NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2099 8.1233 123.5776 53.1288 18.5345 178.8281 3 N 3.3086 6.5479 114.4547 53.0280 39.8885 173.9776 4 T 3.8062 7.9291 114.0977 65.6137 68.2484 176.3224 5 R 3.9633 7.9107 120.0515 59.3401 30.1566 178.6274 6 V 3.7461 8.1883 112.5978 63.8374 31.5393 178.4929 7 I 3.7784 8.0110 120.0955 64.5157 36.9874 178.0465 8 E 3.9453 8.0817 118.8491 59.5500 29.2948 179.4027 9 L 4.0332 7.7452 118.7805 57.8501 41.6472 179.5625 10 F 4.3031 8.5111 120.5741 61.4187 39.4033 176.9535 11 D 4.2194 8.1815 118.5489 57.3195 40.6374 178.3160 12 E 3.9096 8.3118 119.8159 59.1793 29.5681 178.6474 13 F 4.0650 8.8443 121.1641 61.5868 39.5148 176.9730 14 T 3.4317 8.1788 116.1924 66.8806 68.2174 176.2431 15 D 4.2860 7.9670 120.4398 56.9499 40.7343 178.5834 16 L 3.8341 7.5748 120.8775 58.3393 42.1808 179.2212 17 I 3.5765 7.3650 119.6828 64.2400 36.9476 178.6870 18 R 3.8739 7.8493 118.9494 59.3281 29.8522 178.5660 19 D 4.3592 8.0420 117.8033 57.1324 41.1293 178.1623 20 F 3.9888 8.1545 121.1416 61.3748 39.4927 176.8581 21 I 3.7617 8.4265 119.8808 64.7393 36.9415 178.4042 22 V 3.4756 8.2160 118.9683 65.9955 31.2260 177.9441 23 R 3.7543 7.7401 116.8494 59.6104 29.9616 177.6236 24 H 4.3802 7.6986 110.9477 54.9941 29.4439 174.8009 25 E 3.7601 7.8706 118.6306 57.2125 27.2142 175.6941 26 I 3.9563 7.6959 118.6260 61.7240 38.1671 177.9478 27 T 4.3612 8.9239 116.7349 60.8407 71.2120 176.1437 28 T 3.9443 8.2961 117.1027 66.5383 68.4997 174.9786 29 P 4.2793 0.0000 0.0000 65.6491 31.2736 178.4767 30 E 3.9885 8.1877 117.1101 59.5595 29.3464 178.7754 31 Y 4.2024 8.2537 119.4647 60.9511 38.8337 178.0259 32 E 3.8079 8.5926 119.6682 59.4380 29.4545 179.6473 33 T 3.8261 7.8782 115.8755 66.6264 68.5299 176.5848 34 I 3.6946 7.8990 122.0062 64.7036 37.2283 177.9079 35 M 3.8883 8.1042 119.0350 58.8870 31.9234 178.1443 36 Q 3.9634 8.2327 118.2522 59.2539 29.0037 178.4189 37 Y 3.9789 8.4938 120.8153 60.9073 38.6887 177.9868 38 M 4.0092 8.3301 119.7553 58.2718 31.9759 178.6943 39 I 3.6432 7.7676 119.7367 64.7974 37.3617 178.5642 40 S 3.9089 7.9895 116.2693 61.7521 62.5276 177.3943 41 V 3.1637 6.9476 120.4710 65.3800 30.7660 178.2498 42 G 3.5635 7.0234 104.3369 48.0001 0.0000 175.2587 43 E 4.0843 8.1449 120.2587 58.1984 29.6588 177.4224 44 A 4.2877 7.6604 121.1204 51.7944 19.4442 176.7082 45 G 4.1510 8.2636 106.1032 46.3992 0.0000 174.9944 46 E 4.5192 7.7134 118.2011 55.5238 30.3450 177.2945 47 W 4.7424 7.9780 120.1320 59.7617 29.2110 176.1703 48 P 4.4368 0.0000 0.0000 65.6026 30.7625 178.4803 49 L 3.8490 7.9118 118.6849 57.6371 42.2435 178.6625 50 W 3.9951 9.2654 129.5070 60.6566 30.7824 177.9928 51 L 4.6482 9.1848 119.4203 58.2827 40.6373 179.4018 52 D 4.4510 8.4100 118.6475 57.0892 40.8395 178.6439 53 A 3.4711 7.8864 121.4814 54.4238 18.0145 179.0501 54 F 4.2680 7.2972 113.7480 57.8665 40.4334 176.8021 55 F 5.2219 8.3905 115.0930 57.0360 41.3088 176.9612 56 E 4.0235 7.9999 121.4455 59.2716 29.1802 178.1262 57 T 3.8861 8.0797 112.8308 65.6634 66.8885 175.5805 58 T 4.0429 7.6815 115.7842 66.3580 68.8334 176.5748 59 V 3.7384 7.7488 120.0419 66.1735 31.3621 177.3861 60 D 4.3875 8.6111 118.3007 57.3693 41.0218 178.2161 61 S 4.3173 7.7501 112.9712 60.3640 62.9370 175.5101 62 V 3.9436 7.2156 120.3538 65.2730 31.8082 177.2752 63 S 4.3360 7.9725 111.8440 60.2815 62.2529 173.1830 64 Y 4.3775 7.4614 119.2071 58.7771 40.4139 173.8471 65 G 3.8301 8.2717 111.7999 45.2296 0.0000 174.0721 *66 K 4.3719 8.1051 122.6844 53.5353 33.5344 177.3382 67 G 4.3460 7.9976 102.9205 47.6848 0.0000 173.2243 68 N 4.6853 8.8973 119.7053 53.0952 38.1859 175.3095 69 W 4.5095 8.6756 119.0889 57.4705 30.1797 175.4533 70 T 4.5395 9.0441 118.7877 63.2046 68.7040 175.4134 71 S 4.5972 9.0660 123.2679 58.8163 63.4646 174.6124 72 S 4.6000 9.0113 119.4952 58.6405 64.2008 172.4029 73 A 4.8423 8.6017 120.7916 50.4561 22.2931 176.3351 74 I 3.6727 8.3806 112.9686 61.6610 37.4459 176.2937 75 Q 3.9643 9.1142 125.8680 57.3502 29.2710 177.0554 76 G 3.8053 8.6068 105.2789 44.5256 0.0000 170.9708 77 P 4.4993 0.0000 0.0000 62.4306 31.1826 175.9958 78 F 3.8933 7.3875 114.5460 57.1353 39.5174 175.2421 79 F 3.3644 7.9112 122.8853 57.4665 39.7451 174.6206 80 K 3.9386 6.3497 124.5692 53.9781 34.6445 176.3856 81 E 3.6785 7.9461 123.3823 57.1020 30.0410 176.1838 82 G 3.6515 8.4296 106.4002 46.6360 0.0000 174.0828 83 A 3.0977 7.5748 119.9470 50.1271 19.7295 176.5871 84 P 4.2051 0.0000 0.0000 62.3673 32.9054 175.2139 85 L 4.5976 8.4425 126.0300 54.9586 42.5738 175.5483 86 L 4.8725 8.7133 127.2692 52.9348 43.6858 176.8876 87 T 4.6561 8.3256 111.7880 61.2246 69.6756 174.1146 88 G 3.9351 8.2371 110.4318 46.4311 0.0000 174.5297 89 K 4.1794 8.5570 118.7432 58.7765 32.5346 177.4019 90 P 4.1426 0.0000 0.0000 64.4076 31.4985 173.9440 91 A 3.6317 8.1638 124.4011 52.2028 14.7402 175.4265 92 T 5.2992 7.7668 115.5896 61.4256 71.5073 174.1176 93 L 4.2919 8.6863 125.9292 53.9688 42.6566 175.3598 94 P 4.5268 0.0000 0.0000 63.3913 32.0084 175.2600 95 M 5.0597 8.4364 120.8980 53.0878 34.6165 174.7553 96 R 4.1492 8.2922 116.1227 55.1510 30.6948 175.7031 97 A 4.1643 8.4043 121.5460 54.0739 18.6269 176.9790 98 D 4.3896 8.7380 120.0267 54.9578 38.7105 173.5571 99 E 3.7654 7.8547 117.1333 55.9739 29.5857 176.0812 100 P 4.2563 0.0000 0.0000 63.2048 31.9797 176.1411 101 G 3.9952 8.3715 104.2206 45.6658 0.0000 172.8599 102 D 4.4710 8.1285 117.9166 53.9940 42.1429 176.7710 103 R 4.1288 7.9913 120.3465 56.3579 31.6739 175.1696 104 M 5.2065 8.4191 120.5757 54.0427 36.3520 173.4722 105 R 5.2382 9.0067 125.6242 54.5390 33.2107 173.8528 106 F 5.4322 8.9382 128.6825 56.5400 42.1363 174.0643 107 T 5.4363 7.7427 114.6492 58.4883 72.6676 174.1386 108 G 4.6313 7.6843 106.4325 46.1458 0.0000 171.3626 109 S 5.0756 7.8691 112.9313 57.0472 67.1805 173.5287 110 V 4.7541 8.5144 121.3291 61.1463 32.6562 174.3891 111 R 5.0249 8.6494 125.1219 53.9960 34.0201 175.7218 112 D 5.0483 8.2739 120.2374 52.6035 41.9719 176.8298 113 T 3.7367 8.6086 114.7889 67.4202 68.3372 176.1511 114 S 4.0878 7.8246 115.6705 60.2344 62.8505 175.5676 115 G 4.0152 7.9571 107.1057 45.0602 0.0000 173.4510 116 T 4.1364 7.9409 111.2142 60.0185 69.3035 172.4914 117 P 4.6349 0.0000 0.0000 62.8427 31.9014 176.8016 118 I 4.1731 8.9010 125.4650 59.8107 35.9380 176.5596 119 T 3.8984 8.2779 116.2083 64.2287 68.9945 176.2038 120 G 3.8665 8.0340 108.2249 45.6690 0.0000 173.1698 121 A 4.4773 7.5219 122.2079 51.6816 19.4085 177.7693 122 V 4.4643 8.7674 121.0858 60.8632 34.8353 174.2332 123 I 4.9299 8.8254 121.9455 59.0734 39.8427 174.5239 124 D 5.2224 9.2431 128.8826 53.9593 42.2948 175.9924 125 V 5.6665 9.4872 122.7972 58.6224 34.6036 174.5569 126 W 6.3000 8.8164 120.2999 54.8172 31.8472 173.2207 127 H 5.2401 8.6470 115.9278 55.0176 30.6921 173.1437 128 S 3.7493 8.2677 113.9324 57.3554 63.9347 173.8510 129 T 4.1896 8.1634 112.3921 60.7255 69.1938 175.1089 130 N 4.3047 8.6525 119.6029 56.5373 38.9207 175.8353 131 D 4.4449 7.9633 115.9797 55.2279 41.6117 176.4754 132 G 4.1041 8.2111 107.1022 45.7832 0.0000 172.7779 133 N 4.8401 8.0133 115.7817 51.0337 41.8631 173.2419 134 Y 4.7605 8.0135 119.1417 55.8440 39.7166 175.6458 135 S 4.2079 8.5414 118.7989 60.1090 63.2895 174.7065 136 F 4.7263 7.6992 119.5421 58.7026 37.9434 175.4756 137 F 4.8926 7.6219 118.4935 56.3295 40.0274 174.8095 138 S 4.5105 7.7261 112.3901 56.7116 65.1286 173.6216 139 P 4.1594 0.0000 0.0000 65.6341 31.1905 177.2343 140 A 4.2169 7.5522 118.0913 53.0048 18.3978 177.0499 141 L 4.7476 7.4743 115.5911 51.5779 44.9638 174.8937 142 P 4.1092 0.0000 0.0000 63.3477 32.5658 176.4556 143 D 3.9986 8.0420 122.2204 53.2613 39.7047 175.3146 144 Q 4.2928 6.1630 116.6962 53.5638 33.3295 175.4799 145 Y 4.3637 8.3943 117.2790 58.3390 37.5660 175.8365 146 L 4.9332 8.0552 124.4659 54.2123 45.7882 176.7980 147 L 3.9739 9.4809 122.6626 55.6056 40.0193 174.0870 148 R 5.2699 7.4278 115.0375 54.6394 34.1358 175.1341 149 G 4.0219 8.2528 108.4698 46.1183 0.0000 172.0489 150 R 5.2894 8.7200 119.3475 54.1501 33.5065 175.3671 151 V 4.7000 8.9157 122.8242 61.0456 35.1397 174.0705 152 V 4.8281 8.3409 126.6584 60.2175 33.4290 173.6244 153 P 4.5853 0.0000 0.0000 62.1852 32.3002 176.0318 154 A 4.2401 8.5287 123.2136 51.8582 18.8170 178.7710 155 E 4.2382 8.7489 117.9672 58.6393 29.5402 177.5427 156 D 4.6024 7.9180 117.5943 53.1193 40.3155 175.6054 157 G 4.3168 9.0022 112.7514 46.1321 0.0000 174.4938 158 S 4.7585 7.6531 113.7185 58.8542 64.0298 173.6428 159 I 5.1620 9.1268 114.5333 59.5834 41.1747 173.7135 160 E 5.9800 9.0517 123.1512 55.4985 32.6330 173.9206 161 F 5.4453 8.6264 119.8351 56.0180 41.9691 172.5971 162 H 5.6060 9.2933 117.2768 55.1542 31.8651 174.2046 163 S 4.9338 8.6752 114.2120 58.2942 66.2120 173.3928 164 I 4.6986 8.3538 111.7295 59.1290 40.0371 175.3893 165 R 3.9250 8.4312 124.8782 55.5506 30.1167 174.9003 166 P 4.4673 0.0000 0.0000 62.8134 32.0600 175.5539 167 V 4.7181 7.9033 112.9639 58.5112 35.7529 173.6265 168 P 4.6974 0.0000 0.0000 62.7218 31.7806 175.6039 169 Y 5.0830 8.2201 121.1219 55.2074 41.8839 173.4986 170 E 4.4752 8.3223 120.6087 54.2152 31.3496 175.2434 171 I 4.0605 8.5690 128.6842 60.1645 38.1553 174.2425 172 P 4.0307 0.0000 0.0000 63.5287 31.6475 177.6646 *173 K 3.8374 8.8341 124.7945 57.4784 31.5907 174.1903 174 A 4.3575 7.8270 119.6427 53.2694 18.9833 178.4530 175 G 3.8313 7.7704 104.2326 43.3934 0.0000 172.4306 176 P 4.7182 0.0000 0.0000 66.0798 31.2374 179.1779 177 T 4.3254 8.5705 114.2257 66.6684 68.3879 176.8172 178 G 3.9519 8.0375 108.3507 47.4553 0.0000 175.0893 179 Q 3.7367 9.2817 121.4952 58.5634 28.7522 179.2738 180 L 4.0817 8.1607 120.9287 58.5742 42.1364 178.9874 181 M 4.1556 8.4090 118.9255 57.6960 31.8307 178.0663 182 N 4.4550 8.7947 117.0936 55.9802 39.5902 176.9989 183 S 4.1375 7.8171 114.9868 61.1791 62.2682 175.6771 184 Y 4.3804 6.7705 119.7588 60.8840 38.1438 177.2848 185 L 4.1794 8.1425 118.1479 54.8660 42.3153 176.7797 186 G 4.3104 7.4568 105.8235 47.2914 0.0000 173.9361 187 R 4.7001 8.1128 121.7189 56.0420 30.9074 175.9117 188 H 5.1489 8.4896 122.1275 55.2877 31.9344 172.8133 189 S 4.7419 8.3910 111.0424 57.8677 64.1996 173.3152 190 W 4.6398 8.3454 120.4467 57.1026 29.7888 175.6160 191 R 4.5970 8.8386 123.7081 53.9267 31.8641 174.3923 192 P 4.8405 0.0000 0.0000 62.2636 32.6171 175.8577 193 A 4.4549 9.4244 123.7497 53.1799 19.4166 176.2890 194 H 5.1143 8.4087 114.1562 55.6301 31.3865 172.5476 195 I 4.3868 7.6563 119.4463 59.5328 40.7878 174.0622 196 H 4.5165 8.5474 126.1779 55.0625 30.2719 174.4559 197 I 5.0592 8.0031 121.4995 59.7859 41.7983 174.0208 198 R 5.0208 9.4938 127.0024 54.5180 33.3973 173.9205 199 I 4.9804 8.9986 126.6776 59.8067 40.5258 174.4604 200 T 5.0838 8.6873 123.1350 61.8045 71.7160 173.2919 201 A 4.9302 8.3402 125.6891 50.3906 23.0114 175.2518 202 D 4.4300 8.9094 122.6308 56.0957 40.8044 176.7542 203 G 3.8262 9.3604 112.0292 45.8350 0.0000 171.8199 204 Y 4.8288 7.6983 115.0702 55.5516 41.7437 175.4937 205 R 4.2605 8.8986 121.9950 55.3478 30.8633 175.0286 206 P 4.6220 0.0000 0.0000 63.0421 32.4306 175.3502 207 L 4.5196 8.7355 124.3607 53.2144 45.1737 175.0083 208 I 4.8850 7.8563 126.0547 60.1434 40.5948 174.7063 209 T 4.6016 8.5318 120.0933 62.0944 71.0428 171.5472 210 Q 4.7771 8.2729 118.1352 54.3910 33.1560 174.4099 211 L 4.3702 8.1462 121.7135 53.1019 44.8730 175.7524 212 Y 4.7456 8.2338 120.8912 55.3038 41.9009 174.2635 213 F 5.3569 8.2874 117.7148 55.4839 42.5440 174.9213 214 E 3.9894 9.1711 124.5829 58.3506 29.7918 177.8398 215 G 3.9873 8.9995 114.0145 45.1108 0.0000 173.1740 216 D 4.3660 8.0155 120.6057 53.7363 41.4217 175.4174 217 P 4.0747 0.0000 0.0000 65.0693 31.4895 176.4169 218 Y 4.6802 7.9957 115.4707 57.5259 38.4385 177.3425 219 L 3.8850 7.7576 121.5811 57.2351 41.7456 177.8493 220 D 5.0049 7.9955 115.7067 53.8363 41.3125 176.2373 221 S 4.6984 7.9295 113.3560 57.2061 63.5707 173.7504 222 D 4.3669 8.4750 120.5164 55.8639 41.1889 177.3261 223 S 4.1214 8.3558 121.4111 60.6833 63.1917 174.7466 224 C 4.8382 8.4406 116.5267 57.8034 28.3920 173.5509 225 S 3.6124 7.4560 114.1792 60.0002 60.3936 172.6802 226 A 4.5927 8.0068 119.9050 51.7512 20.0180 177.7225 227 V 3.4890 7.3845 116.2139 61.8980 32.4188 175.2946 228 K 4.5682 8.3594 125.0840 54.3629 34.8239 176.8363 229 S 3.8810 8.9960 118.8522 61.6459 62.3017 176.1555 230 E 4.2104 8.2628 117.9845 58.5721 29.5337 177.1712 231 L 4.7393 8.8297 118.7167 54.2672 43.0024 175.9415 232 V 4.7315 7.4790 118.2749 60.2167 33.1824 175.2416 233 L 4.7963 8.9434 124.6106 52.3750 43.7770 174.3042 234 P 5.2617 0.0000 0.0000 62.3960 32.0574 176.1153 235 V 4.5268 8.4178 123.3719 59.9732 33.7174 174.4308 236 N 4.6273 8.7110 125.6936 52.3255 40.1895 173.7813 237 K 4.7014 8.7225 128.6774 55.4389 32.7793 175.1397 238 I 4.4382 8.6824 129.1356 59.7904 39.7583 175.2269 239 D 5.0122 8.4896 126.3615 52.7963 40.1202 175.8877 240 I 4.0177 8.8979 121.0559 60.7864 35.5227 173.9293 241 D 4.1938 7.5591 121.6733 53.1799 41.2426 176.2506 242 G 4.2183 8.9978 119.2563 45.0522 0.0000 172.8782 243 E 4.4580 7.9829 120.5683 54.1747 30.7310 175.4758 244 T 5.0418 8.1010 119.8725 59.5853 66.7462 173.9518 245 W 4.4599 8.8494 127.4657 56.5527 31.1678 174.8787 246 Q 4.9521 9.0635 121.4787 54.3265 31.4657 174.3154 247 L 5.2392 8.7964 124.6704 53.3742 44.1314 176.3122 248 V 4.8368 8.7337 115.2914 59.8841 36.4363 173.9280 249 D 4.9735 8.5648 121.3935 52.7846 44.5291 174.2915 250 F 4.5541 8.6477 126.2284 57.0170 43.5182 172.4658 251 N 4.8984 7.4686 123.4291 51.5061 39.9646 174.3935 252 F 4.6840 9.3128 124.9075 57.1128 40.3752 174.9289 253 I 5.3836 9.1041 125.4229 59.0407 39.1418 175.0429 254 L 5.0396 8.5884 127.8072 53.9120 44.5664 176.7286 *255 Q 4.0315 9.3852 120.8789 56.3432 28.8736 177.1186 *256 H 4.4568 8.5814 114.4555 55.1024 28.0280 177.0759 257 N 4.4337 7.8513 118.5647 52.2675 37.5814 174.5764 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 A 8.12 4.21 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 N 6.55 3.31 0.00 2.93 2.76 0.00 0.00 6.62 6.17 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 4 T 7.93 3.81 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 5 R 7.91 3.96 0.00 1.96 2.03 0.00 3.28 0.00 0.00 3.34 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 6 V 8.19 3.75 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 0.73 0.00 0.00 0.86 0.00 0.00 7 I 8.01 3.78 2.08 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 1.56 0.85 0.95 0.00 0.00 8 E 8.08 3.95 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 2.35 2.51 0.00 9 L 7.75 4.03 0.00 1.68 1.75 0.91 1.19 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 10 F 8.51 4.30 0.00 3.13 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.18 4.22 0.00 2.92 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 12 E 8.31 3.91 0.00 2.26 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 0.00 2.33 2.37 0.00 13 F 8.84 4.06 0.00 3.15 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 14 T 8.18 3.43 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 1.03 0.00 0.00 15 D 7.97 4.29 0.00 2.76 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 L 7.57 3.83 0.00 1.81 1.59 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 17 I 7.36 3.58 1.45 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 -0.36 0.78 0.00 0.00 18 R 7.85 3.87 0.00 1.79 1.92 0.00 3.06 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.79 0.00 19 D 8.04 4.36 0.00 2.83 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 20 F 8.15 3.99 0.00 3.30 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 21 I 8.43 3.76 2.04 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 1.50 0.64 0.87 0.00 0.00 22 V 8.22 3.48 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 0.98 0.00 0.00 0.94 0.00 0.00 23 R 7.74 3.75 0.00 1.62 1.68 0.00 3.14 0.00 0.00 3.62 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 24 H 7.70 4.38 0.00 2.85 3.10 0.00 5.81 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 25 E 7.87 3.76 0.00 2.05 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 2.22 2.39 0.00 26 I 7.70 3.96 1.94 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 1.54 0.44 1.03 0.00 0.00 27 T 8.92 4.36 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 1.31 0.00 0.00 28 T 8.30 3.94 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 1.32 0.00 0.00 29 P 0.00 4.28 0.00 2.18 2.12 0.00 3.58 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 30 E 8.19 3.99 0.00 2.34 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 2.35 2.34 0.00 31 Y 8.25 4.20 0.00 3.04 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.59 3.81 0.00 2.29 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 2.31 2.36 0.00 33 T 7.88 3.83 4.38 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 1.13 0.00 0.00 34 I 7.90 3.69 2.03 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.58 0.96 0.00 0.00 35 M 8.10 3.89 0.00 1.95 1.61 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.50 0.00 36 Q 8.23 3.96 0.00 2.43 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 37 Y 8.49 3.98 0.00 3.00 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 38 M 8.33 4.01 0.00 2.31 2.31 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.81 0.00 39 I 7.77 3.64 1.98 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 1.52 0.80 0.93 0.00 0.00 40 S 7.99 3.91 0.00 3.65 3.54 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 41 V 6.95 3.16 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 -0.19 0.00 0.00 42 G 7.02 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.14 4.08 0.00 1.85 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 0.00 2.32 2.29 0.00 44 A 7.66 4.29 1.21 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 9.04 4.54 4.70 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 1.67 0.00 0.00 71 S 9.07 4.60 0.00 3.95 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 72 S 9.01 4.60 0.00 3.81 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 73 A 8.60 4.84 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.38 3.67 2.04 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 1.24 0.63 0.94 0.00 0.00 75 Q 9.11 3.96 0.00 2.05 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.81 0.00 0.00 0.00 0.00 0.00 2.46 2.56 0.00 76 G 8.61 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 P 0.00 4.50 0.00 1.63 1.84 0.00 2.72 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.42 0.00 78 F 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.33 4.66 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 88 G 8.24 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 89 K 8.56 4.18 0.00 1.78 1.89 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.47 7.81 90 P 0.00 4.14 0.00 2.10 2.18 0.00 3.76 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 91 A 8.16 3.63 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 92 T 7.77 5.30 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 93 L 8.69 4.29 0.00 1.65 1.66 0.89 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.53 0.00 2.33 2.25 0.00 3.77 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 2.21 2.04 0.00 95 M 8.44 5.06 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.65 0.00 96 R 8.29 4.15 0.00 2.00 2.08 0.00 2.94 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 97 A 8.40 4.16 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 D 8.74 4.39 0.00 2.80 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 7.85 3.77 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.44 0.00 100 P 0.00 4.26 0.00 2.15 2.04 0.00 3.70 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 101 G 8.37 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 0.00 102 D 8.13 4.47 0.00 2.52 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 0.00 103 R 7.99 4.13 0.00 0.67 0.66 0.00 2.99 0.00 0.00 2.69 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.07 0.00 104 M 8.42 5.21 0.00 1.92 1.73 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.54 0.00 105 R 9.01 5.24 0.00 2.33 1.93 0.00 3.24 0.00 0.00 2.99 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.73 0.00 106 F 8.94 5.43 0.00 2.68 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 0.00 107 T 7.74 5.44 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 108 G 7.68 4.63 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 0.00 109 S 7.87 5.08 0.00 3.87 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 0.00 110 V 8.51 4.75 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 0.94 0.00 0.00 1.03 0.00 0.00 111 R 8.65 5.02 0.00 1.78 1.67 0.00 3.15 0.00 0.00 3.50 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 112 D 8.27 5.05 0.00 3.09 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 0.00 113 T 8.61 3.74 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 114 S 7.82 4.09 0.00 3.98 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 0.00 115 G 7.96 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 T 7.94 4.14 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 1.36 0.00 0.00 117 P 0.00 4.63 0.00 2.07 2.13 0.00 3.67 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 2.05 2.11 0.00 118 I 8.90 4.17 1.66 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 0.75 1.15 0.55 0.00 0.00 119 T 8.28 3.90 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 120 G 8.03 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 A 7.52 4.48 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 V 8.77 4.46 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 1.00 0.00 0.00 0.94 0.00 0.00 123 I 8.83 4.93 1.70 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.02 0.90 0.00 0.00 124 D 9.24 5.22 0.00 2.96 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 0.00 125 V 9.49 5.67 1.84 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 0.12 0.00 0.00 0.55 0.00 0.00 126 W 8.82 6.30 0.00 3.58 3.37 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 0.00 127 H 8.65 5.24 0.00 3.23 3.28 0.00 5.52 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 S 8.27 3.75 0.00 3.52 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 T 8.16 4.19 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 1.22 0.00 0.00 130 N 8.65 4.30 0.00 2.93 2.86 0.00 0.00 6.51 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 0.00 131 D 7.96 4.44 0.00 2.64 2.64 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 0.00 132 G 8.21 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 N 8.01 4.84 0.00 2.67 2.58 0.00 0.00 6.97 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 Y 8.01 4.76 0.00 2.73 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 S 8.54 4.21 0.00 3.81 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 F 7.70 4.73 0.00 2.81 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 0.00 137 F 7.62 4.89 0.00 2.81 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 S 7.73 4.51 0.00 3.75 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 P 0.00 4.16 0.00 2.04 2.07 0.00 3.70 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 140 A 7.55 4.22 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 0.00 141 L 7.47 4.75 0.00 1.63 1.39 0.87 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 4.11 0.00 1.98 1.84 0.00 3.47 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 2.02 2.03 0.00 143 D 8.04 4.00 0.00 2.52 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 Q 6.16 4.29 0.00 1.77 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.38 7.07 0.00 0.00 0.00 0.00 0.00 2.01 2.17 0.00 145 Y 8.39 4.36 0.00 3.06 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 0.00 146 L 8.06 4.93 0.00 1.60 1.48 0.83 0.67 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 0.00 147 L 9.48 3.97 0.00 1.80 1.38 0.90 0.32 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 0.00 148 R 7.43 5.27 0.00 1.98 2.03 0.00 3.56 0.00 0.00 3.63 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.00 0.00 149 G 8.25 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 R 8.72 5.29 0.00 1.74 1.78 0.00 3.08 0.00 0.00 3.08 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 151 V 8.92 4.70 2.11 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 1.09 0.00 0.00 1.02 0.00 0.00 152 V 8.34 4.83 2.11 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 0.92 0.00 0.00 0.95 0.00 0.00 153 P 0.00 4.59 0.00 2.29 2.14 0.00 3.97 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.98 0.00 154 A 8.53 4.24 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 0.00 155 E 8.75 4.24 0.00 2.10 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 0.00 2.29 2.32 0.00 156 D 7.92 4.60 0.00 2.81 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 0.00 157 G 9.00 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 0.00 158 S 7.65 4.76 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 9.13 5.16 2.17 0.00 0.00 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 1.46 1.24 1.06 0.00 0.00 160 E 9.05 5.98 0.00 2.00 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 2.27 2.30 0.00 161 F 8.63 5.45 0.00 3.34 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 0.00 162 H 9.29 5.61 0.00 3.30 3.42 0.00 5.67 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 S 8.68 4.93 0.00 4.30 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 0.00 164 I 8.35 4.70 1.86 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 1.24 0.74 0.90 0.00 0.00 165 R 8.43 3.92 0.00 1.63 1.72 0.00 3.21 0.00 0.00 3.02 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.12 0.00 166 P 0.00 4.47 0.00 2.29 2.03 0.00 3.66 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 2.15 1.70 0.00 167 V 7.90 4.72 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.05 0.00 0.00 168 P 0.00 4.70 0.00 2.15 2.35 0.00 3.77 0.00 0.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.32 0.00 169 Y 8.22 5.08 0.00 2.99 3.09 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 0.00 170 E 8.32 4.48 0.00 1.16 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 171 I 8.57 4.06 1.88 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.78 0.91 0.00 0.00 172 P 0.00 4.03 0.00 2.16 1.99 0.00 3.64 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.09 0.00 *173 K 8.83 3.84 0.00 1.77 1.76 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.04 7.81 174 A 7.83 4.36 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 0.00 175 G 7.77 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 0.00 176 P 0.00 4.72 0.00 2.00 1.84 0.00 3.75 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 177 T 8.57 4.33 4.34 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 186 G 7.46 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 R 8.11 4.70 0.00 1.89 1.47 0.00 3.12 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 188 H 8.49 5.15 0.00 3.55 3.45 0.00 5.47 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 S 8.39 4.74 0.00 3.84 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 0.00 190 W 8.35 4.64 0.00 2.37 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 0.00 0.00 0.00 191 R 8.84 4.60 0.00 1.03 1.56 0.00 3.11 0.00 0.00 3.27 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 192 P 0.00 4.84 0.00 2.13 2.00 0.00 3.77 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.75 0.00 193 A 9.42 4.45 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 H 8.41 5.11 0.00 2.58 2.85 0.00 5.09 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 I 7.66 4.39 1.87 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.49 0.85 0.00 0.00 196 H 8.55 4.52 0.00 1.40 1.31 0.00 5.63 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 I 8.00 5.06 1.75 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.51 0.58 0.00 0.00 198 R 9.49 5.02 0.00 1.73 1.72 0.00 2.87 0.00 0.00 2.61 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.44 0.00 199 I 9.00 4.98 1.76 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.60 0.83 0.00 0.00 200 T 8.69 5.08 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 1.24 0.00 0.00 201 A 8.34 4.93 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 0.00 202 D 8.91 4.43 0.00 2.73 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 0.00 203 G 9.36 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 0.00 204 Y 7.70 4.83 0.00 3.11 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 0.00 205 R 8.90 4.26 0.00 2.14 2.15 0.00 3.49 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.82 0.00 206 P 0.00 4.62 0.00 1.93 1.99 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 207 L 8.74 4.52 0.00 1.70 1.44 0.79 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 208 I 7.86 4.88 1.78 0.00 0.00 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 1.14 0.58 0.93 0.00 0.00 209 T 8.53 4.60 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 1.26 0.00 0.00 210 Q 8.27 4.78 0.00 1.53 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.45 0.00 0.00 0.00 0.00 0.00 1.86 2.18 0.00 211 L 8.15 4.37 0.00 1.14 1.13 0.78 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 212 Y 8.23 4.75 0.00 2.82 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 F 8.29 5.36 0.00 3.00 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 0.00 214 E 9.17 3.99 0.00 2.32 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 215 G 9.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 D 8.02 4.37 0.00 3.05 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 0.00 217 P 0.00 4.07 0.00 1.18 1.76 0.00 3.70 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.66 0.00 218 Y 8.00 4.68 0.00 3.22 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 0.00 219 L 7.76 3.88 0.00 1.70 1.66 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 220 D 8.00 5.00 0.00 2.58 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 S 7.93 4.70 0.00 4.07 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 0.00 222 D 8.48 4.37 0.00 2.58 2.53 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 0.00 223 S 8.36 4.12 0.00 3.95 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 0.00 224 C 8.44 4.84 0.00 2.82 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 0.00 225 S 7.46 3.61 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 0.00 226 A 8.01 4.59 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.38 3.49 1.84 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 0.52 0.00 0.00 0.24 0.00 0.00 228 K 8.36 4.57 0.00 1.88 1.89 0.00 1.83 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.44 1.45 7.81 229 S 9.00 3.88 0.00 3.86 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 E 8.26 4.21 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 231 L 8.83 4.74 0.00 1.92 1.70 1.04 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 232 V 7.48 4.73 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.00 0.00 0.00 233 L 8.94 4.80 0.00 1.91 1.79 1.08 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 234 P 0.00 5.26 0.00 1.98 2.04 0.00 3.75 0.00 0.00 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 235 V 8.42 4.53 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.96 0.00 0.00 236 N 8.71 4.63 0.00 2.81 2.75 0.00 0.00 6.40 7.94 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 0.00 237 K 8.72 4.70 0.00 2.06 1.73 0.00 1.91 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.35 1.02 7.81 238 I 8.68 4.44 1.93 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.22 0.92 0.00 0.00 239 D 8.49 5.01 0.00 2.55 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 0.00 240 I 8.90 4.02 2.01 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 1.19 1.31 0.91 0.00 0.00 241 D 7.56 4.19 0.00 2.71 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 242 G 9.00 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 0.00 0.00 0.00 243 E 7.98 4.46 0.00 2.11 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 244 T 8.10 5.04 4.50 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 1.20 0.00 0.00 245 W 8.85 4.46 0.00 3.29 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 0.00 246 Q 9.06 4.95 0.00 1.87 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00 247 L 8.80 5.24 0.00 1.63 1.59 0.90 0.67 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 0.00 248 V 8.73 4.84 2.36 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 1.04 0.00 0.00 1.41 0.00 0.00 249 D 8.56 4.97 0.00 2.51 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 F 8.65 4.55 0.00 3.14 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 0.00 251 N 7.47 4.90 0.00 2.32 2.60 0.00 0.00 7.08 7.45 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 0.00 252 F 9.31 4.68 0.00 3.21 3.09 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 0.00 253 I 9.10 5.38 2.06 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 1.25 2.13 0.92 0.00 0.00 254 L 8.59 5.04 0.00 1.47 1.70 0.83 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 *255 Q 9.39 4.03 0.00 2.07 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 5.45 0.00 0.00 0.00 0.00 0.00 2.26 1.92 0.00 *256 H 8.58 4.46 0.00 3.03 3.23 0.00 7.20 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 0.00 257 N 7.85 4.43 0.00 2.69 2.71 0.00 0.00 6.86 7.44 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 * Residues marked with a * may have inaccurate shift predictions.