NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3415 8.1927 116.7852 58.5714 64.0913 173.5621 3 K 4.1819 8.6336 125.3753 56.0198 32.3040 175.0678 4 G 4.1420 7.7936 104.5385 44.0746 0.0000 174.0043 5 E 3.9702 7.8858 121.7389 59.7397 29.6468 178.7075 6 E 3.9998 8.3364 116.5366 59.5006 29.0711 178.8328 7 L 3.7940 7.7434 119.0030 56.6619 41.7189 178.2072 8 F 4.7066 8.2597 116.2634 58.2660 39.2492 178.3500 9 T 3.9299 7.2776 114.8396 66.0063 68.9443 173.3654 10 G 4.0783 7.5863 110.9302 44.3266 0.0000 171.6512 11 V 4.0480 8.6578 122.8804 63.1783 32.2200 176.8451 12 V 4.6823 9.3359 129.3127 60.5321 33.8722 173.0888 13 P 4.7765 0.0000 0.0000 62.7995 32.9919 175.0707 14 I 5.1080 8.4545 122.4602 59.5852 41.5143 174.2749 15 L 5.0049 8.7814 126.2495 53.6286 45.8475 174.9443 16 V 5.0478 8.7825 125.6846 61.2089 34.7181 173.8601 17 E 5.2438 9.4233 126.7527 54.5688 33.2792 174.3960 18 L 5.1733 9.0930 126.1962 53.2225 45.8643 174.3063 19 D 5.1767 9.3340 125.9916 52.4195 43.6066 174.9997 20 G 3.4350 8.8899 113.1165 44.2470 0.0000 171.3357 21 D 4.8779 8.4873 120.1632 53.2041 44.7009 174.3568 22 V 4.6752 8.6901 126.9462 61.1807 34.2988 175.0510 23 N 4.3511 9.9876 127.1106 54.3866 36.6438 176.5531 24 G 3.9730 8.5541 105.4068 45.8153 0.0000 175.0278 25 H 4.6939 8.4307 118.5314 54.5548 27.9590 173.9209 26 K 4.8431 8.3591 121.6165 56.3480 32.9820 175.7755 27 F 5.1325 8.3257 117.8266 57.5995 41.9649 172.7727 28 S 5.1822 8.5552 113.8312 57.1782 67.4885 173.5306 29 V 5.7660 8.8792 123.0244 60.3880 34.9584 174.1274 30 S 5.3761 8.9663 122.7189 56.8024 65.8829 173.2487 31 G 4.4239 8.9251 110.8050 43.9867 0.0000 171.0669 32 E 5.1439 6.4530 115.2539 56.1893 32.3364 175.1214 33 G 4.4633 8.0982 108.8379 46.2806 0.0000 171.6739 34 E 4.9889 7.7059 119.1670 55.3418 33.2839 174.7825 35 G 3.3904 9.0017 107.6261 44.3441 0.0000 171.3143 36 D 5.4403 9.2200 122.3652 51.4126 41.4240 175.6125 37 A 4.6426 8.9805 126.2666 54.3560 18.8762 180.1947 38 T 3.7920 7.7690 110.6463 66.1775 68.5627 174.5296 39 Y 4.6243 8.4506 117.6814 56.7817 38.9308 176.2620 40 G 4.1477 8.3817 107.6110 46.2174 0.0000 172.8763 41 K 4.4254 7.7787 119.4996 55.1044 33.6982 175.5859 42 L 5.0057 8.1194 125.8515 53.2277 46.0624 175.7966 43 T 4.6206 8.3209 118.3661 62.0272 72.3018 172.9863 44 L 4.8879 8.7890 125.4976 52.9620 47.1816 175.3808 45 K 4.7584 8.4527 121.9521 54.8213 35.4523 174.7495 46 F 5.3644 8.9071 126.3858 55.7168 41.6724 174.6067 47 I 5.0633 9.3768 125.1432 59.5872 40.2271 174.5983 48 C 5.1055 9.1707 127.9169 59.2572 30.8901 173.3810 49 T 4.2884 9.4233 118.4109 62.9444 69.6413 175.3480 50 T 4.5426 8.0390 112.8174 61.5601 70.3085 174.1510 51 G 4.1105 8.2090 107.9249 45.7459 0.0000 174.6974 52 K 4.3732 8.2015 123.5259 55.2890 33.1992 176.1192 53 L 3.7379 10.6429 123.5979 53.9741 42.2464 176.2532 54 P 4.1004 0.0000 0.0000 64.3418 31.7149 175.5732 55 V 4.0474 6.2316 110.7616 59.1035 35.2971 172.1406 56 P 4.6147 0.0000 0.0000 61.6711 32.0171 176.3341 57 W 4.5887 8.3415 122.7195 59.7989 28.9586 176.5024 58 P 4.1511 0.0000 0.0000 66.3888 30.7909 178.6177 59 T 4.2166 8.2518 107.7634 64.0639 68.9537 175.5437 60 L 4.1038 8.8131 121.6488 54.7182 41.6640 178.4141 61 V 3.5343 7.5319 119.6189 66.3414 31.1907 177.9670 62 T 3.9972 7.8602 107.3982 64.5448 68.8233 176.2375 63 T 4.0872 7.0463 112.5203 64.7713 68.1981 177.4593 64 F 4.9695 7.9481 120.8629 56.8661 38.5929 175.8905 *68 L 4.3522 7.6605 114.6791 54.7782 43.2543 179.0911 69 Q 3.8431 7.7171 118.5990 58.4000 29.1581 179.2368 70 C 4.2592 7.9897 111.6682 60.4096 29.9553 174.2061 71 F 4.2199 8.3635 118.4858 57.5189 38.7249 175.2658 72 A 4.4046 7.5349 123.0357 51.9060 19.4558 177.5947 73 R 4.4325 8.6194 120.7425 55.1551 31.5618 174.7189 74 Y 4.4772 8.6180 125.0424 55.8251 39.0435 174.4495 75 P 4.3700 0.0000 0.0000 62.2595 32.6142 176.5798 76 D 4.4166 9.0355 120.2160 58.1983 40.7473 178.8340 77 H 4.3512 8.3841 112.6402 57.9243 28.7536 175.9690 78 M 4.5499 8.2608 120.6593 54.8859 32.3467 177.3247 79 K 3.8405 8.0011 121.0626 59.5037 32.1059 178.4335 80 R 3.9853 7.8561 112.0266 57.9216 29.2157 176.3678 81 H 4.6578 8.1770 115.0988 55.7861 30.0159 174.8968 82 D 3.7338 7.6661 120.6938 53.1773 39.5243 176.2178 83 F 4.2600 8.2023 127.3098 60.4112 39.8842 177.0070 84 F 4.2799 7.4820 117.5408 60.7508 38.6670 177.0128 85 K 4.3344 8.3906 119.1106 58.3228 32.3279 179.5327 86 S 3.9906 7.4597 112.7674 61.0417 62.9248 175.7498 87 A 3.9807 7.6842 123.8373 54.6284 18.3628 177.5186 88 M 4.5470 7.8520 114.4881 54.5609 32.6686 175.0025 89 P 4.5008 0.0000 0.0000 65.3326 31.8666 178.6745 90 E 3.6507 8.0121 117.2302 59.5872 29.7012 177.5850 91 G 3.8776 9.7604 104.3645 44.6291 0.0000 171.2751 92 Y 5.4339 8.2686 115.8210 55.3980 42.2743 174.0788 93 V 5.0300 9.7561 121.1099 61.4081 34.1612 174.0908 94 Q 5.2471 9.1655 128.4845 54.4842 31.8917 173.7982 95 E 5.4569 9.4824 125.8364 55.0588 33.3613 175.2409 96 R 5.5083 9.7125 121.5930 54.9727 35.2737 174.0848 97 T 4.9072 8.5086 116.5549 61.9439 72.6302 172.9646 98 I 4.2466 9.0922 127.7204 59.3796 40.2264 174.9049 99 F 4.5846 8.5563 127.4406 56.5061 40.0741 175.3038 100 F 4.6238 9.0232 124.3587 55.9562 40.0857 175.8136 101 K 4.0059 9.2649 126.6047 58.0986 32.3545 175.6917 102 D 4.4116 9.0161 122.8685 54.8605 39.9635 172.0425 103 D 4.5485 8.0066 115.6178 52.9917 44.2501 174.0802 104 G 2.8280 7.6874 106.7453 45.5061 0.0000 172.2196 105 N 5.7557 8.2467 116.1532 51.3705 40.5832 173.3970 106 Y 5.5999 9.4443 119.0074 56.8115 40.8959 174.4685 107 K 5.0885 9.0185 122.8257 55.0049 35.5055 174.8438 108 T 5.1576 9.5609 121.6538 60.4063 71.4099 172.1998 109 R 5.3388 8.7176 127.6249 54.6016 33.3689 173.8808 110 A 5.3505 9.6141 126.9099 50.3795 23.5988 174.5966 111 E 5.0672 9.1305 119.7918 54.6452 32.5095 175.4580 112 V 4.8452 8.2668 126.1862 59.9541 33.6900 175.2794 113 K 4.5588 8.9496 124.4567 56.2103 36.3234 173.7386 114 F 4.6744 8.4410 119.3040 57.3335 40.0690 176.7797 115 E 4.6212 9.2009 121.9421 54.6776 31.3913 177.0641 116 G 4.1086 8.1445 116.9451 46.5759 0.0000 173.3227 117 D 4.7736 8.8972 124.6789 54.6188 41.4841 175.9555 118 T 4.5638 7.8232 117.2169 62.4890 70.4531 173.6156 119 L 4.0348 8.7716 128.7432 53.6732 43.4528 175.0884 120 V 4.6993 8.9506 128.0419 61.1904 34.1652 174.0971 121 N 5.2197 9.0516 125.6035 52.1200 41.5023 172.5648 122 R 5.0870 8.7736 126.0289 54.5940 32.5925 175.7667 123 I 5.2261 9.7540 124.7286 59.5706 41.5561 174.0629 124 E 4.9605 8.9442 125.7557 54.5685 31.8425 174.6148 125 L 4.9038 8.8693 127.4059 52.9884 45.0860 174.8782 126 K 5.0014 9.1723 127.7551 54.7133 35.1878 174.8732 127 G 5.2076 9.6713 115.7017 44.8224 0.0000 171.8484 128 I 5.2317 8.4713 114.4204 59.2538 41.6485 174.4940 129 D 4.6099 8.7315 120.4735 55.5473 37.9222 174.3845 130 F 4.5555 8.3427 116.3355 56.9778 40.0217 175.1826 131 K 4.5655 8.6864 122.8909 54.5107 33.3568 177.5791 132 E 3.7602 8.9937 122.7481 59.0927 29.5673 177.3268 133 D 4.6736 7.9993 116.4329 52.9850 39.8170 177.0056 134 G 3.9162 8.4417 109.0640 44.7042 0.0000 174.2290 135 N 4.4253 8.1079 117.0132 56.3742 38.4715 176.7993 136 I 3.9472 7.6310 121.5948 63.1630 37.0813 177.5891 137 L 3.7846 7.6133 123.9483 57.0414 42.0578 178.6055 138 G 4.2056 7.7318 105.2328 44.7644 0.0000 172.8688 139 H 3.9010 7.7070 115.5755 57.3781 25.9388 175.1250 140 K 4.5876 8.9673 116.6850 56.2449 33.7039 177.6952 141 L 4.8159 7.7688 120.1119 54.0723 42.7723 176.5515 142 E 4.2648 9.1204 122.0782 55.6625 30.3257 177.2713 143 Y 4.6176 8.2829 124.2951 56.3476 37.2675 172.9570 144 N 4.8198 7.2617 117.2832 53.0190 40.6127 173.3374 145 Y 4.3728 7.9394 115.8612 57.2369 41.3725 173.1761 146 N 5.1482 7.9303 121.2519 50.8440 41.8777 174.6334 147 S 4.5378 8.4906 114.6045 58.8029 63.6529 173.0643 148 Q 4.6092 8.5558 119.5070 55.7632 33.0031 171.8981 149 N 5.2559 8.9626 121.7509 51.4611 41.0161 174.0689 150 V 4.0510 8.9613 124.1916 61.1338 33.8406 174.4246 151 Y 4.3621 8.5058 125.1021 57.3067 38.6991 173.9208 152 I 4.6470 8.1362 126.6821 59.9506 38.9944 175.1783 153 M 5.5301 8.6770 123.3000 51.9779 34.9376 174.4784 154 A 4.2824 8.7095 122.3362 52.0261 19.7236 177.0300 155 D 4.5728 8.8084 122.5677 52.2790 41.8425 176.7089 156 K 4.1413 8.7958 125.5136 59.5943 32.9792 179.2188 157 Q 3.9063 8.0015 116.5847 59.2275 28.6459 179.0625 158 K 4.1912 8.2027 112.9986 56.1372 32.1393 176.2471 159 N 4.3510 9.7858 116.2666 54.0724 38.8412 173.9187 160 G 3.8047 8.7173 106.8526 44.6329 0.0000 172.3513 161 I 4.8818 8.2108 116.0303 58.7204 41.3426 174.9357 162 K 5.0338 9.0768 125.0875 54.7858 35.0315 174.9864 163 V 4.6417 9.5931 127.6110 61.1366 35.3841 173.4951 164 N 5.2710 8.4589 121.8922 51.7863 41.4398 173.2703 165 F 5.1184 8.4273 119.8262 55.8521 41.7592 173.2374 166 K 4.8038 8.7081 118.8387 55.0023 34.7579 175.8641 167 I 4.6065 8.0165 121.9337 59.6744 41.6533 174.5249 168 R 4.5381 8.4126 124.7683 54.8426 32.1608 174.9213 169 H 4.7422 8.9269 121.8671 54.5569 31.3285 174.2993 170 N 5.1772 8.5635 118.4490 52.6218 40.5323 174.1351 171 I 4.7379 9.3218 125.3234 59.8369 38.4561 176.8401 172 E 4.0839 9.7710 126.3733 59.5875 29.2640 177.8729 173 D 4.5111 8.0465 115.8527 53.5870 39.3819 176.9459 174 G 3.8515 8.7544 108.4451 45.5351 0.0000 173.5231 175 S 4.6574 8.1719 115.4209 56.9982 65.1855 172.1733 176 V 4.8530 8.2313 119.6435 61.0523 33.8252 174.8468 177 Q 4.5894 9.4403 129.9486 54.0944 30.8895 174.4382 178 L 4.5460 8.5084 127.1549 54.8366 43.1099 176.4540 179 A 4.3016 8.5807 124.1808 49.9408 21.4457 174.0370 180 D 4.5376 9.1543 122.0273 55.0953 41.9637 175.8691 181 H 4.9553 8.9743 121.5198 54.8326 31.2698 174.1026 182 Y 4.8340 8.1761 116.5155 56.8395 42.4839 174.0029 183 Q 5.0533 9.7749 124.0818 55.1263 33.3143 172.6073 184 Q 5.1944 8.9383 125.5630 54.3930 32.9088 173.6127 185 N 6.3000 9.2609 121.9243 50.9288 42.2139 173.5815 186 T 5.2799 8.5944 112.2690 59.0914 72.5456 171.6059 187 P 4.7757 0.0000 0.0000 63.6717 31.6510 176.0239 188 I 4.1691 9.0327 121.5427 62.3032 38.1857 176.0260 189 G 4.0739 7.9232 110.3205 44.3136 0.0000 172.7687 190 D 4.7678 8.4827 118.1185 53.6980 41.4660 176.9758 191 G 3.8426 7.7164 106.6009 44.8516 0.0000 171.6476 192 P 4.4453 0.0000 0.0000 62.2142 32.1398 176.0767 193 V 4.2313 8.1212 113.9999 59.3889 34.7625 175.1331 194 L 4.3076 9.3697 123.7733 53.5259 40.9984 175.2164 195 L 4.4214 8.3028 127.0070 53.4060 41.7789 175.4939 196 P 4.9207 0.0000 0.0000 61.6792 32.8624 175.3924 197 D 4.6923 8.1080 119.1228 53.4413 41.9691 176.1231 198 N 5.0603 8.6368 118.3504 53.8319 39.6736 174.0348 199 H 4.7915 8.2245 117.7565 56.0621 32.5723 171.1803 200 Y 4.9737 8.8150 114.2215 57.7390 43.4657 173.4373 201 L 5.0547 8.7137 120.3599 53.1169 44.8227 175.7267 202 S 4.9108 8.8971 119.5770 56.9118 64.1910 172.4896 203 Y 5.8551 9.8160 124.8163 55.9184 41.5705 174.8010 204 Q 5.0302 8.5481 119.0898 54.9708 33.5120 173.9726 205 S 5.2067 8.8471 118.4724 56.9374 67.4521 173.2402 206 A 4.6679 9.6086 126.2176 50.2076 21.6556 174.8802 207 L 5.0795 8.4975 122.9225 54.1253 43.4705 176.1051 208 S 4.9157 9.8772 117.2256 57.5364 67.1986 172.5959 209 K 4.6370 8.6387 118.3721 54.5750 34.4713 176.0679 210 D 4.6463 8.8585 122.4123 52.1481 40.7031 174.8612 211 P 4.2206 0.0000 0.0000 65.7727 31.2588 177.0892 212 N 4.5407 8.0325 114.4176 54.5517 39.2312 175.6831 213 E 3.8913 8.0095 118.7294 56.3781 29.9297 176.3094 214 K 4.3410 8.4976 125.1244 56.4399 33.3406 176.1285 215 R 4.4176 7.8310 117.0533 54.9476 31.7026 175.2485 216 D 4.7283 8.5932 119.1854 55.9098 41.9431 174.6483 217 H 5.0402 8.4923 119.8288 55.2883 31.5237 172.5300 218 M 4.3245 8.1405 118.6260 53.5058 35.1673 173.8344 219 V 4.7114 8.6784 126.0599 61.2644 33.9569 174.1898 220 L 5.1908 8.8862 129.0096 53.2329 45.9182 174.4876 221 L 5.0217 9.1806 127.9536 53.4540 44.6225 174.8679 222 E 5.2968 8.3756 125.0124 54.6329 34.0733 175.0809 223 F 5.3899 9.1243 119.3003 56.1144 43.8077 174.2822 224 V 5.2293 8.8992 122.3791 61.8183 35.2137 173.3539 225 T 5.1036 8.1920 123.0368 61.5220 72.4739 173.1653 226 A 4.4510 8.6332 128.0433 52.0634 19.3010 176.3082 227 A 4.4502 9.7466 122.4312 51.2906 23.1249 177.3804 228 G 4.2326 9.8717 106.8051 45.5132 0.0000 174.1141 229 I 4.2428 7.3237 124.6062 61.5752 38.2527 174.8792 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 S 8.19 4.34 0.00 4.07 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 3 K 8.63 4.18 0.00 1.76 1.77 0.00 1.70 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.35 1.41 7.81 4 G 7.79 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 E 7.89 3.97 0.00 2.24 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 2.32 2.32 0.00 6 E 8.34 4.00 0.00 2.18 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 2.34 2.37 0.00 7 L 7.74 3.79 0.00 0.92 0.83 0.76 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 8 F 8.26 4.71 0.00 3.22 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 9 T 7.28 3.93 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 10 G 7.59 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.66 4.05 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 0.81 0.00 0.00 0.99 0.00 0.00 12 V 9.34 4.68 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 1.15 0.00 0.00 1.21 0.00 0.00 13 P 0.00 4.78 0.00 2.15 2.15 0.00 3.99 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 2.03 0.00 14 I 8.45 5.11 1.70 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.97 0.79 0.00 0.00 15 L 8.78 5.00 0.00 1.57 1.52 0.90 0.79 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 16 V 8.78 5.05 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 1.00 0.00 0.00 1.02 0.00 0.00 17 E 9.42 5.24 0.00 1.89 1.82 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 2.22 2.37 0.00 18 L 9.09 5.17 0.00 2.00 1.76 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 19 D 9.33 5.18 0.00 2.72 2.37 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 20 G 8.89 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.49 4.88 0.00 2.61 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 22 V 8.69 4.68 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.02 0.00 0.00 23 N 9.99 4.35 0.00 3.21 2.97 0.00 0.00 6.68 7.22 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 24 G 8.55 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 0.00 0.00 0.00 25 H 8.43 4.69 0.00 3.39 3.30 0.00 5.82 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.36 4.84 0.00 1.66 1.71 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.61 7.81 27 F 8.33 5.13 0.00 3.15 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 28 S 8.56 5.18 0.00 3.81 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 29 V 8.88 5.77 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 1.69 0.00 0.00 1.43 0.00 0.00 30 S 8.97 5.38 0.00 3.82 3.70 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 31 G 8.93 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 6.45 5.14 0.00 1.84 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 2.07 1.91 0.00 33 G 8.10 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 E 7.71 4.99 0.00 1.98 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 2.17 2.21 0.00 35 G 9.00 3.39 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 0.00 36 D 9.22 5.44 0.00 2.85 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 37 A 8.98 4.64 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 38 T 7.77 3.79 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 39 Y 8.45 4.62 0.00 3.10 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 40 G 8.38 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 41 K 7.78 4.43 0.00 2.42 1.82 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.17 0.96 7.81 42 L 8.12 5.01 0.00 1.45 1.34 0.94 0.34 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 43 T 8.32 4.62 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 1.10 0.00 0.00 44 L 8.79 4.89 0.00 1.50 0.66 0.96 0.13 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 45 K 8.45 4.76 0.00 1.56 1.37 0.00 1.49 0.00 0.00 1.53 0.00 0.00 2.72 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.18 1.31 7.81 46 F 8.91 5.36 0.00 2.61 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 I 9.38 5.06 1.93 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 1.13 0.84 1.01 0.00 0.00 48 C 9.17 5.11 0.00 3.13 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 9.42 4.29 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 1.32 0.00 0.00 50 T 8.04 4.54 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 1.32 0.00 0.00 51 G 8.21 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 52 K 8.20 4.37 0.00 1.69 1.67 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.48 7.81 53 L 10.64 3.74 0.00 1.07 0.89 0.31 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.10 0.00 1.93 2.02 0.00 2.55 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.88 0.00 55 V 6.23 4.05 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 0.31 0.00 0.00 0.46 0.00 0.00 56 P 0.00 4.61 0.00 2.15 1.99 0.00 3.38 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.94 0.00 57 W 8.34 4.59 0.00 3.65 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.15 0.00 2.38 2.64 0.00 3.95 0.00 0.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.25 0.00 59 T 8.25 4.22 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 60 L 8.81 4.10 0.00 1.32 0.13 0.78 0.35 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 61 V 7.53 3.53 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 0.58 0.00 0.00 0.95 0.00 0.00 62 T 7.86 4.00 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 63 T 7.05 4.09 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 64 F 7.95 4.97 0.00 3.01 2.54 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 *68 L 7.66 4.35 0.00 1.83 1.97 1.05 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 7.72 3.84 0.00 0.93 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.92 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 70 C 7.99 4.26 0.00 2.80 3.40 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 71 F 8.36 4.22 0.00 3.28 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 72 A 7.53 4.40 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 73 R 8.62 4.43 0.00 2.16 1.83 0.00 3.04 0.00 0.00 3.26 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 74 Y 8.62 4.48 0.00 2.86 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 75 P 0.00 4.37 0.00 1.89 1.99 0.00 3.47 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 2.01 2.03 0.00 76 D 9.04 4.42 0.00 2.72 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.38 4.35 0.00 3.40 3.43 0.00 5.55 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 78 M 8.26 4.55 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.61 0.00 79 K 8.00 3.84 0.00 1.74 1.84 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.17 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.71 1.61 7.81 80 R 7.86 3.99 0.00 1.81 1.98 0.00 2.94 0.00 0.00 3.19 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.27 0.00 81 H 8.18 4.66 0.00 3.30 3.32 0.00 5.65 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 82 D 7.67 3.73 0.00 1.58 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 8.20 4.26 0.00 2.93 2.27 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 84 F 7.48 4.28 0.00 3.36 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 85 K 8.39 4.33 0.00 1.79 1.91 0.00 1.49 0.00 0.00 1.52 0.00 0.00 2.73 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.30 0.90 7.81 86 S 7.46 3.99 0.00 3.87 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 87 A 7.68 3.98 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 88 M 7.85 4.55 0.00 2.21 2.38 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.25 2.94 0.00 89 P 0.00 4.50 0.00 2.17 1.99 0.00 3.59 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 2.03 1.92 0.00 90 E 8.01 3.65 0.00 2.31 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 0.00 2.34 2.44 0.00 91 G 9.76 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 Y 8.27 5.43 0.00 3.42 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 93 V 9.76 5.03 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 1.11 0.00 0.00 1.04 0.00 0.00 94 Q 9.17 5.25 0.00 2.51 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.52 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 95 E 9.48 5.46 0.00 1.98 1.85 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 2.27 2.32 0.00 96 R 9.71 5.51 0.00 1.67 1.82 0.00 3.21 0.00 0.00 3.37 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.59 0.00 97 T 8.51 4.91 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 0.36 0.00 0.00 98 I 9.09 4.25 1.86 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 0.90 1.01 -0.03 0.00 0.00 99 F 8.56 4.58 0.00 3.07 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 0.00 100 F 9.02 4.62 0.00 3.27 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 0.00 101 K 9.26 4.01 0.00 1.67 1.76 0.00 1.95 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.39 7.81 102 D 9.02 4.41 0.00 2.85 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 0.00 103 D 8.01 4.55 0.00 2.85 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 0.00 104 G 7.69 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 0.00 0.00 0.00 105 N 8.25 5.76 0.00 2.31 2.72 0.00 0.00 7.36 7.08 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 0.00 106 Y 9.44 5.60 0.00 3.02 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 0.00 107 K 9.02 5.09 0.00 1.96 1.63 0.00 1.38 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.54 7.81 108 T 9.56 5.16 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 0.00 109 R 8.72 5.34 0.00 1.87 1.75 0.00 3.14 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 110 A 9.61 5.35 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 0.00 111 E 9.13 5.07 0.00 1.94 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 2.25 2.27 0.00 112 V 8.27 4.85 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 0.70 0.00 0.00 0.62 0.00 0.00 113 K 8.95 4.56 0.00 1.93 1.87 0.00 1.35 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.18 1.29 7.81 114 F 8.44 4.67 0.00 3.00 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 0.00 115 E 9.20 4.62 0.00 1.94 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 2.23 2.38 0.00 116 G 8.14 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 0.00 117 D 8.90 4.77 0.00 2.73 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 0.00 118 T 7.82 4.56 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 1.20 0.00 0.00 119 L 8.77 4.03 0.00 1.07 1.58 0.98 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.95 4.70 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 0.86 0.00 0.00 0.89 0.00 0.00 121 N 9.05 5.22 0.00 2.83 2.73 0.00 0.00 6.90 7.17 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 0.00 122 R 8.77 5.09 0.00 1.84 1.84 0.00 3.13 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 123 I 9.75 5.23 1.98 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 1.35 0.81 0.95 0.00 0.00 124 E 8.94 4.96 0.00 1.93 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 2.21 2.22 0.00 125 L 8.87 4.90 0.00 1.51 1.29 0.27 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 126 K 9.17 5.00 0.00 1.82 1.62 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.41 7.81 127 G 9.67 5.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 I 8.47 5.23 1.90 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 1.27 1.50 0.98 0.00 0.00 129 D 8.73 4.61 0.00 2.72 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 0.00 130 F 8.34 4.56 0.00 3.17 2.86 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 0.00 131 K 8.69 4.57 0.00 1.89 1.92 0.00 1.68 0.00 0.00 1.87 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.60 7.81 132 E 8.99 3.76 0.00 2.06 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 0.00 2.30 2.39 0.00 133 D 8.00 4.67 0.00 2.80 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 G 8.44 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 0.00 0.00 0.00 135 N 8.11 4.43 0.00 2.94 2.86 0.00 0.00 7.47 7.20 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 0.00 136 I 7.63 3.95 1.65 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 0.81 0.28 0.01 0.00 0.00 137 L 7.61 3.78 0.00 1.86 1.64 1.02 0.62 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 0.00 138 G 7.73 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 H 7.71 3.90 0.00 3.27 3.34 0.00 5.62 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.97 4.59 0.00 1.73 1.95 0.00 1.70 0.00 0.00 1.77 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.44 7.81 141 L 7.77 4.82 0.00 1.57 1.65 0.90 1.03 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 0.00 142 E 9.12 4.26 0.00 1.86 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 2.40 2.49 0.00 143 Y 8.28 4.62 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 0.00 144 N 7.26 4.82 0.00 2.82 2.80 0.00 0.00 6.10 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 0.00 145 Y 7.94 4.37 0.00 2.87 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 N 7.93 5.15 0.00 2.65 2.67 0.00 0.00 6.98 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 0.00 147 S 8.49 4.54 0.00 4.13 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 0.00 148 Q 8.56 4.61 0.00 2.16 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 149 N 8.96 5.26 0.00 2.35 2.29 0.00 0.00 6.73 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 0.00 150 V 8.96 4.05 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 0.60 0.00 0.00 0.13 0.00 0.00 151 Y 8.51 4.36 0.00 2.97 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 0.00 152 I 8.14 4.65 1.57 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 1.39 1.26 0.92 0.00 0.00 153 M 8.68 5.53 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.36 0.00 154 A 8.71 4.28 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 0.00 155 D 8.81 4.57 0.00 2.72 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.80 4.14 0.00 1.82 1.77 0.00 1.81 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.46 7.81 157 Q 8.00 3.91 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.94 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 158 K 8.20 4.19 0.00 1.95 1.85 0.00 1.79 0.00 0.00 1.91 0.00 0.00 3.11 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.50 7.81 159 N 9.79 4.35 0.00 2.82 2.90 0.00 0.00 6.80 7.86 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 0.00 160 G 8.72 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 0.00 0.00 0.00 161 I 8.21 4.88 1.74 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 0.50 0.42 0.16 0.00 0.00 162 K 9.08 5.03 0.00 1.81 1.65 0.00 1.75 0.00 0.00 1.93 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.43 7.81 163 V 9.59 4.64 2.34 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 1.14 0.00 0.00 1.03 0.00 0.00 164 N 8.46 5.27 0.00 2.74 2.64 0.00 0.00 6.96 6.90 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 0.00 165 F 8.43 5.12 0.00 3.25 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 0.00 166 K 8.71 4.80 0.00 1.62 1.70 0.00 1.54 0.00 0.00 1.64 0.00 0.00 2.69 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.40 7.81 167 I 8.02 4.61 1.97 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 0.91 1.30 0.55 0.00 0.00 168 R 8.41 4.54 0.00 1.56 1.77 0.00 3.17 0.00 0.00 3.20 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 169 H 8.93 4.74 0.00 3.11 3.22 0.00 5.60 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 N 8.56 5.18 0.00 2.69 2.83 0.00 0.00 6.94 7.78 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 0.00 171 I 9.32 4.74 2.06 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 1.47 0.61 1.02 0.00 0.00 172 E 9.77 4.08 0.00 2.00 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 0.00 2.62 2.29 0.00 173 D 8.05 4.51 0.00 2.82 2.82 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 0.00 174 G 8.75 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 0.00 175 S 8.17 4.66 0.00 3.94 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 0.00 176 V 8.23 4.85 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 0.84 0.00 0.00 0.94 0.00 0.00 177 Q 9.44 4.59 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 178 L 8.51 4.55 0.00 1.61 1.55 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 179 A 8.58 4.30 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 0.00 180 D 9.15 4.54 0.00 2.78 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 0.00 181 H 8.97 4.96 0.00 1.49 2.71 0.00 5.78 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 0.00 182 Y 8.18 4.83 0.00 3.13 2.92 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 0.00 183 Q 9.77 5.05 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 184 Q 8.94 5.19 0.00 2.26 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.53 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 185 N 9.26 6.30 0.00 2.52 2.70 0.00 0.00 6.38 6.63 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 0.00 186 T 8.59 5.28 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 1.31 0.00 0.00 187 P 0.00 4.78 0.00 2.18 2.17 0.00 3.66 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.46 0.00 188 I 9.03 4.17 1.99 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 1.24 0.70 0.95 0.00 0.00 189 G 7.92 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 D 8.48 4.77 0.00 2.63 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 0.00 191 G 7.72 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 0.00 192 P 0.00 4.45 0.00 2.18 2.06 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 193 V 8.12 4.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 1.17 0.00 0.00 194 L 9.37 4.31 0.00 1.62 1.56 0.87 0.72 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 0.00 195 L 8.30 4.42 0.00 1.69 1.62 0.91 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 196 P 0.00 4.92 0.00 2.28 2.32 0.00 3.70 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 1.95 1.98 0.00 197 D 8.11 4.69 0.00 2.61 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 N 8.64 5.06 0.00 2.59 2.75 0.00 0.00 7.15 8.16 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 0.00 199 H 8.22 4.79 0.00 3.49 3.29 0.00 5.50 0.00 0.00 0.00 0.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 8.82 4.97 0.00 2.58 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 0.00 201 L 8.71 5.05 0.00 1.58 1.28 0.94 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 202 S 8.90 4.91 0.00 3.68 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 Y 9.82 5.86 0.00 3.07 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 0.00 204 Q 8.55 5.03 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.86 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 205 S 8.85 5.21 0.00 3.55 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 A 9.61 4.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 L 8.50 5.08 0.00 0.95 0.95 0.64 0.76 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 0.00 208 S 9.88 4.92 0.00 3.73 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 0.00 209 K 8.64 4.64 0.00 1.72 1.73 0.00 1.29 0.00 0.00 0.96 0.00 0.00 2.30 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.18 1.32 7.81 210 D 8.86 4.65 0.00 2.63 2.43 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 0.00 211 P 0.00 4.22 0.00 2.20 2.21 0.00 3.79 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 1.99 2.04 0.00 212 N 8.03 4.54 0.00 2.86 2.88 0.00 0.00 6.98 7.04 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 0.00 213 E 8.01 3.89 0.00 1.70 1.63 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 1.93 2.37 0.00 214 K 8.50 4.34 0.00 1.73 1.79 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.43 7.81 215 R 7.83 4.42 0.00 1.95 1.92 0.00 3.26 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 1.64 1.65 0.00 216 D 8.59 4.73 0.00 2.87 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 0.00 217 H 8.49 5.04 0.00 3.24 3.27 0.00 5.52 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 M 8.14 4.32 0.00 1.07 0.57 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 2.44 2.36 0.00 219 V 8.68 4.71 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 0.88 0.00 0.00 0.93 0.00 0.00 220 L 8.89 5.19 0.00 1.74 1.57 0.82 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 221 L 9.18 5.02 0.00 1.63 1.55 0.37 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 222 E 8.38 5.30 0.00 1.82 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 2.17 2.24 0.00 223 F 9.12 5.39 0.00 2.97 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 V 8.90 5.23 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 -0.07 0.00 0.00 0.45 0.00 0.00 225 T 8.19 5.10 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 226 A 8.63 4.45 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 A 9.75 4.45 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 G 9.87 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 0.00 0.00 0.00 229 I 7.32 4.24 1.91 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.99 0.97 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.