29.6113 181.1850 131 N 4.5264 8.1204 117.4282 56.5128 38.6873 177.8019 132 T 4.0804 7.9735 116.9702 66.5400 68.5222 177.1166 133 L 4.2181 8.2822 121.6606 57.6989 41.6537 179.5781 134 T 3.9881 8.2470 112.4322 65.5928 68.5229 176.8088 135 D 4.4082 7.5101 121.6274 57.9255 39.7689 179.3748 136 H 4.9001 7.5657 112.0484 54.5363 29.9134 174.4988 137 H 4.0224 7.7611 117.2489 57.3368 26.6714 175.1982 138 I 4.6458 8.0112 118.9352 58.8404 39.4130 175.8176 139 P 4.7197 0.0000 0.0000 62.8041 33.0855 174.7761 140 F 5.2312 7.2996 112.7943 56.1819 40.4738 173.7444 141 V 4.3490 8.5299 113.0303 59.5662 35.9066 174.5521 142 F 5.6707 9.1474 122.9335 55.8833 40.3009 176.8298 143 I 3.9765 9.0623 119.2190 62.9571 37.9469 176.7292 144 D 4.7569 8.2807 120.3545 53.8840 39.8027 176.5908 *151 N 4.4333 8.0082 116.6227 52.8217 40.2229 173.9837 152 G 4.6097 7.8505 107.2638 45.1411 0.0000 174.0488 153 I 4.5562 7.9107 108.6704 60.4367 40.3141 175.3269 154 S 4.4029 7.9479 115.9840 57.7723 62.9537 173.1492 155 T 4.0412 8.2151 114.8035 61.5243 69.3480 173.4629 156 N 4.6312 8.4252 119.7739 53.0040 40.0091 175.1801 157 H 4.3210 8.6194 125.8258 58.5617 28.9922 177.4353 158 F 4.3878 8.4466 124.7812 61.9319 39.3331 177.8375 159 K 4.1300 8.6838 123.4707 59.6336 31.5125 180.9189 160 G 4.8096 7.8795 108.7182 47.2752 0.0000 175.9278 161 G 3.5765 8.2238 108.2079 47.5697 0.0000 175.6602 162 Q 3.9817 7.7889 120.2817 58.8056 28.6058 179.1257 163 L 4.0156 7.7980 119.8245 57.6563 41.6355 179.5468 164 Q 3.9388 8.1254 117.8507 59.0703 28.6510 178.8294 165 A 4.0692 8.1112 124.1252 55.5685 18.2366 180.2499 166 E 3.9038 8.2442 117.0999 61.1829 29.8209 182.3562 167 V 3.7850 7.5407 119.3170 65.9434 31.5159 178.3231 168 V 3.5621 7.6061 117.3151 65.9237 31.3672 177.8167 169 R 3.8752 8.2697 118.7728 59.5680 29.6825 178.6458 170 K 4.1623 8.2665 117.4805 59.2415 32.0658 179.0636 171 G 3.7833 7.9121 101.9709 44.0792 0.0000 173.4703 172 K 3.8422 7.9395 118.3140 57.0335 30.0792 176.2428 173 G 4.1064 8.1526 109.2934 46.0351 0.0000 174.1994 174 K 4.3593 9.1816 123.2738 54.9563 34.6465 174.1187 175 N 4.9997 9.0870 119.0165 51.3650 41.3159 173.7957 176 V 4.7565 8.6597 124.6590 60.8589 34.4061 173.9233 177 L 4.9369 8.8318 130.2606 53.6254 44.2069 175.0450 178 I 4.6491 9.0056 128.4879 60.1811 38.5613 175.0439 179 V 4.7549 8.7013 129.6226 61.7230 32.6940 174.3861 180 H 5.0811 8.6094 123.6569 53.6434 31.8957 173.8418 181 E 4.2626 8.1496 120.2697 55.1001 31.2809 175.5254 182 N 4.2560 8.5516 118.9700 54.5657 38.7562 175.4037 183 L 4.4667 8.5699 125.0618 55.8348 42.1114 178.1465 184 L 4.1525 8.1262 119.4778 57.4824 41.9942 178.2663 185 I 4.2374 7.9963 120.8762 60.5023 38.0140 176.2564 186 D 4.3882 8.8906 125.2318 57.4383 40.7883 178.4858 187 A 3.7034 7.8726 120.5129 55.3458 18.2689 179.5883 188 F 4.3733 7.6332 115.4345 60.9955 39.0643 177.2988 189 H 4.1703 8.5158 117.8933 59.4058 29.7178 177.3651 190 Q 4.1116 8.5314 120.2861 58.9533 28.5496 178.6982 191 R 4.0565 8.0395 119.7921 59.4620 30.0791 178.7553 192 V 3.4997 7.7002 117.9221 66.0837 31.4948 178.0478 193 Q 4.1011 8.1874 118.0198 58.5984 28.3747 178.8145 194 G 2.7023 7.9056 106.8213 47.5767 0.0000 175.6982 195 I 3.6480 7.4107 122.6525 63.9080 37.1073 178.7960 196 K 3.6035 8.0496 121.7134 59.8699 31.3847 179.3073 *197 Y 4.0963 8.1438 121.5482 62.3833 36.7530 181.0935 198 I 3.9117 7.3531 121.2887 64.2206 37.3271 178.6442 199 L 4.0453 8.0841 120.0984 57.7910 41.3152 179.2554 200 D 4.5228 8.7878 121.6936 58.3531 40.6498 179.2491 201 Q 4.0391 7.4999 119.0382 60.6571 28.1374 180.6190 202 Q 4.4522 8.1596 118.9842 56.0328 29.5438 176.5712 203 R 3.7751 7.9012 118.1512 56.9667 27.4117 181.6487 204 I 4.4413 7.6599 119.3705 60.5057 38.7051 177.0088 205 D 4.5599 8.7025 127.3416 54.6986 41.8223 174.8988 206 Y 6.0189 7.6180 119.0915 55.4953 41.4158 173.7940 207 K 4.7982 8.7513 120.3493 55.0454 36.4478 174.2544 208 M 5.2471 8.7282 123.7476 53.5001 34.5243 175.0354 209 L 4.7616 9.1098 125.1963 52.9466 45.5690 175.3695 210 E 4.0311 8.7813 126.9630 55.6067 30.5110 177.3261 211 A 3.9166 8.4492 127.5031 55.0464 18.2931 180.1140 212 T 3.8108 7.8135 114.3547 66.6563 68.3123 175.6429 213 L 4.2293 7.6874 117.3325 55.6572 41.5826 178.6386 214 L 3.7724 7.5044 120.4522 57.2769 41.5433 178.1167 215 D 4.6374 8.1345 118.1241 55.8788 41.7163 175.5387 216 N 4.7059 7.8579 118.6815 51.9150 38.3898 174.4982 217 D 4.4519 8.4655 126.9770 55.9835 39.7346 178.1104 218 K 3.6281 8.1849 123.1460 59.8456 32.3306 179.4033 219 K 4.0227 7.9756 123.5242 59.4549 31.6052 180.7385 220 F 4.3612 8.0643 121.0663 61.4782 39.3058 177.3007 221 I 3.3248 7.6663 119.2674 64.3403 36.7947 178.0592 222 D 4.2978 7.9612 119.7032 57.1986 40.5966 178.7710 223 L 3.8125 7.5882 120.1583 58.1666 42.1839 178.6810 224 I 3.3687 7.2764 119.9516 64.4528 36.9609 178.5214 225 K 3.9886 8.0398 118.8538 59.4906 31.7287 179.0470 226 E 3.9195 7.9870 118.2013 59.0399 29.6778 178.0768 227 L 4.2401 7.8974 115.8552 53.9816 42.4159 176.5561 228 S 3.7436 7.8930 114.2316 59.1039 61.0666 172.9706 229 I 3.9623 7.5033 119.9651 61.8324 37.7017 176.1061 230 D 5.1495 8.9654 121.7284 51.8668 41.4594 175.3822 231 S 5.1247 7.8580 115.2807 57.1357 67.8295 172.8448 232 I 4.9556 9.0978 124.5716 59.7089 40.6775 174.2229 233 I 4.8289 8.6358 128.4162 59.8320 39.0795 174.5842 234 C 5.1398 8.7458 125.1856 57.8867 29.8353 174.4664 235 S 4.3148 8.3785 119.0635 61.5780 63.4027 173.7187 236 N 5.1150 7.5722 114.5847 50.8403 40.0235 174.3131 237 D 4.3897 8.5385 116.6396 57.2122 40.6952 178.9459 238 L 3.9755 7.9408 119.3834 57.7358 41.5883 179.3454 239 L 3.8648 8.3544 118.7187 57.5796 41.4630 179.3657 240 A 3.9027 7.7792 120.3680 55.1771 18.3320 179.7908 241 I 3.4041 7.8732 118.6336 64.2827 37.1251 178.0637 242 N 4.1626 7.8706 117.7688 56.7783 38.7333 176.8092 243 V 3.4170 7.7550 119.6216 65.8980 31.4987 177.5453 244 L 4.0179 8.1627 120.2414 58.2362 41.9421 179.2519 245 G 3.6318 7.9992 105.4673 47.7848 0.0000 175.6884 246 I 3.8978 7.7751 122.2666 64.4507 37.1322 179.0808 247 V 3.8585 8.1505 113.3068 64.4807 31.3408 178.7757 248 Q 4.2099 8.4254 118.0841 58.9912 28.3546 178.6619 249 R 3.8706 8.1164 118.7039 58.7204 30.0413 177.1462 250 Y 4.3879 7.5243 114.1403 57.2167 38.5757 174.9238 251 H 4.1142 7.9920 115.2069 57.0663 26.3864 174.8856 252 F 4.6286 8.4679 117.1975 56.4260 40.6253 176.0000 253 K 4.4053 9.0261 124.2301 55.4966 33.4819 175.2869 254 V 4.9253 8.4148 127.4940 60.6816 33.1836 173.3993 255 P 5.3971 0.0000 0.0000 62.1537 32.1727 176.4606 256 A 4.1247 8.0674 122.5330 55.6164 18.5509 178.8686 257 E 4.2141 8.3170 114.8232 58.7737 30.2746 176.2816 258 I 5.0228 8.0698 119.5894 59.4545 40.6239 174.5004 259 Q 5.0080 8.9420 125.4851 55.0405 31.0452 174.7818 260 I 5.1694 8.4707 120.9221 59.7726 41.3449 174.6055 261 I 4.6350 8.8101 125.5153 59.2969 41.1286 174.2274 262 G 4.4342 8.4570 117.5751 46.3259 0.0000 171.8237 263 Y 4.4128 8.7268 120.1466 58.4340 42.3034 174.9285 264 D 4.6802 9.4942 126.2039 53.4063 40.2042 175.4250 265 N 4.1168 7.7748 115.3528 54.4072 37.6539 173.5654 266 I 4.2169 8.3155 112.7349 59.7766 39.4969 175.6372 267 P 4.2854 0.0000 0.0000 65.8223 31.1085 178.4610 268 F 4.5172 8.5624 119.2496 61.7134 39.0420 177.2165 269 S 4.1376 8.2350 113.5493 60.7347 62.5308 175.3056 270 E 4.4402 8.1690 119.8314 56.8124 29.7105 176.3797 271 M 4.4885 8.0017 118.2494 55.4891 33.5230 176.3533 272 T 4.4258 7.6562 109.4886 60.7565 70.3825 172.9227 273 Y 4.6014 8.2023 122.4167 54.8666 40.6300 173.4341 274 P 4.0767 0.0000 0.0000 62.1448 31.9490 176.0191 275 Q 4.4334 8.2249 117.6032 55.6207 30.2050 175.2421 276 I 4.4938 8.5743 123.2949 60.3266 38.2117 176.2006 277 T 4.1202 8.6462 125.1143 64.3174 69.6057 173.7315 278 T 4.7192 8.4294 119.0687 61.2186 71.8855 171.4679 279 I 4.6116 7.7390 121.8742 59.1223 40.1301 174.8208 280 D 4.7179 8.8874 128.7883 53.5507 42.2177 176.6628 281 Q 4.5050 8.5180 124.4706 56.0440 29.8194 175.4384 282 S 3.7308 8.5069 110.6649 60.4149 61.3182 174.0712 283 A 3.9902 8.0616 123.9160 55.4786 18.5991 178.6160 284 Y 4.0698 8.0406 117.4304 61.3452 38.9044 177.8150 285 H 4.4327 8.4046 118.5703 58.8030 30.0084 176.5201 286 L 3.9926 8.5050 123.1109 58.2069 41.9069 179.2131 287 G 3.4824 7.8055 105.1567 47.8588 0.0000 175.3310 288 E 3.8409 7.7008 121.1498 59.1875 29.3036 179.6806 289 I 3.5973 7.9835 119.8994 64.0309 37.0546 178.2718 290 A 4.1303 7.8744 121.9355 55.2661 18.2129 180.1718 291 V 3.4571 7.5020 117.0990 64.7280 31.4755 178.7426 292 S 3.9564 8.0968 115.9285 61.4803 62.4953 176.3817 293 Q 3.8965 8.6470 121.8492 59.0950 28.8314 177.7395 294 L 3.9295 7.9645 120.7075 57.6371 42.1495 178.1406 295 L 4.3579 7.7320 117.4520 54.5908 43.5937 177.3325 296 G 3.8524 8.0890 107.2817 45.7714 0.0000 171.0447 *310 A 4.1537 7.6266 122.3963 52.0991 20.1431 175.8981 311 L 4.9813 8.5893 122.4439 53.1827 43.9180 176.1359 312 T 4.5571 8.4334 113.4718 59.5060 71.7959 173.3455 313 V 3.8450 8.5118 126.8366 62.8793 32.5857 175.4848 314 K 4.3641 8.7849 128.7403 55.3063 32.8007 175.2716 315 H 4.7567 8.6094 123.0491 55.6262 29.1267 175.1816 316 R 4.6580 8.9289 121.7980 54.6878 34.5721 176.1217 317 G 3.6440 8.8927 107.8858 48.3637 0.0000 174.5732 318 S 4.3744 7.7868 113.1777 58.8811 63.5724 173.6816 319 T 4.8832 7.2531 109.9456 59.9316 71.4363 174.2259 320 R 4.1626 9.0651 120.8618 56.5614 30.1610 176.6386 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 61 L 8.04 4.63 0.00 1.66 1.67 1.00 0.46 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 62 I 8.44 4.51 1.76 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.04 0.73 0.00 0.00 63 G 8.68 2.88 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 64 L 8.40 5.02 0.00 1.61 1.58 0.87 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 65 L 9.27 4.99 0.00 1.99 1.65 0.85 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 66 L 8.66 4.32 0.00 1.59 1.35 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 67 P 0.00 4.31 0.00 1.73 1.82 0.00 2.20 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 0.95 1.50 0.00 68 D 7.29 4.52 0.00 2.76 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 69 M 9.91 4.45 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.49 0.00 70 S 8.19 4.26 0.00 4.08 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 71 N 8.28 4.75 0.00 3.14 3.29 0.00 0.00 7.03 7.11 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 72 P 0.00 4.66 0.00 2.29 2.16 0.00 4.05 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.08 0.00 73 F 8.57 4.15 0.00 3.08 2.91 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 74 F 8.09 4.24 0.00 3.43 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 75 T 7.95 3.96 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 1.30 0.00 0.00 76 L 7.85 4.02 0.00 1.98 1.80 1.08 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 77 I 7.34 3.67 1.90 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.03 0.85 0.00 0.00 78 A 8.31 3.99 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 79 R 8.10 3.97 0.00 1.85 1.95 0.00 3.31 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 80 G 7.60 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 0.00 0.00 0.00 81 V 7.71 3.44 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 0.99 0.00 0.00 0.85 0.00 0.00 82 E 8.40 3.94 0.00 2.27 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 2.33 2.36 0.00 83 D 8.28 4.35 0.00 2.71 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 84 V 7.59 3.56 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 0.97 0.00 0.00 0.93 0.00 0.00 85 A 8.22 4.04 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 86 L 8.61 4.17 0.00 1.71 1.75 0.94 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 87 A 7.84 4.06 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 88 H 7.80 4.68 0.00 3.43 3.54 0.00 5.88 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 G 8.54 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 0.00 0.00 0.00 90 Y 8.37 4.68 0.00 3.01 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 91 Q 8.59 4.86 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.87 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 92 V 8.17 4.77 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 0.72 0.00 0.00 0.88 0.00 0.00 93 L 8.48 4.51 0.00 1.58 1.71 0.97 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 94 I 8.45 4.88 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.41 0.86 0.00 0.00 95 G 8.94 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 0.00 0.00 0.00 96 N 8.36 5.35 0.00 2.69 2.77 0.00 0.00 7.10 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 97 S 9.52 4.26 0.00 4.02 4.09 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 0.00 0.00 0.00 98 D 8.96 4.55 0.00 2.86 2.63 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 99 N 7.98 4.09 0.00 2.84 2.78 0.00 0.00 6.54 7.34 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 0.00 100 D 7.96 4.89 0.00 2.64 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 I 8.59 3.90 1.93 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 1.82 0.58 0.94 0.00 0.00 102 K 8.13 3.92 0.00 1.76 1.82 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.11 7.81 103 K 8.33 4.00 0.00 2.06 1.96 0.00 1.65 0.00 0.00 1.86 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.45 7.81 104 A 8.19 4.05 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 Q 8.63 3.97 0.00 2.06 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 106 G 8.25 3.46 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 0.00 107 Y 7.64 3.75 0.00 2.97 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 0.00 0.00 0.00 108 L 8.00 4.11 0.00 1.76 1.85 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.84 3.93 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 8.17 3.92 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 1.34 0.00 0.00 111 F 8.88 4.62 0.00 3.15 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 0.00 112 V 8.66 3.58 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 0.78 0.00 0.00 0.96 0.00 0.00 113 S 8.45 4.18 0.00 4.10 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 0.00 114 H 8.16 4.68 0.00 3.32 3.40 0.00 6.00 0.00 0.00 0.00 0.00 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.26 4.26 0.00 2.89 2.92 0.00 0.00 6.85 6.96 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 0.00 116 C 7.75 4.17 0.00 3.10 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 0.00 117 T 9.04 4.26 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 118 G 7.36 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 M 8.50 5.27 0.00 2.17 1.94 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.59 0.00 120 I 8.65 5.12 1.81 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 1.20 0.46 0.89 0.00 0.00 121 S 8.94 5.06 0.00 4.02 4.09 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 0.00 0.00 0.00 122 T 8.49 4.94 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 1.22 0.00 0.00 123 A 9.06 3.21 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 F 7.58 3.97 0.00 3.02 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 0.00 125 N 8.13 4.79 0.00 2.91 2.78 0.00 0.00 7.18 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 0.00 126 E 8.01 3.79 0.00 1.95 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 2.26 2.27 0.00 127 N 7.85 4.46 0.00 2.65 2.84 0.00 0.00 6.79 7.48 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 0.00 128 I 7.59 3.70 1.84 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 1.61 1.33 0.91 0.00 0.00 129 I 7.91 3.64 1.91 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.58 0.56 0.00 0.00 130 E 8.24 3.48 0.00 1.96 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 2.25 2.25 0.00 131 N 8.12 4.53 0.00 2.84 2.88 0.00 0.00 7.14 6.42 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 0.00 132 T 7.97 4.08 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 0.00 133 L 8.28 4.22 0.00 1.53 2.04 0.91 0.53 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 0.00 134 T 8.25 3.99 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 1.47 0.00 0.00 135 D 7.51 4.41 0.00 2.85 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 0.00 136 H 7.57 4.90 0.00 3.17 3.40 0.00 5.97 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 H 7.76 4.02 0.00 3.28 3.38 0.00 5.80 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 I 8.01 4.65 1.96 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 1.35 0.88 1.00 0.00 0.00 139 P 0.00 4.72 0.00 1.96 2.08 0.00 3.93 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 1.92 0.00 140 F 7.30 5.23 0.00 2.74 2.88 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 0.00 141 V 8.53 4.35 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 0.80 0.00 0.00 0.89 0.00 0.00 142 F 9.15 5.67 0.00 3.02 3.08 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 157 H 8.62 4.32 0.00 3.24 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 F 8.45 4.39 0.00 3.11 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 0.00 159 K 8.68 4.13 0.00 1.82 1.80 0.00 1.88 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.33 7.81 160 G 7.88 4.81 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 0.00 0.00 0.00 161 G 8.22 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 0.00 0.00 0.00 162 Q 7.79 3.98 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.17 2.10 0.00 163 L 7.80 4.02 0.00 1.96 1.68 0.89 0.80 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 0.00 164 Q 8.13 3.94 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.74 0.00 165 A 8.11 4.07 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 E 8.24 3.90 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 2.24 2.18 0.00 167 V 7.54 3.79 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.89 0.00 0.00 168 V 7.61 3.56 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.95 0.00 0.00 169 R 8.27 3.88 0.00 1.99 2.08 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 170 K 8.27 4.16 0.00 1.97 1.86 0.00 1.65 0.00 0.00 1.94 0.00 0.00 3.14 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.50 7.81 171 G 7.91 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 0.00 172 K 7.94 3.84 0.00 1.92 1.88 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.37 7.81 173 G 8.15 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 0.00 174 K 9.18 4.36 0.00 1.74 1.67 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.23 0.98 7.81 175 N 9.09 5.00 0.00 2.67 2.73 0.00 0.00 6.50 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 0.00 176 V 8.66 4.76 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 1.01 0.00 0.00 0.97 0.00 0.00 177 L 8.83 4.94 0.00 1.76 1.52 0.98 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 178 I 9.01 4.65 1.89 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 1.02 0.39 0.87 0.00 0.00 179 V 8.70 4.75 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 0.84 0.00 0.00 1.02 0.00 0.00 180 H 8.61 5.08 0.00 3.16 3.29 0.00 5.51 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 E 8.15 4.26 0.00 1.16 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 1.86 1.56 0.00 182 N 8.55 4.26 0.00 2.82 2.83 0.00 0.00 7.68 6.28 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 0.00 183 L 8.57 4.47 0.00 1.74 1.81 0.83 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 184 L 8.13 4.15 0.00 2.04 2.02 1.20 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 185 I 8.00 4.24 2.27 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.88 0.71 0.00 0.00 186 D 8.89 4.39 0.00 2.67 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 0.00 187 A 7.87 3.70 0.74 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 0.00 188 F 7.63 4.37 0.00 3.36 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 0.00 189 H 8.52 4.17 0.00 3.52 3.48 0.00 5.78 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 0.00 190 Q 8.53 4.11 0.00 2.35 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.56 0.00 191 R 8.04 4.06 0.00 1.95 2.02 0.00 2.78 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 192 V 7.70 3.50 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 0.86 0.00 0.00 0.92 0.00 0.00 193 Q 8.19 4.10 0.00 2.58 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 194 G 7.91 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 0.00 0.00 0.00 195 I 7.41 3.65 1.80 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.77 0.67 0.00 0.00 196 K 8.05 3.60 0.00 1.86 1.82 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.99 1.30 7.81 *197 Y 8.14 4.10 0.00 2.27 2.33 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 0.00 198 I 7.35 3.91 1.79 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 1.57 1.13 0.88 0.00 0.00 199 L 8.08 4.05 0.00 1.62 2.06 0.81 1.19 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 0.00 200 D 8.79 4.52 0.00 2.80 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 Q 7.50 4.04 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.93 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 202 Q 8.16 4.45 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.63 0.00 0.00 0.00 0.00 0.00 2.53 2.52 0.00 203 R 7.90 3.78 0.00 1.91 1.81 0.00 3.25 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.45 0.00 204 I 7.66 4.44 1.94 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 1.35 1.17 1.02 0.00 0.00 205 D 8.70 4.56 0.00 2.73 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 Y 7.62 6.02 0.00 2.92 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 0.00 207 K 8.75 4.80 0.00 1.86 1.65 0.00 1.53 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.50 7.81 208 M 8.73 5.25 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 209 L 9.11 4.76 0.00 1.72 1.52 0.97 1.02 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 0.00 210 E 8.78 4.03 0.00 1.98 1.73 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 2.24 2.13 0.00 211 A 8.45 3.92 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 T 7.81 3.81 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 1.18 0.00 0.00 213 L 7.69 4.23 0.00 1.63 1.72 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 214 L 7.50 3.77 0.00 1.69 1.50 0.42 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 215 D 8.13 4.64 0.00 2.70 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 0.00 216 N 7.86 4.71 0.00 2.84 2.72 0.00 0.00 6.98 8.49 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 0.00 217 D 8.47 4.45 0.00 3.08 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 0.00 218 K 8.18 3.63 0.00 1.87 1.84 0.00 1.82 0.00 0.00 1.90 0.00 0.00 3.02 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.49 7.81 219 K 7.98 4.02 0.00 1.80 1.80 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.44 1.06 7.81 220 F 8.06 4.36 0.00 3.04 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 I 7.67 3.32 1.63 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 -0.29 0.94 0.00 0.00 222 D 7.96 4.30 0.00 2.83 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 L 7.59 3.81 0.00 1.70 1.65 0.87 0.84 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 0.00 224 I 7.28 3.37 1.47 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.13 0.28 0.00 0.00 225 K 8.04 3.99 0.00 1.95 1.88 0.00 1.75 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.67 1.75 7.81 226 E 7.99 3.92 0.00 1.95 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 2.37 0.00 227 L 7.90 4.24 0.00 1.78 1.63 0.88 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 228 S 7.89 3.74 0.00 3.99 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 0.00 229 I 7.50 3.96 1.69 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 1.22 0.60 0.86 0.00 0.00 230 D 8.97 5.15 0.00 2.75 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 0.00 231 S 7.86 5.12 0.00 3.74 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 0.00 232 I 9.10 4.96 1.88 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 1.23 0.85 1.00 0.00 0.00 233 I 8.64 4.83 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.74 0.89 0.00 0.00 234 C 8.75 5.14 0.00 2.88 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 0.00 235 S 8.38 4.31 0.00 3.35 3.46 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 0.00 236 N 7.57 5.12 0.00 3.06 2.96 0.00 0.00 6.30 8.07 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 0.00 237 D 8.54 4.39 0.00 2.75 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 L 7.94 3.98 0.00 1.81 1.74 1.01 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 239 L 8.35 3.86 0.00 1.59 1.58 0.79 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 240 A 7.78 3.90 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 0.00 241 I 7.87 3.40 1.62 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.44 0.18 0.00 0.00 242 N 7.87 4.16 0.00 2.90 2.84 0.00 0.00 6.88 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 0.00 243 V 7.76 3.42 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 1.09 0.00 0.00 0.77 0.00 0.00 244 L 8.16 4.02 0.00 1.81 1.78 0.89 1.26 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 0.00 245 G 8.00 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 0.00 246 I 7.78 3.90 2.07 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 1.17 0.00 0.00 247 V 8.15 3.86 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 0.75 0.00 0.00 1.08 0.00 0.00 248 Q 8.43 4.21 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.79 0.00 0.00 0.00 0.00 0.00 2.42 2.57 0.00 249 R 8.12 3.87 0.00 1.92 2.36 0.00 3.37 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.50 0.00 250 Y 7.52 4.39 0.00 3.24 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 0.00 251 H 7.99 4.11 0.00 3.25 3.40 0.00 5.84 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 F 8.47 4.63 0.00 3.11 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 0.00 253 K 9.03 4.41 0.00 1.92 1.71 0.00 1.48 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.44 7.81 254 V 8.41 4.93 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 0.89 0.00 0.00 0.99 0.00 0.00 255 P 0.00 5.40 0.00 2.20 2.19 0.00 3.40 0.00 0.00 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.07 0.00 256 A 8.07 4.12 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 0.00 257 E 8.32 4.21 0.00 2.38 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 0.00 2.44 2.36 0.00 258 I 8.07 5.02 1.88 0.00 0.00 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 1.38 0.79 0.85 0.00 0.00 259 Q 8.94 5.01 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.77 0.00 0.00 0.00 0.00 0.00 2.47 2.31 0.00 260 I 8.47 5.17 1.84 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 1.10 0.65 0.87 0.00 0.00 261 I 8.81 4.64 1.84 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 1.15 1.91 0.95 0.00 0.00 262 G 8.46 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 0.00 0.00 0.00 0.00 263 Y 8.73 4.41 0.00 3.06 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 0.00 264 D 9.49 4.68 0.00 2.75 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 0.00 265 N 7.77 4.12 0.00 2.74 2.93 0.00 0.00 7.25 9.16 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 0.00 266 I 8.32 4.22 1.98 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 1.54 0.60 1.05 0.00 0.00 267 P 0.00 4.29 0.00 2.23 2.19 0.00 3.70 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 2.16 2.19 0.00 268 F 8.56 4.52 0.00 3.07 3.01 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 0.00 269 S 8.24 4.14 0.00 4.07 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 0.00 270 E 8.17 4.44 0.00 2.02 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 2.32 2.37 0.00 271 M 8.00 4.49 0.00 2.15 2.55 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.52 0.00 272 T 7.66 4.43 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 1.07 0.00 0.00 273 Y 8.20 4.60 0.00 2.88 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 0.00 274 P 0.00 4.08 0.00 1.96 1.65 0.00 3.66 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.79 0.00 275 Q 8.22 4.43 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.02 0.00 0.00 0.00 0.00 0.00 2.59 2.33 0.00 276 I 8.57 4.49 1.79 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.63 0.85 0.00 0.00 277 T 8.65 4.12 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 1.16 0.00 0.00 278 T 8.43 4.72 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 1.15 0.00 0.00 279 I 7.74 4.61 0.56 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.34 0.44 0.00 0.00 280 D 8.89 4.72 0.00 2.76 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 281 Q 8.52 4.51 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.66 0.00 282 S 8.51 3.73 0.00 4.14 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 0.00 283 A 8.06 3.99 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 284 Y 8.04 4.07 0.00 3.10 3.01 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 0.00 285 H 8.40 4.43 0.00 3.36 3.46 0.00 5.76 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 286 L 8.50 3.99 0.00 2.01 1.69 1.08 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 287 G 7.81 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 0.00 0.00 0.00 288 E 7.70 3.84 0.00 2.08 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 2.10 2.17 0.00 289 I 7.98 3.60 1.78 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.01 0.86 0.00 0.00 290 A 7.87 4.13 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 0.00 291 V 7.50 3.46 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 0.78 0.00 0.00 0.71 0.00 0.00 292 S 8.10 3.96 0.00 3.93 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 0.00 293 Q 8.65 3.90 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.96 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 294 L 7.96 3.93 0.00 1.66 1.70 0.87 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 295 L 7.73 4.36 0.00 1.47 1.55 0.44 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 296 G 8.09 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 0.00 0.00 0.00 *310 A 7.63 4.15 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 0.00 311 L 8.59 4.98 0.00 1.52 1.55 0.99 0.94 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 0.00 312 T 8.43 4.56 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 1.20 0.00 0.00 313 V 8.51 3.85 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 0.45 0.00 0.00 0.85 0.00 0.00 314 K 8.78 4.36 0.00 1.66 1.73 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.49 1.49 7.81 315 H 8.61 4.76 0.00 3.03 3.23 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 316 R 8.93 4.66 0.00 1.77 1.79 0.00 3.23 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 317 G 8.89 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 318 S 7.79 4.37 0.00 4.00 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 0.00 319 T 7.25 4.88 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 1.22 0.00 0.00 320 R 9.07 4.16 0.00 1.89 1.87 0.00 3.20 0.00 0.00 3.56 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 * Residues marked with a * may have inaccurate shift predictions.