NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.3225 8.1727 120.0817 56.0162 35.2369 175.2685 3 L 4.4412 8.0272 122.7013 54.6159 42.6432 174.2153 4 T 4.5476 9.4427 123.8286 62.5195 72.6335 173.2174 5 G 3.9305 8.4261 114.3841 46.5956 0.0000 174.9558 6 K 4.2711 9.1209 119.5131 58.4455 32.8963 177.4431 7 Q 4.5759 8.9987 114.3508 55.5627 32.2024 174.4797 8 T 4.8390 7.8416 115.7287 61.5232 71.5873 173.1188 9 W 5.1923 8.9904 126.7265 55.2511 31.0857 174.7090 10 E 4.4950 8.9018 127.0126 54.1256 30.4242 175.5114 11 F 4.7329 7.8244 126.3039 57.7463 39.1636 175.6580 12 E 4.3499 9.5687 121.8616 57.1326 30.4828 176.2650 13 N 4.9394 8.3303 115.1842 50.3043 40.7991 172.8577 14 P 4.1500 0.0000 0.0000 63.3938 32.1238 175.4929 15 L 4.7294 7.3843 123.2654 53.8264 45.6542 174.4227 16 F 5.3521 9.4228 124.2346 55.6424 43.9508 174.2060 17 V 4.0501 8.4842 121.9267 62.4872 30.8881 175.6839 18 N 4.7127 9.2276 127.6476 56.0071 39.3482 175.5057 19 S 4.7533 7.5732 110.7908 57.7590 65.8997 174.6372 20 S 5.1129 8.6992 114.4377 56.8777 66.3890 173.2525 21 G 4.5328 9.4061 107.3579 45.0006 0.0000 171.7301 22 T 5.5370 9.4367 112.1276 59.9317 72.8870 172.6277 23 A 5.2282 8.9133 124.9824 50.6928 22.9826 175.4646 24 V 4.6902 8.8934 114.5058 58.9367 37.2951 175.1791 25 G 4.3222 8.5895 108.9779 43.2379 0.0000 172.6537 26 P 4.3416 0.0000 0.0000 65.7942 30.9647 178.3064 27 K 3.8947 7.9559 118.0308 59.3345 32.4654 178.1740 28 E 4.3113 8.1979 118.4033 59.2943 29.4489 178.9437 29 K 4.0993 8.1132 119.7578 59.5434 32.0571 178.1370 30 E 4.4240 8.4803 116.9911 57.0089 30.0086 177.0148 31 G 4.1770 7.8145 108.5440 43.1908 0.0000 172.7113 32 P 4.1999 0.0000 0.0000 65.0725 31.4569 177.6315 33 L 4.3659 7.8836 115.9728 54.0792 41.9362 177.9606 34 G 4.6445 8.4053 110.2144 48.3600 0.0000 174.5994 35 H 4.5757 8.2401 111.9043 55.9739 28.9957 175.5005 36 L 4.2020 7.5662 120.0447 55.4225 42.4791 177.1040 37 F 4.9032 7.2751 116.1839 56.5775 39.6656 175.2190 38 D 4.6387 8.8649 123.7813 56.8204 41.4974 176.8499 39 K 4.7518 8.5323 119.1447 54.6161 35.7391 175.5319 40 S 5.2275 8.4540 119.9127 56.9606 66.3533 172.5488 41 Y 4.8401 8.4076 118.0938 56.4523 40.3087 176.0877 42 D 4.6791 9.1049 122.0026 56.4265 42.6364 176.3104 43 E 4.5626 7.5632 121.8458 55.9519 29.7141 177.6965 *45 H 4.7718 8.7665 112.4736 54.2100 30.5372 172.6443 46 C 3.7293 8.7490 115.8558 60.7631 25.8371 173.3293 47 N 4.2590 8.4276 111.3453 53.9621 35.6961 173.9237 48 Q 4.6264 7.5498 118.6099 53.8414 31.6870 175.9350 49 K 3.9985 8.4957 120.2476 58.6780 32.2010 176.5775 50 N 4.7352 7.3915 112.6230 50.5687 40.7245 173.8859 51 W 4.5462 8.1378 116.6439 60.1972 29.3362 179.0573 52 E 4.1201 8.1347 114.6585 57.1341 28.5277 178.5656 *54 A 4.1760 8.1416 123.6088 52.2812 20.4170 179.5701 55 E 4.0218 8.2880 114.7098 59.5129 29.6800 178.8552 56 R 4.0816 7.8779 117.2971 59.0267 30.3561 178.6451 57 K 4.1911 7.9263 118.9678 59.3379 32.1841 179.2792 58 L 4.2120 7.7460 115.6729 55.8271 41.3746 178.7239 *60 E 4.3109 8.1268 120.9569 56.6955 31.7170 177.9800 61 D 4.3947 8.8349 118.6821 57.3969 40.8587 178.6948 62 A 4.0651 8.2988 121.3475 55.1636 18.3468 179.8804 63 V 3.5567 7.7952 116.2224 66.2743 31.7636 177.8227 64 Q 3.9971 8.2800 119.3535 59.2146 28.8396 178.5167 65 S 4.0879 8.3944 116.0347 61.4985 62.5490 176.3338 66 A 4.0290 7.9691 123.3803 55.3403 18.1374 179.7191 67 L 3.8254 8.3104 117.7417 58.0428 41.6258 179.9543 68 S 4.1447 8.5782 115.4791 61.6334 62.5699 176.8469 69 K 3.9480 8.0277 119.9312 58.8990 31.8008 178.3097 70 Q 4.4201 7.3503 115.0578 54.4056 29.1283 174.8051 71 N 4.1534 8.0319 117.3475 54.6180 37.9442 173.8653 72 L 4.7721 8.1207 115.1380 52.7838 43.9769 176.0600 73 K 4.7157 8.9465 119.6522 53.9484 35.2684 177.6846 74 K 3.8387 8.6441 119.7750 60.2932 32.2619 178.9848 75 E 3.9507 8.1048 117.2759 58.6940 29.4118 177.2383 76 D 4.6229 8.1989 117.2998 54.6629 41.2157 175.9828 77 I 4.4971 7.6738 121.2171 59.7546 38.8376 175.4205 78 D 4.7132 8.6763 124.8463 56.3772 41.7825 176.8656 79 I 4.9542 7.6735 117.3172 59.3976 41.9862 173.3421 80 F 5.6586 9.5729 130.8842 56.5203 42.5024 173.4600 81 L 5.1404 8.8771 125.8716 53.0735 44.3008 175.4875 82 A 5.1298 7.5644 123.7822 51.3650 23.1462 174.6395 83 G 4.3611 8.1612 103.2652 45.7535 0.0000 172.8109 84 D 4.7703 8.9310 121.1171 53.8956 41.2258 176.9716 85 L 4.1207 8.9818 122.1432 56.9825 42.2083 178.9907 86 L 4.3629 8.1121 116.3838 54.6364 44.0283 175.5019 87 N 5.0342 7.8645 114.2290 51.5268 41.6976 174.5427 88 Q 4.5352 8.4464 117.0117 56.6647 27.7725 175.9587 89 N 4.8108 8.2083 108.9388 54.0800 37.3466 177.7742 90 V 3.6823 7.4920 119.2224 66.1612 31.5317 177.1302 91 T 3.9750 8.7200 115.3662 66.3309 68.5766 176.7530 92 A 4.1496 8.6942 123.0064 55.6164 18.4320 179.5100 93 N 4.3922 8.3973 114.8535 56.4705 38.7303 177.1577 94 Y 4.0515 7.6419 118.5456 60.7016 38.8678 178.1725 95 V 3.6166 8.3174 119.1092 65.9403 31.6917 177.6470 96 A 3.7480 8.2750 120.9355 55.0577 17.7632 179.4836 97 R 3.7352 7.6397 116.0024 60.0341 30.2332 178.2121 98 H 4.1132 7.6318 114.0508 58.8117 28.6989 177.6008 99 L 3.9498 8.1520 121.1034 55.4998 41.0599 178.6666 100 K 4.0518 7.6509 115.0550 57.0864 30.2100 175.2041 101 I 4.2673 6.9096 119.5617 59.7124 38.2196 174.2337 102 P 4.3822 0.0000 0.0000 63.5375 32.3551 174.6972 103 F 5.6900 8.9962 125.7211 56.5114 41.6059 173.8201 104 L 4.3172 8.9191 126.5057 53.1127 43.7409 175.1286 105 C 3.8833 8.0870 125.3021 57.8702 31.6441 172.7756 106 L 4.5503 8.3999 126.6708 53.5567 43.0917 177.6713 107 F 5.0539 7.9797 122.4810 57.5251 39.8564 174.1984 108 G 3.8356 8.7809 108.8355 43.8858 0.0000 172.5598 109 A 3.9518 7.2203 122.0183 51.2908 17.0406 178.1882 110 C 3.5631 8.7128 110.5742 62.7168 28.1796 174.9772 111 S 4.3892 7.6941 113.0713 59.6700 63.3031 176.3403 112 T 3.7664 8.7426 120.2685 66.6920 68.0942 176.3606 113 S 4.3542 7.6032 112.3509 59.7077 62.8654 175.3375 *115 E 3.9793 8.2261 123.5576 56.5724 31.2419 177.9459 116 S 4.2222 8.3837 114.1757 61.5648 62.9393 176.5899 117 I 3.8901 7.6177 122.9800 63.8179 36.8941 178.2319 118 A 4.2146 8.0281 121.2251 55.3944 18.3651 179.6343 119 I 3.9872 8.0141 118.3361 64.7165 37.1994 178.7609 120 S 4.1907 8.2182 116.0214 61.7562 62.5916 177.0178 121 S 3.7864 8.4528 117.7797 61.4821 62.4824 176.5942 122 A 4.0637 8.0813 123.3477 55.1952 18.0479 179.7415 123 L 4.1138 8.0693 117.4583 57.9615 41.7041 179.8284 124 I 4.1370 7.8213 121.1296 64.0612 36.8748 178.1073 125 D 4.4704 8.2697 118.0239 56.7703 41.1435 177.6277 126 G 3.9380 8.2192 104.2503 44.8299 0.0000 174.3136 127 G 3.7232 7.7541 108.8782 45.8953 0.0000 174.6096 128 F 4.4819 8.4294 119.3622 58.1120 39.7060 176.1278 129 A 4.7465 7.5474 122.2961 50.4424 22.1790 176.6796 130 K 3.9900 9.4013 123.8083 58.7316 32.8462 177.4902 131 R 5.0315 8.0420 116.5331 54.2140 33.6912 174.3299 132 A 5.3841 8.9727 124.3530 50.0140 22.8047 174.6143 133 L 5.3032 9.0930 121.4176 53.2195 45.2884 175.1535 134 A 5.6109 9.5078 127.0630 49.2890 22.2080 174.6236 135 A 5.6514 8.7020 121.7447 51.5221 23.0752 174.9460 136 T 5.2606 8.7280 108.8646 60.1706 73.1318 172.2783 137 S 4.9507 8.4390 114.6465 57.8247 66.3694 173.1218 138 S 5.0496 9.1030 114.6309 57.7171 66.9375 172.7998 139 H 4.8073 8.5137 119.8232 54.3338 32.5686 173.5919 140 N 4.1743 8.9013 125.8932 56.5980 38.9395 176.6711 141 A 3.5815 7.8016 119.8650 54.0224 18.4192 177.8394 142 T 4.4643 7.5704 104.6129 61.2356 69.5219 176.0132 143 A 4.0788 7.8556 129.2998 56.3488 18.2102 180.9098 144 E 4.2257 8.3776 118.7577 61.8320 29.5202 182.2064 145 R 4.5921 7.7336 122.5588 61.5080 29.1937 182.9484 146 Q 4.2587 8.1780 117.8555 59.2505 28.0712 182.4422 147 F 4.5650 8.8888 118.6865 59.7462 40.8185 176.5116 148 R 4.9247 7.5855 117.3507 54.2959 33.1536 177.2110 149 Y 4.6780 8.0772 116.8415 58.2339 36.7294 176.6490 *164 T 4.3178 7.4549 114.8162 63.1400 70.1355 176.1837 165 V 4.1906 8.6829 127.1769 63.0053 32.7434 175.5367 166 T 4.4425 9.7868 124.5112 63.0188 70.1854 174.2504 167 G 4.0485 7.9322 113.9792 46.7761 0.0000 169.9199 168 S 5.1226 8.2816 113.1344 56.8719 66.4297 173.2966 169 G 4.7604 8.8513 112.3623 44.5472 0.0000 171.4135 170 A 5.6151 9.5255 124.0200 50.2795 23.1615 175.4251 171 V 4.7832 9.0024 112.3485 59.5445 36.6037 174.6903 172 V 4.8169 8.5467 123.1185 61.2348 33.7856 174.4102 173 L 5.7072 8.8898 127.6147 52.5374 45.4555 175.7918 174 S 5.0009 8.1875 114.8135 58.5732 65.8906 175.2797 175 Q 4.6893 8.7852 116.5155 55.5881 28.9670 176.0993 176 Q 4.0720 7.9721 120.8239 54.6641 29.6058 173.8526 177 P 2.9700 0.0000 0.0000 62.6891 31.7968 175.7403 178 G 3.9906 6.2203 109.8938 44.2156 0.0000 171.7614 179 G 3.8317 8.5856 104.5996 48.0291 0.0000 173.8890 180 I 5.1681 7.7464 120.8077 59.4097 41.1195 174.6468 181 K 4.7692 9.3360 125.6025 54.7659 34.9281 175.2237 182 I 4.8596 8.0389 124.3333 60.0403 38.4501 175.5110 183 T 4.7162 8.6369 117.2948 62.4093 71.4017 174.1063 184 S 4.6980 7.8369 114.4698 57.5431 66.4306 173.4496 185 A 5.1012 8.6036 121.1962 50.7588 22.9739 175.1791 186 T 4.7342 8.8129 117.4749 61.6161 71.7553 173.3210 187 V 4.0785 8.0861 127.2080 61.6571 32.4097 176.0139 188 G 4.5262 9.1145 114.9799 45.1039 0.0000 172.5904 189 R 4.8058 8.1303 116.4732 53.8040 32.3350 175.8458 190 V 3.9512 8.2330 120.2915 63.0274 32.3787 175.0979 191 I 4.5536 8.8983 128.6061 59.5089 40.3810 174.1732 192 D 4.6628 8.5865 125.7070 52.4807 43.4274 174.0654 193 L 4.4382 8.5978 126.3116 54.6110 42.1470 176.9632 194 G 3.6541 8.5949 104.8978 46.8642 0.0000 176.3669 195 I 4.2252 7.3323 121.1456 59.6803 36.9370 177.0482 196 T 4.1322 8.2209 115.8254 63.3502 69.6135 174.9245 197 D 4.3396 8.0278 122.7093 54.0019 41.0017 176.5737 198 S 4.4019 8.7975 124.3513 60.8688 63.2908 175.8501 199 Q 4.0719 8.1159 119.5417 56.7634 28.6462 180.9991 200 D 4.5408 8.0006 117.4421 53.4675 41.4653 176.7997 *202 G 4.0005 8.6083 115.7245 45.7634 0.0000 173.6908 203 S 4.2027 8.0139 113.7378 60.3554 63.1720 174.4971 204 A 4.2489 7.4081 121.0743 52.5561 18.3765 177.8123 *206 A 4.4018 8.0113 122.6013 52.8050 20.5613 178.2520 207 P 4.2019 0.0000 0.0000 65.3714 31.2556 178.8242 208 A 3.9129 7.8785 119.1713 55.1223 18.3960 179.3908 209 A 3.8928 7.9181 118.6436 55.0593 18.3890 179.5883 210 A 3.8622 8.1008 119.5666 55.2531 18.4032 179.3486 211 D 4.2157 8.1485 116.5479 57.8136 41.2387 178.6612 212 T 3.8053 7.8016 116.1678 66.5933 68.4470 176.7665 213 I 3.6011 7.8258 121.7776 64.1782 37.0745 178.3087 214 K 3.8587 8.2394 120.6893 59.7035 32.0272 178.6061 215 Q 3.9071 8.2777 119.9257 59.2278 29.0622 177.4746 216 H 4.0501 8.5135 119.7165 59.3448 29.8703 177.3181 217 L 4.0332 7.9630 120.7318 57.6282 41.3339 179.1033 218 E 3.9111 8.3950 119.4533 59.4906 29.3502 178.5793 219 D 4.3800 8.5646 119.2953 56.7291 40.6628 177.8311 220 L 4.5161 7.6318 116.1571 53.3414 42.4478 176.4253 221 G 3.8364 7.7839 106.7528 47.0609 0.0000 173.4808 222 R 4.8271 8.3289 117.4687 54.0551 33.6485 174.6220 223 T 4.8449 9.2944 108.4806 59.1331 72.1423 173.1743 224 P 4.4049 0.0000 0.0000 65.6602 31.3822 178.6995 225 D 4.7041 7.7275 117.3432 57.1644 40.7248 177.1339 226 D 4.5192 8.2301 117.1343 55.0555 41.1655 175.7457 227 Y 4.7496 8.1238 117.2284 56.1280 40.8660 175.5124 228 D 4.6766 9.0330 123.1614 56.6305 41.9260 176.6062 229 L 4.6074 7.7255 117.7507 54.1246 45.9132 173.5756 230 I 4.5237 8.8823 127.4137 59.7032 39.4905 173.9190 231 L 5.1204 9.0686 131.0194 53.5826 43.8042 175.6215 232 T 5.1483 8.0977 115.9993 59.0610 71.9513 174.5920 233 G 4.8007 8.1928 105.5468 44.7553 0.0000 173.7652 234 D 4.8739 8.1668 114.7260 54.2487 44.8692 176.0937 235 L 4.1704 8.5441 121.2523 55.3576 42.9720 177.8552 236 S 3.6423 8.4858 114.5011 59.0897 61.8659 172.8292 237 G 3.6909 8.9671 109.2963 49.9777 0.0000 174.9945 238 V 3.7148 7.9724 120.2095 65.4140 32.0867 178.2940 239 G 3.8548 8.0522 106.2539 47.6296 0.0000 175.6353 240 S 4.1495 7.9762 117.2937 61.2456 62.9389 175.0102 241 P 4.2438 0.0000 0.0000 65.7694 31.0015 178.7003 242 I 3.6839 7.2604 118.9423 64.0867 36.9733 178.1172 243 L 3.8770 7.9312 121.1962 58.1826 41.9150 179.1202 244 K 3.8740 7.8624 118.2335 59.6386 31.9858 179.0608 245 D 4.3338 8.0457 118.9554 57.3657 40.9034 178.7905 246 L 3.9820 8.2035 119.8058 57.8776 41.5440 179.6726 247 L 4.0534 8.0643 118.9148 57.4115 41.4357 179.3042 248 K 4.0605 7.9897 121.0207 59.1233 31.9417 178.6842 249 E 4.0338 8.0077 117.0659 58.8131 29.3244 178.1507 250 E 4.5075 7.3994 115.8776 55.5045 29.6679 176.4986 251 G 3.8221 8.1546 106.9695 46.2241 0.0000 173.6869 252 I 4.2265 8.0767 121.5612 59.2861 38.2305 174.8188 253 N 4.9268 8.5624 123.9971 51.6362 38.9088 175.4111 254 V 3.8718 8.3685 117.6508 61.6199 33.3607 178.3831 255 G 4.1146 7.5629 107.7821 47.2543 0.0000 174.1829 256 T 4.4835 8.6440 113.5805 61.0597 68.8303 175.3940 257 K 4.1515 8.4601 123.5643 58.7844 32.4913 176.0553 258 H 5.2821 7.9215 118.5365 55.3855 31.1715 173.6559 259 N 4.8612 8.4529 121.5245 52.3545 43.1612 172.1632 260 D 5.3905 8.3323 122.4569 52.4287 43.4939 176.7863 261 C 4.0829 9.0244 123.9900 62.8320 28.2807 175.5352 262 G 3.6948 8.5203 107.4384 47.2222 0.0000 173.6735 263 L 4.5648 7.4935 120.3687 54.5301 42.0745 177.4319 *265 I 4.0528 7.6929 119.7141 60.2464 39.9517 174.1762 266 Y 5.0242 7.2795 116.6341 55.9475 40.8373 175.2327 267 T 4.5343 8.3629 112.9672 59.9834 70.0389 172.3604 268 P 4.2376 0.0000 0.0000 63.6639 31.3379 174.7546 269 D 4.2084 8.9155 124.7038 53.1521 40.7904 173.0714 *279 C 4.4975 8.1320 123.0097 59.5671 32.9903 174.9684 280 A 3.9993 7.5829 119.4734 53.7882 16.1622 177.7959 281 C 4.5150 7.5219 112.8788 59.4196 30.2163 174.3909 282 S 3.9385 7.9222 118.6722 62.0253 62.3842 176.2059 283 A 3.0154 7.5587 122.3178 55.0996 18.2028 179.9897 284 V 3.5320 7.3408 110.2366 64.2967 31.5331 179.0278 285 V 3.5571 7.6269 118.0963 66.1456 31.3297 178.1394 286 T 3.5538 7.5002 115.3688 66.6390 68.0399 176.6525 287 F 3.3306 7.5605 118.1165 60.3342 39.0215 177.3726 288 A 4.1677 8.0351 119.0979 54.1384 18.5803 177.3978 289 H 4.6435 8.2073 114.4248 58.0615 31.4696 176.3210 290 I 3.6057 7.4277 120.7184 64.5277 36.9551 178.3135 291 F 4.5016 8.3385 118.7389 60.6559 38.7240 177.9089 292 K 4.0292 8.1169 117.6536 59.4453 31.9365 179.0494 293 E 3.9964 8.3203 118.8757 59.4140 29.3808 179.5596 294 I 4.3540 7.9326 121.1412 64.1652 37.0312 178.3242 295 E 3.9921 8.2463 117.9152 59.2928 29.3811 178.7433 296 A 4.2803 8.0022 118.6209 52.6660 18.7201 178.3320 297 G 3.8979 7.9978 105.4361 45.5791 0.0000 174.6829 298 R 4.3254 7.8700 117.7151 56.6517 31.0195 176.6648 299 L 4.8700 7.5588 117.5581 53.1174 45.8581 176.1418 300 N 4.8160 9.6121 119.5983 54.2680 41.5097 175.0948 301 R 5.1655 8.0121 118.7246 54.8893 33.7457 174.0107 302 V 5.0557 9.3056 126.2780 61.1243 35.2384 173.6060 303 L 4.9204 8.7874 130.0339 53.7672 43.6961 174.9242 304 V 4.8954 8.9332 126.9416 61.1279 34.0828 174.2769 305 V 4.8055 9.0471 127.7468 61.1512 34.2774 173.6967 306 A 4.8371 8.8341 130.3250 50.6625 21.0252 175.4875 307 T 5.0236 8.8881 119.0924 61.5607 71.6472 174.0204 308 G 4.1527 9.0742 112.2552 44.2383 0.0000 171.4161 309 A 4.6284 8.5398 126.1759 51.1848 19.7533 177.9493 310 L 4.4109 8.6562 125.1327 52.8995 40.5275 175.4770 311 L 4.7544 7.2732 122.5206 53.6364 44.0659 176.4952 312 S 4.5679 7.7356 112.2304 56.7581 66.0901 174.2779 313 P 4.7715 0.0000 0.0000 65.4155 30.9192 178.8804 314 T 3.8512 7.7176 113.6912 66.7458 68.3316 176.4280 315 I 3.6853 7.5032 121.2896 64.4029 37.1239 178.5787 316 I 3.6711 7.9803 120.7748 64.6009 36.7500 178.0284 317 Q 3.9824 8.4360 117.8392 59.6529 28.7486 179.2767 318 Q 4.1971 7.8474 114.6984 55.3013 29.4447 176.1223 319 K 3.8086 8.1449 119.4382 57.3783 30.0761 174.3873 320 E 4.5359 7.7361 117.2636 55.3026 31.5330 177.7806 321 S 4.2717 8.5606 115.5394 59.0076 64.0085 174.5158 322 I 4.4031 7.8257 123.1508 58.7436 37.2012 173.5844 323 P 4.6205 0.0000 0.0000 63.0135 32.7040 175.2108 324 C 5.3427 9.0767 118.6398 58.3274 33.0197 172.7321 325 I 4.8919 8.4822 119.4531 59.4903 41.7636 173.5232 326 A 5.1502 8.3803 128.3513 50.4467 22.4522 174.4849 327 H 5.2388 9.0747 118.5037 53.8640 32.7183 173.2266 328 G 4.4921 8.9968 108.1819 44.4834 0.0000 171.7711 329 V 4.8718 8.7077 120.9163 60.8217 35.6363 174.1432 330 V 4.7490 8.7790 127.6954 61.5462 33.1302 174.3765 331 F 5.4451 9.2960 126.9892 56.1881 41.7681 174.7185 332 E 5.2961 9.3780 120.6119 54.6191 34.6111 174.4600 333 R 4.3837 8.6070 122.1075 56.0867 30.8901 176.2414 334 A 4.3838 8.3688 126.5226 52.3261 18.0682 177.1678 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 K 8.17 4.32 0.00 1.66 2.03 0.00 1.63 0.00 0.00 2.00 0.00 0.00 2.85 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.44 7.81 3 L 8.03 4.44 0.00 1.75 1.62 1.12 0.64 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 4 T 9.44 4.55 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 1.25 0.00 0.00 5 G 8.43 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 6 K 9.12 4.27 0.00 1.74 1.86 0.00 1.69 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.44 7.81 7 Q 9.00 4.58 0.00 1.85 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.77 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 8 T 7.84 4.84 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 9 W 8.99 5.19 0.00 2.97 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 10 E 8.90 4.49 0.00 1.81 1.76 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 2.15 2.16 0.00 11 F 7.82 4.73 0.00 3.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 9.57 4.35 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 13 N 8.33 4.94 0.00 2.82 2.75 0.00 0.00 7.01 8.59 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 14 P 0.00 4.15 0.00 2.38 2.21 0.00 3.61 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.16 0.00 15 L 7.38 4.73 0.00 1.67 1.35 0.40 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 16 F 9.42 5.35 0.00 2.99 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 17 V 8.48 4.05 1.80 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 0.59 0.00 0.00 0.85 0.00 0.00 18 N 9.23 4.71 0.00 2.64 2.84 0.00 0.00 6.90 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 19 S 7.57 4.75 0.00 3.84 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 20 S 8.70 5.11 0.00 3.74 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 21 G 9.41 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 T 9.44 5.54 4.49 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 1.50 0.00 0.00 23 A 8.91 5.23 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 24 V 8.89 4.69 1.76 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 -0.11 0.00 0.00 0.55 0.00 0.00 25 G 8.59 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 0.00 0.00 0.00 0.00 26 P 0.00 4.34 0.00 2.31 2.51 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 27 K 7.96 3.89 0.00 1.69 1.87 0.00 1.49 0.00 0.00 1.28 0.00 0.00 2.13 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.07 1.29 7.81 28 E 8.20 4.31 0.00 2.08 1.70 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 2.15 2.39 0.00 29 K 8.11 4.10 0.00 1.97 1.98 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.55 7.81 30 E 8.48 4.42 0.00 2.02 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 2.37 2.60 0.00 31 G 7.81 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.20 0.00 2.03 2.14 0.00 3.81 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 33 L 7.88 4.37 0.00 1.51 1.17 0.83 0.58 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 34 G 8.41 4.64 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 35 H 8.24 4.58 0.00 3.27 3.39 0.00 5.52 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 36 L 7.57 4.20 0.00 0.96 1.57 0.65 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 37 F 7.28 4.90 0.00 3.09 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 38 D 8.86 4.64 0.00 2.82 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.53 4.75 0.00 1.84 1.59 0.00 1.37 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.39 1.07 7.81 40 S 8.45 5.23 0.00 3.87 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 41 Y 8.41 4.84 0.00 2.89 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 42 D 9.10 4.68 0.00 2.75 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 7.56 4.56 0.00 1.98 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 2.37 2.32 0.00 *45 H 8.77 4.77 0.00 3.61 3.47 0.00 6.02 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 C 8.75 3.73 0.00 2.69 1.52 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 47 N 8.43 4.26 0.00 2.91 2.98 0.00 0.00 6.94 7.69 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 48 Q 7.55 4.63 0.00 2.08 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.26 6.97 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 49 K 8.50 4.00 0.00 1.69 1.75 0.00 1.56 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.41 7.81 50 N 7.39 4.74 0.00 2.53 2.59 0.00 0.00 6.04 8.88 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 51 W 8.14 4.55 0.00 3.30 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.13 4.12 0.00 2.15 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 2.33 2.33 0.00 *54 A 8.14 4.18 1.54 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 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.29 4.02 0.00 2.04 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 2.37 2.40 0.00 56 R 7.88 4.08 0.00 1.61 1.85 0.00 2.69 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 57 K 7.93 4.19 0.00 1.82 1.90 0.00 1.69 0.00 0.00 1.85 0.00 0.00 3.18 0.00 0.00 3.50 0.00 0.00 0.00 0.00 1.39 1.79 7.81 58 L 7.75 4.21 0.00 1.96 1.72 0.93 0.99 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 *60 E 8.13 4.31 0.00 2.23 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 0.00 2.34 2.64 0.00 61 D 8.83 4.39 0.00 2.95 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 62 A 8.30 4.07 1.51 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 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.80 3.56 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 1.02 0.00 0.00 1.03 0.00 0.00 64 Q 8.28 4.00 0.00 2.29 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 65 S 8.39 4.09 0.00 4.10 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 66 A 7.97 4.03 1.43 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 67 L 8.31 3.83 0.00 1.80 1.90 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.58 4.14 0.00 4.03 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 69 K 8.03 3.95 0.00 1.88 1.89 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.77 7.81 70 Q 7.35 4.42 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.83 0.00 0.00 0.00 0.00 0.00 2.31 2.48 0.00 71 N 8.03 4.15 0.00 2.80 2.85 0.00 0.00 7.02 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.12 4.77 0.00 1.73 1.56 0.93 0.74 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 73 K 8.95 4.72 0.00 1.78 1.79 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.46 7.81 74 K 8.64 3.84 0.00 1.84 2.01 0.00 1.61 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.44 7.81 75 E 8.10 3.95 0.00 1.95 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 2.31 2.39 0.00 76 D 8.20 4.62 0.00 2.78 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 77 I 7.67 4.50 1.96 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 1.40 0.82 1.10 0.00 0.00 78 D 8.68 4.71 0.00 2.75 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 79 I 7.67 4.95 1.96 0.00 0.00 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 1.29 1.53 1.00 0.00 0.00 80 F 9.57 5.66 0.00 3.10 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.88 5.14 0.00 1.66 1.52 0.99 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 82 A 7.56 5.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 G 8.16 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 0.00 0.00 0.00 0.00 84 D 8.93 4.77 0.00 2.89 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 85 L 8.98 4.12 0.00 1.67 1.67 0.88 0.38 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 86 L 8.11 4.36 0.00 1.59 1.65 nan 0.93 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 87 N 7.86 5.03 0.00 2.90 2.83 0.00 0.00 6.92 7.69 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 88 Q 8.45 4.54 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.31 0.00 0.00 0.00 0.00 0.00 2.58 2.52 0.00 89 N 8.21 4.81 0.00 2.95 3.18 0.00 0.00 6.62 7.68 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 90 V 7.49 3.68 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 1.04 0.00 0.00 0.98 0.00 0.00 91 T 8.72 3.97 4.59 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 1.35 0.00 0.00 92 A 8.69 4.15 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 N 8.40 4.39 0.00 2.96 3.02 0.00 0.00 6.70 7.58 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 94 Y 7.64 4.05 0.00 3.11 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 V 8.32 3.62 2.25 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 1.06 0.00 0.00 1.16 0.00 0.00 96 A 8.27 3.75 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.64 3.74 0.00 1.84 2.04 0.00 3.17 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.56 0.00 98 H 7.63 4.11 0.00 3.16 3.26 0.00 5.91 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.15 3.95 0.00 1.32 1.41 -0.03 0.93 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 0.00 100 K 7.65 4.05 0.00 1.88 1.89 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.41 7.81 101 I 6.91 4.27 1.87 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.55 1.04 0.00 0.00 102 P 0.00 4.38 0.00 2.33 2.08 0.00 3.69 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 2.26 2.17 0.00 103 F 9.00 5.69 0.00 3.17 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 0.00 104 L 8.92 4.32 0.00 1.51 1.43 0.89 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 105 C 8.09 3.88 0.00 2.18 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.40 4.55 0.00 1.68 1.76 0.93 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 107 F 7.98 5.05 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 0.00 108 G 8.78 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 0.00 109 A 7.22 3.95 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 0.00 110 C 8.71 3.56 0.00 3.04 3.14 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 0.00 111 S 7.69 4.39 0.00 4.05 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 0.00 112 T 8.74 3.77 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 1.24 0.00 0.00 113 S 7.60 4.35 0.00 3.80 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 *115 E 8.23 3.98 0.00 2.06 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 0.00 2.24 2.15 0.00 116 S 8.38 4.22 0.00 4.26 4.19 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 0.00 117 I 7.62 3.89 2.07 0.00 0.00 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 1.69 1.04 1.09 0.00 0.00 118 A 8.03 4.21 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 0.00 119 I 8.01 3.99 1.96 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 1.75 1.10 0.96 0.00 0.00 120 S 8.22 4.19 0.00 4.10 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 0.00 121 S 8.45 3.79 0.00 3.77 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 0.00 122 A 8.08 4.06 1.11 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 0.00 123 L 8.07 4.11 0.00 1.90 1.83 0.93 0.56 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 0.00 124 I 7.82 4.14 1.91 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 1.40 1.78 0.90 0.00 0.00 125 D 8.27 4.47 0.00 2.62 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 G 8.22 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 0.00 127 G 7.75 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 0.00 128 F 8.43 4.48 0.00 3.14 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 0.00 129 A 7.55 4.75 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 0.00 130 K 9.40 3.99 0.00 1.72 1.98 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.41 7.81 131 R 8.04 5.03 0.00 1.90 1.79 0.00 3.32 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 132 A 8.97 5.38 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 0.00 133 L 9.09 5.30 0.00 1.84 1.73 1.09 0.87 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 0.00 134 A 9.51 5.61 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 0.00 135 A 8.70 5.65 1.51 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 0.00 0.00 0.00 0.00 0.00 0.00 136 T 8.73 5.26 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 1.27 0.00 0.00 137 S 8.44 4.95 0.00 3.92 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 0.00 138 S 9.10 5.05 0.00 3.83 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 0.00 139 H 8.51 4.81 0.00 3.19 3.04 0.00 5.68 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 N 8.90 4.17 0.00 2.87 2.62 0.00 0.00 6.66 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 0.00 141 A 7.80 3.58 -0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 T 7.57 4.46 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 1.21 0.00 0.00 143 A 7.86 4.08 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 0.00 144 E 8.38 4.23 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 1.95 0.00 145 R 7.73 4.59 0.00 1.86 1.90 0.00 3.20 0.00 0.00 3.11 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.39 0.00 146 Q 8.18 4.26 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 147 F 8.89 4.56 0.00 3.17 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 0.00 148 R 7.59 4.92 0.00 1.69 1.74 0.00 3.24 0.00 0.00 3.34 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.17 0.00 149 Y 8.08 4.68 0.00 3.02 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 *164 T 7.45 4.32 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 1.19 0.00 0.00 165 V 8.68 4.19 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 0.97 0.00 0.00 0.78 0.00 0.00 166 T 9.79 4.44 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 0.92 0.00 0.00 167 G 7.93 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 0.00 168 S 8.28 5.12 0.00 3.93 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 0.00 169 G 8.85 4.76 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 0.00 170 A 9.53 5.62 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 0.00 171 V 9.00 4.78 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 -0.31 0.00 0.00 0.96 0.00 0.00 172 V 8.55 4.82 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 1.09 0.00 0.00 0.96 0.00 0.00 173 L 8.89 5.71 0.00 1.61 1.51 0.96 1.04 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 0.00 174 S 8.19 5.00 0.00 4.01 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 0.00 175 Q 8.79 4.69 0.00 2.11 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.97 0.00 0.00 0.00 0.00 0.00 2.57 2.31 0.00 176 Q 7.97 4.07 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.72 0.00 0.00 0.00 0.00 0.00 2.41 2.21 0.00 177 P 0.00 2.97 0.00 1.76 1.53 0.00 3.50 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.90 0.00 178 G 6.22 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 0.00 179 G 8.59 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 0.00 0.00 0.00 180 I 7.75 5.17 1.58 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.62 0.77 0.00 0.00 181 K 9.34 4.77 0.00 1.74 1.56 0.00 1.46 0.00 0.00 1.54 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.62 1.36 7.81 182 I 8.04 4.86 1.74 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 1.08 0.61 0.88 0.00 0.00 183 T 8.64 4.72 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 0.00 184 S 7.84 4.70 0.00 3.88 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 0.00 185 A 8.60 5.10 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 0.00 186 T 8.81 4.73 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 187 V 8.09 4.08 1.72 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 0.61 0.00 0.00 -0.18 0.00 0.00 188 G 9.11 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 R 8.13 4.81 0.00 1.78 1.89 0.00 3.02 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 190 V 8.23 3.95 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 0.76 0.00 0.00 0.91 0.00 0.00 191 I 8.90 4.55 1.83 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.90 0.88 0.00 0.00 192 D 8.59 4.66 0.00 2.59 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 0.00 193 L 8.60 4.44 0.00 1.66 1.64 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 194 G 8.59 3.65 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 0.00 0.00 0.00 195 I 7.33 4.23 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 1.46 1.73 0.91 0.00 0.00 196 T 8.22 4.13 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 1.27 0.00 0.00 197 D 8.03 4.34 0.00 2.73 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 0.00 198 S 8.80 4.40 0.00 4.23 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 Q 8.12 4.07 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.16 0.00 200 D 8.00 4.54 0.00 2.78 2.58 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 *202 G 8.61 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 0.00 203 S 8.01 4.20 0.00 4.02 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 0.00 204 A 7.41 4.25 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 *206 A 8.01 4.40 1.39 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 0.00 0.00 207 P 0.00 4.20 0.00 2.14 2.09 0.00 3.73 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 208 A 7.88 3.91 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 0.00 209 A 7.92 3.89 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 0.00 210 A 8.10 3.86 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 0.00 211 D 8.15 4.22 0.00 2.87 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 0.00 212 T 7.80 3.81 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 213 I 7.83 3.60 1.88 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 0.67 0.84 0.00 0.00 214 K 8.24 3.86 0.00 1.81 2.02 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.42 1.44 7.81 215 Q 8.28 3.91 0.00 2.27 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.54 0.00 216 H 8.51 4.05 0.00 3.27 3.46 0.00 5.83 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 0.00 217 L 7.96 4.03 0.00 1.89 1.95 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 218 E 8.39 3.91 0.00 2.11 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 0.00 2.29 2.34 0.00 219 D 8.56 4.38 0.00 2.82 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 L 7.63 4.52 0.00 1.59 1.67 0.81 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 221 G 7.78 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 0.00 222 R 8.33 4.83 0.00 1.88 2.08 0.00 3.24 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.72 0.00 223 T 9.29 4.84 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 1.24 0.00 0.00 224 P 0.00 4.40 0.00 2.25 2.20 0.00 3.65 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.13 0.00 225 D 7.73 4.70 0.00 2.65 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 0.00 226 D 8.23 4.52 0.00 2.75 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 0.00 0.00 0.00 0.00 227 Y 8.12 4.75 0.00 3.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 D 9.03 4.68 0.00 2.73 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 0.00 229 L 7.73 4.61 0.00 1.76 1.51 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 230 I 8.88 4.52 1.88 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 0.89 0.88 0.87 0.00 0.00 231 L 9.07 5.12 0.00 1.72 1.53 0.93 0.52 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 0.00 232 T 8.10 5.15 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 1.25 0.00 0.00 233 G 8.19 4.80 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 0.00 0.00 0.00 234 D 8.17 4.87 0.00 2.59 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 L 8.54 4.17 0.00 1.89 1.66 0.91 0.79 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 0.00 236 S 8.49 3.64 0.00 4.01 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 0.00 237 G 8.97 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 0.00 238 V 7.97 3.71 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 0.96 0.00 0.00 0.93 0.00 0.00 239 G 8.05 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 0.00 240 S 7.98 4.15 0.00 3.99 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 0.00 241 P 0.00 4.24 0.00 2.14 2.10 0.00 3.72 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 242 I 7.26 3.68 2.01 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 251 G 8.15 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 0.00 252 I 8.08 4.23 2.00 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 1.30 1.27 0.90 0.00 0.00 253 N 8.56 4.93 0.00 2.69 2.78 0.00 0.00 7.22 7.68 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 0.00 254 V 8.37 3.87 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 0.73 0.00 0.00 0.92 0.00 0.00 255 G 7.56 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 0.00 256 T 8.64 4.48 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 1.22 0.00 0.00 257 K 8.46 4.15 0.00 2.23 1.94 0.00 1.57 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.59 1.48 7.81 258 H 7.92 5.28 0.00 3.15 3.19 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 N 8.45 4.86 0.00 2.74 2.50 0.00 0.00 6.59 8.47 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 0.00 260 D 8.33 5.39 0.00 2.71 2.44 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 0.00 261 C 9.02 4.08 0.00 2.90 2.90 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 0.00 262 G 8.52 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 0.00 263 L 7.49 4.56 0.00 1.73 1.67 0.92 0.58 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 *265 I 7.69 4.05 1.65 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 1.32 0.16 0.00 0.00 266 Y 7.28 5.02 0.00 3.02 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 267 T 8.36 4.53 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 1.26 0.00 0.00 268 P 0.00 4.24 0.00 2.21 2.13 0.00 3.78 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 269 D 8.92 4.21 0.00 2.81 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *279 C 8.13 4.50 0.00 2.98 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 0.00 280 A 7.58 4.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 281 C 7.52 4.51 0.00 3.00 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 0.00 282 S 7.92 3.94 0.00 3.78 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 0.00 283 A 7.56 3.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 284 V 7.34 3.53 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 0.70 0.00 0.00 0.87 0.00 0.00 285 V 7.63 3.56 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 1.07 0.00 0.00 0.89 0.00 0.00 286 T 7.50 3.55 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 0.59 0.00 0.00 287 F 7.56 3.33 0.00 2.80 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 288 A 8.04 4.17 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 289 H 8.21 4.64 0.00 2.98 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 290 I 7.43 3.61 1.88 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 1.67 0.58 0.95 0.00 0.00 291 F 8.34 4.50 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 0.00 292 K 8.12 4.03 0.00 1.96 1.87 0.00 1.61 0.00 0.00 1.80 0.00 0.00 3.10 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.56 1.66 7.81 293 E 8.32 4.00 0.00 2.15 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 294 I 7.93 4.35 2.06 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 1.62 2.17 0.97 0.00 0.00 295 E 8.25 3.99 0.00 2.09 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 2.34 2.51 0.00 296 A 8.00 4.28 1.39 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 0.00 0.00 297 G 8.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 298 R 7.87 4.33 0.00 1.93 2.00 0.00 3.12 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 299 L 7.56 4.87 0.00 1.68 1.54 0.93 0.70 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 0.00 300 N 9.61 4.82 0.00 2.79 2.83 0.00 0.00 6.23 7.21 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 0.00 301 R 8.01 5.17 0.00 1.81 1.66 0.00 2.73 0.00 0.00 2.49 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 302 V 9.31 5.06 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 1.14 0.00 0.00 1.05 0.00 0.00 303 L 8.79 4.92 0.00 1.29 1.16 0.65 0.37 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 0.00 304 V 8.93 4.90 2.48 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 1.02 0.00 0.00 1.13 0.00 0.00 305 V 9.05 4.81 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 0.86 0.00 0.00 0.85 0.00 0.00 306 A 8.83 4.84 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 0.00 307 T 8.89 5.02 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 0.00 308 G 9.07 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 309 A 8.54 4.63 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 310 L 8.66 4.41 0.00 1.52 1.55 0.86 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 311 L 7.27 4.75 0.00 1.47 1.50 0.38 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 312 S 7.74 4.57 0.00 3.96 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 0.00 313 P 0.00 4.77 0.00 0.89 1.26 0.00 3.69 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.68 0.00 314 T 7.72 3.85 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 1.24 0.00 0.00 315 I 7.50 3.69 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.87 0.00 0.00 316 I 7.98 3.67 1.98 0.00 0.00 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 1.67 0.96 0.97 0.00 0.00 317 Q 8.44 3.98 0.00 2.25 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.05 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 318 Q 7.85 4.20 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.64 0.00 0.00 0.00 0.00 0.00 2.41 2.53 0.00 319 K 8.14 3.81 0.00 1.80 1.83 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.58 1.54 7.81 320 E 7.74 4.54 0.00 1.90 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 2.32 2.25 0.00 321 S 8.56 4.27 0.00 4.12 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 0.00 322 I 7.83 4.40 1.86 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 1.26 0.82 0.87 0.00 0.00 323 P 0.00 4.62 0.00 2.07 2.15 0.00 3.59 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 2.14 1.97 0.00 324 C 9.08 5.34 0.00 2.78 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 0.00 325 I 8.48 4.89 1.79 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.55 0.80 0.00 0.00 326 A 8.38 5.15 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 0.00 327 H 9.07 5.24 0.00 3.03 3.06 0.00 5.56 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 0.00 328 G 9.00 4.49 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 0.00 329 V 8.71 4.87 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 0.38 0.00 0.00 0.98 0.00 0.00 330 V 8.78 4.75 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 1.09 0.00 0.00 1.11 0.00 0.00 331 F 9.30 5.45 0.00 3.23 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 332 E 9.38 5.30 0.00 1.84 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 2.27 2.30 0.00 333 R 8.61 4.38 0.00 1.88 1.86 0.00 3.44 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 334 A 8.37 4.38 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 * Residues marked with a * may have inaccurate shift predictions.