NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 S 4.3381 8.3344 116.7924 57.8460 64.7605 172.5646 13 V 4.0635 7.6839 121.3138 61.0266 32.1907 173.4376 14 T 4.7964 8.1361 123.3148 61.9187 73.1597 173.0533 15 T 4.6299 8.2286 112.8837 59.6766 71.4969 174.0531 16 K 3.9941 8.6699 125.6314 56.4137 32.6688 176.6216 17 R 4.5281 8.0466 121.1691 54.8891 32.4600 174.0079 18 Y 4.7262 8.6025 116.4045 56.7605 40.9946 174.7459 19 T 4.5386 8.0103 109.4655 60.5191 71.5412 173.5246 20 L 4.2391 8.2023 124.0895 52.9779 41.0934 174.3413 21 P 4.4549 0.0000 0.0000 61.9392 31.9611 175.1812 22 P 4.3720 0.0000 0.0000 62.0247 32.1201 176.1643 23 L 3.9006 7.6132 120.4981 53.4351 41.6137 176.3558 24 P 4.2864 0.0000 0.0000 64.9320 32.4291 176.1676 25 Y 4.8014 7.2220 117.7489 56.2886 38.7951 174.2385 26 A 4.7212 8.4636 122.9776 50.8970 21.4045 176.5111 27 Y 4.1999 8.1981 115.5889 60.0889 38.5199 177.2283 28 N 4.9589 8.1033 114.6636 52.5925 39.7619 175.9409 29 A 4.0732 8.2993 122.1647 55.5561 18.3665 178.7189 30 L 4.6066 8.1103 112.9857 54.7114 41.9477 176.6071 31 E 4.4690 7.5572 117.9227 57.2437 29.7517 175.5286 32 P 4.4181 0.0000 0.0000 62.4418 29.0894 173.4182 33 Y 5.3760 7.5583 113.7012 58.2688 40.1400 176.2900 34 I 4.9620 7.9875 120.5540 59.5078 41.1016 175.0969 35 S 4.4500 8.8525 119.8102 57.8925 63.7415 174.8167 36 A 5.0646 8.8440 122.6443 53.1423 17.2744 178.2119 37 E 4.2308 7.6940 118.8115 57.9560 30.6477 177.9817 38 I 4.1552 8.1925 121.7287 61.2012 37.6593 178.4384 *40 Q 4.0765 8.1487 121.3501 56.2481 30.8576 176.7342 41 L 3.9156 7.8936 117.2079 58.0701 41.5913 178.7287 42 H 4.3680 8.2769 118.1670 59.8288 29.3392 176.3110 43 H 4.7425 8.2395 118.7505 59.3461 29.9052 177.1057 44 Q 4.0721 8.6932 118.7001 58.6676 28.8223 177.6384 45 K 4.1755 9.0330 120.0589 58.8803 32.7917 178.5172 46 H 3.7023 7.6304 115.5825 58.9994 28.7684 177.0807 47 H 4.0062 9.0235 120.2594 59.6980 29.7833 177.2330 48 Q 4.0051 7.8569 120.7984 58.8626 28.7547 178.1502 49 G 3.5395 7.6931 106.9134 48.2220 0.0000 175.2764 50 Y 4.4352 7.2028 118.7377 60.4617 37.8086 178.6475 51 V 3.5127 7.4951 119.5981 66.0823 31.5826 177.4963 52 N 4.3590 8.6686 116.6935 56.4417 38.4247 177.2610 53 G 3.3735 8.4028 106.8713 47.8674 0.0000 175.2724 54 A 4.0028 7.9842 122.6569 55.1510 18.4089 179.4363 55 N 4.3506 8.2640 114.7608 56.5448 38.4895 177.4844 56 A 4.0483 8.4661 122.2438 54.9579 18.4083 179.6899 57 A 3.9825 8.0163 119.3414 55.4327 18.5986 179.8409 58 L 4.0391 8.3309 117.9565 57.8487 41.5711 179.4312 59 E 3.9567 8.6630 119.7220 59.3092 29.4487 179.0446 60 K 4.0157 7.8859 118.6072 59.5422 32.2629 179.2728 61 L 4.2445 8.1985 118.7797 57.0331 41.5231 179.0846 62 E 4.0407 8.1241 119.9481 59.0531 29.7745 178.5220 63 K 4.3620 8.4028 117.8450 58.3540 32.1915 178.9598 64 F 5.0643 7.8844 122.9644 60.4563 39.3193 177.7077 65 R 3.4861 7.6789 116.2262 58.5549 29.8447 178.1353 66 K 4.3889 8.3708 116.5424 55.1433 32.1188 176.7938 67 G 4.0043 7.2839 106.1363 46.6815 0.0000 174.2066 68 E 4.3908 8.6866 116.3752 54.7693 30.2446 176.3897 69 A 4.7947 7.3486 128.0166 51.8334 20.8022 177.4901 70 Q 4.8129 8.2482 120.2903 56.4553 29.5835 175.3939 71 I 4.4291 7.7383 116.2046 59.5681 40.9844 175.4216 72 D 4.5811 8.2392 126.4967 52.2220 38.5288 176.2054 73 I 3.5100 7.6345 123.7152 63.8770 38.1212 176.6208 74 R 3.8037 7.8586 118.3777 59.2520 30.0872 178.0737 75 A 3.9388 8.0119 120.2162 55.1700 18.3810 179.6833 76 V 3.5318 8.1156 116.9726 66.2908 31.6335 178.2183 77 L 4.0299 8.1887 118.9631 57.7852 41.4157 179.6502 78 R 3.9496 8.3248 118.3621 59.3792 29.9484 178.8366 79 D 4.3524 8.1745 118.4380 57.2928 40.9033 178.3889 80 L 3.9667 8.2972 121.2205 58.3007 42.1384 178.6648 81 S 4.0405 8.4744 113.2776 61.5682 62.2898 175.9016 82 F 4.1366 8.2194 122.9143 61.7503 39.1720 176.8941 83 H 4.1674 8.5140 115.8573 58.7335 28.5222 177.5430 84 L 3.6989 8.3129 122.5308 58.1930 41.8558 178.8436 85 N 4.2149 7.9708 116.1225 56.0066 38.4594 177.6202 86 G 2.6203 7.4617 107.2095 47.4715 0.0000 175.3239 87 H 4.2675 8.0453 120.3071 59.1572 29.7727 177.2485 88 I 3.4846 7.3815 120.2337 64.5490 37.2754 178.1367 89 L 3.5771 7.4352 119.4163 57.8870 41.0080 179.4163 90 H 3.9297 7.6518 115.6805 58.4632 28.4372 177.3272 91 S 4.6185 8.3812 114.5383 59.9094 62.7267 174.6783 92 I 4.4594 7.2260 122.4007 61.6697 39.5554 177.7103 93 F 4.3850 8.1273 122.1226 61.0518 39.3711 176.4656 94 W 5.4685 8.2027 118.8490 59.1112 28.9988 175.8559 95 P 4.5914 0.0000 0.0000 65.1764 31.1697 176.6976 96 N 4.4165 7.8577 118.2500 53.2821 38.1451 174.5162 *98 A 3.8738 7.7924 119.1084 50.7335 20.1580 175.3986 99 P 4.2029 0.0000 0.0000 62.0230 32.0467 174.1767 100 P 4.4199 0.0000 0.0000 63.9497 32.0793 176.6959 101 G 4.2805 8.8849 114.8091 46.7672 0.0000 175.0711 102 K 4.0279 7.7801 118.6591 57.9127 32.6242 177.0700 103 G 3.8002 7.0926 105.7602 45.7136 0.0000 172.9483 104 G 4.2956 7.8434 127.0700 45.3324 0.0000 170.5486 105 G 4.0939 7.4258 107.2351 42.8432 0.0000 171.5724 106 K 2.5681 8.3306 120.1694 55.2139 31.9366 174.6666 107 P 3.7683 0.0000 0.0000 62.7826 31.9118 176.0167 108 G 3.7698 7.4481 106.9628 45.3856 0.0000 171.8916 109 G 4.1093 8.5618 108.5595 45.4852 0.0000 173.3999 110 K 4.0677 8.8419 118.6350 59.1210 32.0795 178.9003 111 I 3.6680 9.0163 119.1271 64.1994 37.8365 177.7705 112 A 3.7784 7.7950 121.5450 55.0934 18.3264 179.3755 113 D 4.2750 7.7816 117.1401 57.4832 40.8946 179.0503 114 L 4.0981 8.2616 119.7038 57.7020 41.6342 179.4456 115 I 4.1842 7.8258 119.6983 64.6400 37.0001 178.1884 116 N 4.6155 8.2054 117.1365 55.7256 38.1375 177.5869 117 K 3.6817 7.5230 120.3974 59.6197 32.4372 178.7576 118 F 4.3568 7.5617 116.1836 59.3083 38.9231 176.4476 119 F 4.8351 7.8052 115.5064 57.3967 40.7074 176.0266 120 G 4.4423 8.8538 112.5795 45.7476 0.0000 174.2421 121 S 5.4564 7.6369 114.5774 56.1827 66.9947 174.7459 122 F 4.3498 8.7496 123.4502 61.0842 39.0421 177.1190 123 E 3.5556 8.0256 118.1310 59.1674 29.4303 178.8441 124 K 3.9024 7.8179 119.1761 59.4218 32.1596 178.6038 125 F 3.5806 8.2270 120.9609 60.8834 39.2068 176.9813 126 K 3.0077 7.6901 119.5289 59.3942 31.6369 177.8740 127 E 3.8491 8.0231 119.6567 58.8656 29.5566 177.9628 128 E 3.8394 8.2411 118.9465 59.7037 29.8418 179.2349 129 F 3.8790 8.2321 120.6465 61.0602 39.2677 177.4312 130 S 4.3086 8.5112 115.1402 61.5277 62.8070 176.3200 131 Q 3.9507 8.9222 121.7291 59.0089 28.2622 178.8486 132 A 3.8269 7.7083 119.8131 55.3479 18.2861 179.2310 133 A 3.8624 7.4797 118.3139 55.1778 18.1790 180.0321 134 K 3.9443 8.1090 116.3641 58.8713 32.1064 178.0766 135 N 5.0233 7.6977 115.1473 52.0904 39.7083 175.2438 136 V 3.6845 6.9066 121.2463 61.6788 31.3662 175.3758 137 E 3.8424 8.5700 129.4585 57.3427 29.8820 177.2002 138 G 3.6526 8.4614 116.8271 45.0118 0.0000 172.6509 139 V 3.5337 7.5944 112.2852 60.0137 32.8567 176.5055 140 G 4.7897 6.6158 106.5142 46.0988 0.0000 171.0466 141 W 5.4707 8.3560 118.4184 54.8337 34.3299 174.3349 142 A 4.9927 8.8723 122.7266 50.1391 20.9426 175.4194 143 I 5.2977 8.6187 115.6441 59.1493 41.8595 174.0200 144 L 5.4351 9.6541 125.9193 53.7810 44.2727 175.6492 145 V 5.0773 9.3024 118.7931 59.8430 36.8045 173.5934 146 Y 4.7287 9.2187 123.9871 56.1661 40.8442 174.0768 147 E 4.2201 8.5540 129.1377 54.1161 29.9389 174.5687 148 P 4.3397 0.0000 0.0000 65.5440 31.3609 177.6497 149 L 3.9277 8.3436 119.4757 57.6904 42.1265 177.1726 150 E 4.3600 8.8443 116.5811 55.2519 30.0898 176.4884 151 E 3.4148 7.5579 117.1097 56.6709 27.1035 172.9838 152 Q 3.7079 6.3099 117.6833 54.2028 32.9320 174.5345 153 L 4.8104 6.4605 119.1233 54.1632 43.0739 176.5382 154 L 4.9455 8.9922 121.2248 53.3516 46.5004 175.1308 155 I 5.1789 8.6550 122.2139 59.9348 39.4291 175.0144 156 L 4.9088 8.9369 124.7907 53.2014 46.4305 175.1492 157 Q 4.9571 8.5962 119.9077 54.5631 30.5305 175.0692 158 I 4.7191 8.7251 124.6634 59.5661 40.5514 174.3139 159 E 4.8641 8.9046 126.2028 54.5715 31.8625 175.7789 160 K 3.9485 8.8223 123.2840 58.4404 31.0491 179.1659 161 H 5.1275 9.3448 124.1690 56.1552 30.4392 173.3107 162 N 5.4262 8.2839 113.4937 51.4204 38.5415 175.2503 163 L 4.4278 7.6400 120.1164 53.9879 40.6666 175.1813 *165 H 4.6655 7.5945 115.3606 55.5102 30.5486 173.2797 166 A 4.4516 8.2203 123.9253 50.2335 19.6659 176.7282 167 A 4.0197 8.6094 125.5645 54.3999 18.6329 177.9037 168 D 4.4966 8.9589 119.2960 54.7744 39.8198 174.4118 169 A 4.2426 7.9048 122.5466 52.2268 19.1109 176.6558 170 Q 4.5060 8.6057 121.4217 54.7077 30.4513 175.3293 171 V 4.2390 8.4505 124.7455 62.9507 31.8103 175.0991 172 L 4.7005 9.3163 127.7770 55.7122 43.8285 176.9343 173 L 5.1547 7.9649 119.2156 53.3285 45.7528 174.9854 174 A 5.3915 9.3850 127.0379 50.2332 22.3486 174.8250 175 L 4.2962 9.4181 124.9544 53.0308 44.3612 174.9633 176 D 3.3700 7.5656 127.1053 52.7523 41.0832 175.7643 177 V 4.4884 7.5349 120.2695 60.9312 32.5197 176.7172 178 W 4.0135 7.7794 121.3947 56.2601 29.7245 177.2298 179 E 2.8610 8.8491 122.2623 59.7674 28.9216 178.6277 180 H 4.3988 7.9546 110.2527 56.3427 28.7510 175.6354 181 A 4.6657 8.0845 123.9191 54.0577 19.9329 176.6698 182 Y 4.6086 6.5891 115.8920 54.5000 39.4037 174.3917 183 Y 4.1188 9.0403 117.4288 57.0632 38.4666 170.7688 184 L 3.6301 8.0147 124.1338 57.4860 42.7288 177.8789 185 Q 4.3601 8.2789 115.8406 57.4293 31.3863 175.1332 186 Y 4.5229 8.3844 112.3225 56.7371 40.1323 177.5172 187 K 2.7459 8.6294 123.6811 57.4009 31.8907 178.2926 188 N 4.9045 8.7291 126.1846 54.5234 37.9149 175.6708 189 D 4.7105 7.8273 120.2706 54.4982 38.6200 176.6107 190 R 3.4920 8.2750 123.7871 59.3318 30.4036 177.0128 191 G 3.6468 8.2073 105.1495 47.3592 0.0000 175.1391 192 S 4.2324 8.0925 116.2819 61.2108 63.3052 176.3439 193 Y 3.3966 7.5535 121.2327 60.5747 38.1685 178.4555 194 V 2.9074 7.2353 117.3555 65.8962 31.9230 177.4382 195 D 4.8825 8.6760 118.9631 57.5283 40.4572 178.1534 196 N 4.8367 9.2083 116.9816 54.7381 38.5808 177.2364 197 W 3.8510 7.8129 130.6469 60.1616 30.5983 177.7514 198 W 4.3365 7.6327 117.4256 59.5058 28.1786 177.1571 199 N 4.8396 7.1393 113.8299 53.3173 37.7219 175.6450 200 V 4.3546 7.2647 116.4283 60.5206 33.1285 175.9387 201 V 2.9295 6.9575 118.9237 63.5102 31.5127 175.5749 202 N 4.4509 8.2829 127.3118 51.9815 37.2725 175.1537 203 W 4.4466 8.0901 121.2352 57.7080 29.2180 176.3747 204 D 4.4825 7.9127 118.9443 56.5645 41.0372 177.5237 205 D 4.2755 7.9977 118.6112 57.1632 41.1772 178.2381 206 V 3.7601 7.7429 118.3071 66.0594 31.5578 177.2707 207 E 3.9787 8.0783 118.6491 59.6270 29.4947 179.0687 208 R 3.9606 8.2813 118.0885 59.2367 30.0445 179.4039 209 R 3.9470 8.0769 118.0046 58.9710 30.0912 178.6978 210 L 3.8874 8.2440 120.4961 58.1307 42.0707 178.6264 211 Q 3.8699 8.1210 119.4024 59.3947 29.0188 178.5662 212 K 4.1273 8.1122 119.9108 58.7920 32.0250 179.2499 213 A 4.2586 7.7032 122.3766 54.5963 18.1184 179.7153 214 L 3.6731 7.9353 116.3557 57.2093 41.7066 178.5902 215 N 4.6461 7.9667 114.7629 53.2601 38.7172 175.7442 216 G 3.8887 7.9222 108.5732 45.9163 0.0000 173.3049 217 Q 4.7051 8.1920 118.1332 53.3124 31.2244 175.3261 218 I 4.1522 8.1101 121.2526 61.4561 37.8986 176.7728 219 A 4.4509 8.9812 130.5366 52.4829 18.3230 176.0851 220 L 4.6128 7.1651 122.1688 56.6816 45.2987 177.5799 221 K 5.0093 8.0970 119.0848 57.2097 31.5915 174.5070 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 12 S 8.33 4.34 0.00 3.86 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.68 4.06 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 0.79 0.00 0.00 0.94 0.00 0.00 14 T 8.14 4.80 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 1.20 0.00 0.00 15 T 8.23 4.63 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 16 K 8.67 3.99 0.00 1.60 1.57 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.69 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.34 7.81 17 R 8.05 4.53 0.00 1.74 2.08 0.00 3.54 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 18 Y 8.60 4.73 0.00 2.84 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 19 T 8.01 4.54 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 1.23 0.00 0.00 20 L 8.20 4.24 0.00 1.75 1.63 0.72 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 4.45 0.00 2.30 2.10 0.00 3.85 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 22 P 0.00 4.37 0.00 1.97 1.88 0.00 3.69 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 2.01 2.09 0.00 23 L 7.61 3.90 0.00 0.81 0.20 -0.35 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.29 0.00 2.31 2.26 0.00 3.81 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.21 0.00 25 Y 7.22 4.80 0.00 3.11 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 26 A 8.46 4.72 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 27 Y 8.20 4.20 0.00 2.99 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 28 N 8.10 4.96 0.00 2.87 3.12 0.00 0.00 7.02 8.11 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 29 A 8.30 4.07 1.65 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 30 L 8.11 4.61 0.00 1.95 1.88 1.02 0.62 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 31 E 7.56 4.47 0.00 2.06 1.93 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 2.62 2.55 0.00 32 P 0.00 4.42 0.00 1.30 2.23 0.00 3.56 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 33 Y 7.56 5.38 0.00 3.25 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 34 I 7.99 4.96 2.18 0.00 0.00 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 1.81 1.67 1.27 0.00 0.00 35 S 8.85 4.45 0.00 4.07 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.84 5.06 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 E 7.69 4.23 0.00 2.03 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 2.28 2.45 0.00 38 I 8.19 4.16 2.09 0.00 0.00 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 1.34 0.91 1.24 0.00 0.00 *40 Q 8.15 4.08 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.95 6.91 0.00 0.00 0.00 0.00 0.00 1.76 2.08 0.00 41 L 7.89 3.92 0.00 1.78 1.68 0.99 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 42 H 8.28 4.37 0.00 3.79 3.78 0.00 5.57 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 H 8.24 4.74 0.00 2.91 3.35 0.00 5.72 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 44 Q 8.69 4.07 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.60 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 45 K 9.03 4.18 0.00 1.54 1.54 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.51 7.81 46 H 7.63 3.70 0.00 3.29 2.87 0.00 5.64 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 H 9.02 4.01 0.00 3.66 3.68 0.00 5.61 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 48 Q 7.86 4.01 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 49 G 7.69 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 0.00 0.00 0.00 50 Y 7.20 4.44 0.00 3.01 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 51 V 7.50 3.51 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.97 0.00 0.00 52 N 8.67 4.36 0.00 2.87 2.82 0.00 0.00 6.93 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0.00 0.00 0.00 0.00 1.49 1.77 7.81 61 L 8.20 4.24 0.00 1.94 1.85 0.97 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.12 4.04 0.00 2.33 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 2.32 2.37 0.00 63 K 8.40 4.36 0.00 1.90 1.88 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.80 7.81 64 F 7.88 5.06 0.00 3.09 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 R 7.68 3.49 0.00 1.96 1.87 0.00 3.32 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.96 0.00 66 K 8.37 4.39 0.00 1.71 1.80 0.00 1.85 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.57 7.81 67 G 7.28 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 68 E 8.69 4.39 0.00 2.03 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 2.31 2.25 0.00 69 A 7.35 4.79 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 70 Q 8.25 4.81 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.63 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 71 I 7.74 4.43 1.74 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.50 0.01 0.00 0.00 72 D 8.24 4.58 0.00 2.71 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 73 I 7.63 3.51 1.64 0.00 0.00 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 1.40 1.24 0.83 0.00 0.00 74 R 7.86 3.80 0.00 1.89 1.87 0.00 3.22 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 75 A 8.01 3.94 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.12 3.53 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 1.08 0.00 0.00 0.95 0.00 0.00 77 L 8.19 4.03 0.00 1.77 1.70 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 78 R 8.32 3.95 0.00 2.07 1.97 0.00 3.11 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 79 D 8.17 4.35 0.00 2.95 2.83 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 80 L 8.30 3.97 0.00 1.76 1.87 0.95 0.79 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 81 S 8.47 4.04 0.00 4.00 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 82 F 8.22 4.14 0.00 3.13 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 83 H 8.51 4.17 0.00 3.39 3.55 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.31 3.70 0.00 1.57 1.66 0.46 0.68 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 85 N 7.97 4.21 0.00 2.90 2.74 0.00 0.00 6.90 7.38 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 86 G 7.46 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 0.00 0.00 0.00 87 H 8.05 4.27 0.00 3.26 3.37 0.00 5.80 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 88 I 7.38 3.48 1.64 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 1.43 0.70 0.77 0.00 0.00 89 L 7.44 3.58 0.00 0.63 0.13 -0.13 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 90 H 7.65 3.93 0.00 3.12 2.63 0.00 5.81 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 S 8.38 4.62 0.00 3.90 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 I 7.23 4.46 1.91 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.15 1.00 0.00 0.00 93 F 8.13 4.39 0.00 3.12 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 94 W 8.20 5.47 0.00 3.50 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.59 0.00 2.41 2.32 0.00 3.97 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.22 0.00 96 N 7.86 4.42 0.00 2.96 2.88 0.00 0.00 6.67 7.75 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 *98 A 7.79 3.87 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.20 0.00 2.18 2.05 0.00 3.56 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 100 P 0.00 4.42 0.00 2.20 2.47 0.00 3.88 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 2.45 2.61 0.00 101 G 8.88 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 0.00 0.00 0.00 0.00 102 K 7.78 4.03 0.00 1.75 1.99 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.37 7.81 103 G 7.09 3.80 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 1.77 1.24 1.00 0.00 0.00 112 A 7.79 3.78 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.78 4.28 0.00 2.76 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 0.00 114 L 8.26 4.10 0.00 1.89 2.12 1.25 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 115 I 7.83 4.18 2.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.42 0.92 0.00 0.00 116 N 8.21 4.62 0.00 2.90 2.84 0.00 0.00 6.61 6.62 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 0.00 117 K 7.52 3.68 0.00 1.45 1.18 0.00 1.41 0.00 0.00 0.61 0.00 0.00 2.74 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.79 1.14 7.81 118 F 7.56 4.36 0.00 2.53 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 0.00 119 F 7.81 4.84 0.00 3.47 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 G 8.85 4.44 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 0.00 121 S 7.64 5.46 0.00 4.29 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 0.00 122 F 8.75 4.35 0.00 2.94 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.03 3.56 0.00 2.03 1.86 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 2.36 2.37 0.00 124 K 7.82 3.90 0.00 1.92 2.04 0.00 1.62 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.71 1.68 7.81 125 F 8.23 3.58 0.00 2.74 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 0.00 126 K 7.69 3.01 0.00 0.84 1.28 0.00 0.61 0.00 0.00 0.92 0.00 0.00 2.13 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.43 0.21 7.81 127 E 8.02 3.85 0.00 2.12 1.96 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 2.28 2.28 0.00 128 E 8.24 3.84 0.00 2.11 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 0.00 2.36 2.39 0.00 129 F 8.23 3.88 0.00 2.49 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 0.00 130 S 8.51 4.31 0.00 4.16 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 0.00 131 Q 8.92 3.95 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 132 A 7.71 3.83 1.17 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 0.00 0.00 133 A 7.48 3.86 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 K 8.11 3.94 0.00 1.87 1.85 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.62 7.81 135 N 7.70 5.02 0.00 2.71 2.78 0.00 0.00 6.99 7.84 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 0.00 136 V 6.91 3.68 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 0.64 0.00 0.00 0.90 0.00 0.00 137 E 8.57 3.84 0.00 1.91 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 138 G 8.46 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 0.00 139 V 7.59 3.53 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 0.14 0.00 0.00 -0.66 0.00 0.00 140 G 6.62 4.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.36 5.47 0.00 3.13 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 0.00 142 A 8.87 4.99 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 I 8.62 5.30 1.98 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 1.14 0.89 0.98 0.00 0.00 144 L 9.65 5.44 0.00 2.37 1.94 1.50 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 145 V 9.30 5.08 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.00 0.00 0.00 146 Y 9.22 4.73 0.00 3.11 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 0.00 147 E 8.55 4.22 0.00 1.83 1.55 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 2.17 2.32 0.00 148 P 0.00 4.34 0.00 2.12 2.21 0.00 3.75 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 149 L 8.34 3.93 0.00 1.56 1.88 0.92 0.94 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 0.00 150 E 8.84 4.36 0.00 1.91 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 151 E 7.56 3.41 0.00 2.17 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 0.00 2.46 2.34 0.00 152 Q 6.31 3.71 0.00 0.93 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 7.01 0.00 0.00 0.00 0.00 0.00 1.91 1.89 0.00 153 L 6.46 4.81 0.00 1.51 1.88 1.25 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.99 4.95 0.00 1.53 1.52 0.85 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.66 5.18 2.04 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 1.81 1.07 0.88 0.00 0.00 156 L 8.94 4.91 0.00 1.54 1.48 0.94 1.13 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 0.00 157 Q 8.60 4.96 0.00 1.88 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.68 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 158 I 8.73 4.72 1.99 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.96 0.83 0.00 0.00 159 E 8.90 4.86 0.00 1.90 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 0.00 2.28 2.22 0.00 160 K 8.82 3.95 0.00 2.19 1.59 0.00 1.62 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.38 0.00 0.00 0.00 0.00 1.30 1.40 7.81 161 H 9.34 5.13 0.00 2.82 2.94 0.00 5.66 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 N 8.28 5.43 0.00 2.83 3.08 0.00 0.00 6.30 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 L 7.64 4.43 0.00 1.93 1.63 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 *165 H 7.59 4.67 0.00 3.16 3.22 0.00 5.68 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 0.00 166 A 8.22 4.45 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 0.00 167 A 8.61 4.02 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 0.00 168 D 8.96 4.50 0.00 2.86 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 0.00 169 A 7.90 4.24 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 0.00 170 Q 8.61 4.51 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.96 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 171 V 8.45 4.24 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 0.80 0.00 0.00 0.89 0.00 0.00 172 L 9.32 4.70 0.00 1.68 1.81 1.15 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 173 L 7.96 5.15 0.00 1.80 1.69 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 174 A 9.38 5.39 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 0.00 175 L 9.42 4.30 0.00 0.58 1.13 -0.66 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 176 D 7.57 3.37 0.00 1.58 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 0.00 177 V 7.53 4.49 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 0.62 0.00 0.00 0.85 0.00 0.00 178 W 7.78 4.01 0.00 2.90 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 0.00 179 E 8.85 2.86 0.00 1.79 1.61 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 2.25 2.15 0.00 180 H 7.95 4.40 0.00 3.20 3.35 0.00 5.52 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 0.00 181 A 8.08 4.67 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 6.59 4.61 0.00 2.93 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 0.00 183 Y 9.04 4.12 0.00 3.09 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 0.00 184 L 8.01 3.63 0.00 1.81 1.84 1.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 185 Q 8.28 4.36 0.00 2.10 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.71 0.00 0.00 0.00 0.00 0.00 1.68 2.17 0.00 186 Y 8.38 4.52 0.00 3.23 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 0.00 187 K 8.63 2.75 0.00 1.63 0.74 0.00 1.56 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.13 1.22 7.81 188 N 8.73 4.90 0.00 2.92 3.06 0.00 0.00 5.92 8.06 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 0.00 189 D 7.83 4.71 0.00 3.04 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 0.00 190 R 8.28 3.49 0.00 1.79 1.86 0.00 3.24 0.00 0.00 3.46 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.47 0.00 191 G 8.21 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 0.00 192 S 8.09 4.23 0.00 4.14 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 0.00 193 Y 7.55 3.40 0.00 1.83 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 0.00 194 V 7.24 2.91 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 0.82 0.00 0.00 0.69 0.00 0.00 195 D 8.68 4.88 0.00 2.93 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 0.00 196 N 9.21 4.84 0.00 3.18 3.35 0.00 0.00 6.69 7.55 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 0.00 197 W 7.81 3.85 0.00 2.92 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 0.00 198 W 7.63 4.34 0.00 3.62 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 0.00 199 N 7.14 4.84 0.00 1.98 2.53 0.00 0.00 6.68 7.56 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 0.00 200 V 7.26 4.35 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.50 0.00 0.00 201 V 6.96 2.93 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 -0.91 0.00 0.00 -0.87 0.00 0.00 202 N 8.28 4.45 0.00 2.63 2.54 0.00 0.00 6.78 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 0.00 203 W 8.09 4.45 0.00 3.36 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 D 7.91 4.48 0.00 2.72 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 0.00 205 D 8.00 4.28 0.00 3.02 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 0.00 206 V 7.74 3.76 2.31 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 1.28 0.00 0.00 0.67 0.00 0.00 207 E 8.08 3.98 0.00 2.27 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 0.00 2.32 2.42 0.00 208 R 8.28 3.96 0.00 2.05 1.98 0.00 3.19 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.89 0.00 209 R 8.08 3.95 0.00 2.09 2.01 0.00 3.38 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.84 0.00 210 L 8.24 3.89 0.00 1.82 1.85 0.97 0.87 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 0.00 211 Q 8.12 3.87 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.55 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 212 K 8.11 4.13 0.00 1.97 1.84 0.00 1.73 0.00 0.00 1.79 0.00 0.00 3.14 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.42 7.81 213 A 7.70 4.26 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 L 7.94 3.67 0.00 1.62 1.64 0.88 1.11 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 0.00 215 N 7.97 4.65 0.00 2.94 2.82 0.00 0.00 7.09 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 7.92 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 Q 8.19 4.71 0.00 2.16 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 6.95 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 218 I 8.11 4.15 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.48 0.94 0.00 0.00 219 A 8.98 4.45 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 0.00 220 L 7.17 4.61 0.00 1.60 1.60 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 221 K 8.10 5.01 0.00 1.83 2.01 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.48 7.81 * Residues marked with a * may have inaccurate shift predictions.