NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4614 8.1633 120.3514 55.4161 34.5313 177.4723 2 K 3.8289 8.0400 118.3232 59.1766 31.9653 177.4084 3 D 4.3987 8.2987 118.9264 57.2797 41.2095 178.3606 4 K 3.9699 7.9976 119.7150 59.2602 32.2626 178.8662 5 I 3.6982 8.0433 120.3750 64.4545 37.0320 178.4760 6 I 3.6648 8.0728 120.8677 64.3964 36.6977 177.9141 7 D 4.3044 8.3029 119.0297 57.6314 41.0337 178.1755 8 N 4.2915 8.2890 116.5763 55.8312 38.4621 177.4044 9 A 3.5890 8.2266 122.8834 55.0164 18.4251 179.5553 10 I 3.6389 7.9895 118.7183 64.8806 37.1572 178.7911 11 T 3.7271 7.4335 116.1189 66.4676 68.2154 176.7494 12 L 3.8214 7.6338 120.7020 57.9332 41.5923 179.5972 13 F 4.5387 8.3737 118.2583 60.7292 38.6235 177.9567 14 S 4.2868 8.1585 113.1283 61.0968 62.8641 176.0903 15 E 4.0617 7.8140 120.9449 58.5010 29.6372 178.2155 16 K 4.3400 8.3888 116.1606 54.8356 33.4568 177.9497 17 G 4.1092 7.9455 104.4107 45.1892 0.0000 173.8097 18 Y 3.9880 8.4377 119.3266 60.7849 38.6882 178.5112 19 D 4.0644 8.0612 117.6764 56.8181 41.0606 177.6508 20 G 3.7581 7.4723 105.5219 46.4342 0.0000 173.5076 21 T 4.5519 7.3396 117.5466 62.2673 70.1562 174.7430 22 T 4.6253 8.3973 115.6703 59.5349 72.8772 175.4846 23 L 3.9501 8.2914 121.4191 58.0924 41.5957 179.6059 24 D 4.5314 7.8844 119.8280 56.6980 40.7768 178.2526 25 D 4.2977 7.9588 119.5475 57.2996 40.8155 178.9682 26 I 3.5776 7.5326 120.4495 64.3531 37.2929 178.6166 27 S 4.0916 8.4504 115.4864 61.3517 62.3795 176.3885 28 K 4.0106 8.1655 123.5015 59.1873 31.7185 178.9480 29 S 4.1044 8.0219 113.5837 60.9146 62.9853 175.9116 30 V 4.0032 7.6225 112.7428 59.7430 32.7933 175.2522 31 N 4.1782 7.7260 115.0937 53.9283 35.8829 173.0974 32 I 4.6987 7.6226 109.5454 59.0190 41.7064 175.5371 33 K 4.3469 8.2498 120.0476 55.5391 33.2332 178.3099 34 K 3.7640 8.7631 120.3120 59.8692 30.4502 179.1554 35 A 4.4092 8.2347 120.3076 55.6578 17.7423 179.6292 36 S 4.3259 8.2287 113.2711 61.0484 62.7991 176.6618 37 L 4.1000 8.3243 123.9000 58.4445 41.6898 178.5835 38 Y 5.1936 7.0383 114.0067 60.3883 37.7976 177.4265 39 Y 4.1653 7.6434 119.0360 60.2520 38.8906 176.5376 40 H 4.3985 8.0145 115.3139 55.9866 30.4084 174.7807 41 Y 4.9163 7.8001 116.8460 56.2699 41.6443 175.9307 42 D 4.7071 8.9342 121.8998 56.3816 41.5728 176.1597 43 N 4.7460 7.7061 115.4909 51.0253 40.7186 174.9496 44 K 4.0578 8.5057 120.5801 59.6176 32.1205 178.0633 45 E 4.1389 8.4503 119.3663 59.3566 29.6386 178.5126 46 E 4.1612 9.0420 119.0648 59.3666 29.5285 179.3895 47 I 3.2314 7.5864 120.2361 64.1457 37.0513 177.8200 48 Y 3.9497 8.4654 120.7208 60.5408 38.5476 177.8311 49 R 3.7375 8.4082 120.0696 59.6420 30.0905 178.6911 50 K 4.0439 8.0785 118.0108 59.4206 31.9318 179.6416 51 S 4.1182 8.0279 115.7102 61.4640 62.6788 176.8762 52 V 3.4553 7.8035 121.3898 65.9323 31.2101 177.9903 53 E 4.0344 8.4157 118.5612 59.3595 29.2174 178.7583 54 N 4.4105 8.5279 117.3534 56.7816 39.0039 176.4076 55 C 4.4831 8.4103 120.1199 62.8438 31.6698 175.6201 56 F 4.3729 8.5731 119.4038 60.7726 38.4222 177.4286 57 N 4.4887 8.7296 116.2660 56.4198 38.3364 176.7885 58 Y 3.8615 8.3664 121.1295 60.7845 38.9630 178.2969 59 F 4.2148 8.3751 118.6914 60.3421 38.9436 177.9522 60 I 3.9347 8.4058 119.8264 64.6507 36.9610 178.0640 61 D 4.4027 8.4683 120.0535 57.4798 40.4134 178.6740 62 F 3.8335 7.9505 119.9821 61.1950 39.3518 176.9722 63 L 4.5514 7.8786 117.2766 58.0129 41.6779 179.1218 64 L 4.4583 8.3194 118.2579 55.5240 41.6989 177.5290 65 R 4.3558 7.9379 115.1140 54.1203 31.4781 174.3907 *68 D 4.2907 8.6152 122.0146 54.3474 42.3235 176.2829 69 D 4.3631 8.4250 127.6119 53.6257 40.3509 176.4335 70 N 4.7687 7.4222 118.0034 52.2778 41.0113 173.6366 71 Y 4.3246 8.3767 122.2791 57.7426 38.2749 176.3428 72 S 4.5151 8.2976 116.6276 57.7282 65.6849 174.6203 73 I 3.9968 8.2613 122.0312 64.7425 36.8728 178.1490 74 D 4.5002 8.2622 118.5007 57.2534 41.0741 178.3640 75 G 3.8916 8.1720 107.5514 46.8636 0.0000 175.5054 76 L 3.6243 8.2257 122.8498 58.1145 42.0046 178.5909 77 Y 3.9452 8.1465 116.4952 60.9748 37.7445 177.9724 78 Q 4.1725 8.2107 120.2341 58.9069 29.1193 177.8920 79 F 4.3230 8.6122 121.9458 61.3953 39.4196 177.1146 80 L 3.9297 8.1810 118.5899 57.7172 41.4509 179.2387 81 F 4.2287 8.6970 120.6607 61.4219 39.3318 177.3381 82 K 4.0977 8.6990 118.4106 59.3481 31.9430 179.1009 83 F 3.7451 8.3726 120.9991 61.2535 39.0484 177.3493 84 I 2.6444 7.5821 118.1573 63.9578 36.8925 177.9405 85 F 4.0258 8.0621 117.1843 59.0455 39.1498 176.5336 86 D 4.6993 8.3540 116.2995 54.4396 41.5503 176.8301 87 V 3.6331 6.8977 119.5192 61.8058 32.2128 175.0071 88 D 4.3906 8.8750 127.3666 54.2475 41.5178 176.7406 89 E 3.9340 8.8993 126.7982 59.5431 29.3572 179.5063 90 R 3.8193 8.5849 118.6735 59.3912 30.0128 178.6711 91 Y 3.8603 7.7200 116.0472 60.9580 37.7098 178.4866 92 I 3.9746 7.8135 120.3889 64.3642 37.3289 178.2768 93 K 3.9412 8.1190 120.5653 59.2790 31.7904 178.6571 94 L 4.0067 7.9298 119.9760 58.1217 42.2643 178.1403 95 Y 3.9317 8.4017 119.5829 60.8158 38.4734 178.1233 96 V 3.7313 8.3038 119.2683 66.0728 31.5265 177.2741 97 Q 4.3026 8.1242 115.8853 56.9858 28.6256 177.8171 98 L 4.0197 7.9195 121.4407 57.5020 41.3921 178.8563 99 S 4.3718 7.6326 111.6745 59.7823 62.8613 174.8031 100 S 4.6148 7.7256 116.4057 57.8078 63.1012 174.1636 101 A 3.9204 7.7390 123.5810 51.7378 18.7839 176.6131 102 P 4.2550 0.0000 0.0000 62.1824 32.1830 177.5995 103 E 3.8434 8.8775 121.9216 59.4488 29.1876 179.0542 104 A 4.0927 7.9747 119.1072 53.9744 18.7183 178.1973 105 L 4.4437 7.9276 116.5644 54.4848 42.0927 177.7091 106 N 4.2241 8.0177 119.2491 56.9373 38.8799 176.6356 107 S 4.0725 7.9654 113.7630 61.2710 62.5185 175.3836 108 E 3.8430 8.1162 121.4936 59.4622 29.3646 178.7590 109 I 3.6319 8.1069 120.1647 64.1449 37.1518 178.1717 110 K 3.8071 8.4847 120.8981 60.0043 31.9421 178.5517 111 H 4.0663 8.1648 116.3195 59.0497 28.5979 177.3796 112 H 3.8413 8.0805 118.1974 58.7747 28.2015 177.8316 113 L 4.2004 7.9278 120.7824 57.8820 41.5443 179.5358 114 Q 3.9800 8.0163 118.0669 58.8324 28.6460 178.4926 115 E 3.9392 8.1680 120.3154 59.4281 29.7624 178.7999 116 I 3.9351 8.0818 118.6951 64.1359 37.9990 177.5779 117 N 4.5275 8.6653 117.8795 56.5807 38.2774 177.5692 118 T 3.9331 7.9625 117.0147 66.7929 68.5456 177.0554 119 T 3.9283 8.1368 117.7206 66.4831 68.4424 176.4989 120 L 4.0581 8.5752 122.5686 58.4811 42.1667 178.3781 121 H 4.0909 8.5307 118.3566 59.5939 29.5859 176.9591 122 D 4.4275 8.2140 119.4640 57.2305 40.8272 178.0805 123 E 4.1363 8.4534 120.0185 59.1389 29.6939 178.7822 124 L 4.2732 8.4012 119.5106 57.8224 41.6706 179.4527 125 I 3.9021 7.8668 119.7793 64.1885 36.7056 178.5325 126 K 3.7594 7.6167 118.4455 59.1476 31.7766 177.6126 127 Y 4.3759 7.8344 114.8481 59.1150 38.2413 174.8840 128 Y 3.7379 7.6943 121.9442 56.3932 38.3147 174.3566 129 D 4.4093 7.5508 127.8365 51.3570 42.2093 174.1014 130 P 3.9568 0.0000 0.0000 65.8445 31.3958 178.0625 131 T 3.8474 7.8100 113.5841 67.0891 68.4105 174.9134 132 H 4.4164 7.9686 116.6502 56.7593 29.4373 175.4033 133 I 4.3842 7.6226 120.9636 59.2332 38.6805 175.5160 134 A 4.1575 8.8414 128.8290 55.0811 18.6580 177.9814 135 L 4.2240 8.0081 113.8101 55.2264 42.4894 177.6658 136 D 4.6560 8.5032 120.6219 53.7635 42.8565 177.5326 137 K 2.5163 8.2751 122.5224 59.6094 31.9665 178.9333 138 E 3.9100 7.9493 117.9982 59.4890 29.4157 178.9199 139 D 4.2852 7.9791 118.4319 57.1561 41.0174 178.4229 140 F 4.0442 8.2470 121.0702 61.3835 39.4213 177.2501 141 I 3.3843 7.7816 119.3155 64.4381 36.8884 178.2520 142 N 4.1879 8.3311 117.6716 55.9586 38.3988 177.2871 143 L 3.3462 7.6007 121.7886 57.9485 42.0390 179.1326 144 I 3.4503 6.9036 119.4518 64.2577 36.8845 178.4639 145 L 3.9186 7.8205 119.8634 57.4843 41.3529 179.3128 146 L 3.9010 7.6254 120.4632 58.0714 41.9786 179.1175 147 F 4.7725 7.6687 117.2689 60.7588 39.0036 177.7075 148 L 4.0444 8.2553 118.6979 58.0256 41.4140 179.5463 149 E 4.2607 8.6559 118.7869 59.7017 29.3743 179.5611 150 T 4.0414 8.3958 116.0600 66.2483 68.4969 176.6004 151 W 3.8772 8.4578 130.5204 60.3945 30.7609 177.5525 152 Y 3.7208 8.1233 116.3614 60.9136 37.1897 178.5491 153 F 4.0819 8.1643 120.8781 61.5679 39.5484 177.4983 154 R 3.7339 8.4268 117.8524 58.9748 29.6913 179.0057 155 A 3.1437 7.3814 121.1841 54.5502 17.6779 179.7531 156 S 3.8564 7.5664 112.6807 61.6484 62.9195 176.8159 157 F 3.7851 7.8676 121.3525 59.9653 38.8649 177.8973 158 S 4.2028 8.3038 113.3970 61.1699 61.9326 176.1707 159 Q 3.9127 8.0482 120.2113 58.6017 28.3119 178.1973 160 K 3.7295 7.0584 120.3179 58.6770 32.5384 178.1067 161 F 4.8703 8.2338 114.9420 59.2715 40.0383 176.2330 162 G 4.0208 8.3194 109.1156 44.0078 0.0000 173.1034 163 I 4.3313 8.1647 123.9113 59.3263 39.2103 175.6932 164 I 4.0908 8.1789 127.2431 63.6549 37.9279 177.3120 165 E 4.0488 8.2318 118.9177 59.5786 29.2358 178.7575 166 D 4.4019 8.0503 117.5168 57.2607 41.3263 178.3129 167 S 4.2513 8.1619 115.7997 61.4676 62.8813 176.6791 168 K 3.3299 8.6168 121.5115 59.4045 31.7437 179.1269 169 N 4.4757 8.1441 116.5311 56.3048 38.5104 177.5328 170 R 3.8882 8.2221 120.1626 59.3863 30.1691 178.3488 171 F 4.2035 8.5489 120.7807 61.2013 39.3590 176.8257 172 K 3.5641 7.9466 119.2286 59.6133 31.8973 178.4273 173 D 4.2133 7.9173 118.9166 57.3756 40.7504 178.7538 174 Q 3.9549 7.9253 118.5465 58.8179 28.6837 179.0792 175 V 2.7935 7.4795 119.4914 65.9371 31.4299 177.6005 176 Y 4.1659 8.1711 116.7052 61.1856 37.8228 178.7382 177 S 4.1735 8.2163 113.9366 61.5074 62.4679 176.3005 178 L 4.2153 8.0935 121.7101 57.7019 41.4064 179.0630 179 L 4.1618 8.6627 120.7381 58.1380 41.6810 178.4675 180 N 4.4486 8.3092 116.4173 56.9634 39.0837 177.0793 181 V 3.7932 7.5994 118.5597 64.7040 31.5362 177.9674 182 F 4.2257 8.5183 118.3026 59.9974 38.8953 175.8755 183 L 4.5033 8.2750 122.3372 55.0122 41.7495 176.5505 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 1 M 8.16 4.46 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.71 0.00 2 K 8.04 3.83 0.00 1.94 1.95 0.00 1.70 0.00 0.00 1.80 0.00 0.00 2.83 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.29 1.40 7.81 3 D 8.30 4.40 0.00 2.79 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 4 K 8.00 3.97 0.00 1.83 1.93 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.52 7.81 5 I 8.04 3.70 2.18 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.63 0.96 0.00 0.00 6 I 8.07 3.66 1.92 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 1.76 1.04 0.94 0.00 0.00 7 D 8.30 4.30 0.00 2.85 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 8 N 8.29 4.29 0.00 2.83 2.75 0.00 0.00 6.93 7.05 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 9 A 8.23 3.59 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 7.99 3.64 1.82 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 1.42 0.70 0.28 0.00 0.00 11 T 7.43 3.73 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 1.11 0.00 0.00 12 L 7.63 3.82 0.00 1.41 1.42 0.73 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 13 F 8.37 4.54 0.00 3.11 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 S 8.16 4.29 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 15 E 7.81 4.06 0.00 1.89 1.94 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 2.22 2.51 0.00 16 K 8.39 4.34 0.00 1.79 1.81 0.00 1.65 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.36 7.81 17 G 7.95 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 18 Y 8.44 3.99 0.00 2.15 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 19 D 8.06 4.06 0.00 2.67 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 20 G 7.47 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 7.34 4.55 4.33 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 0.86 0.00 0.00 22 T 8.40 4.63 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 1.15 0.00 0.00 23 L 8.29 3.95 0.00 1.67 1.65 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 24 D 7.88 4.53 0.00 2.68 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 25 D 7.96 4.30 0.00 2.78 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 26 I 7.53 3.58 1.90 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.78 0.80 0.00 0.00 27 S 8.45 4.09 0.00 4.18 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 28 K 8.17 4.01 0.00 1.88 1.97 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.40 1.42 7.81 29 S 8.02 4.10 0.00 3.99 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 30 V 7.62 4.00 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 0.81 0.00 0.00 0.98 0.00 0.00 31 N 7.73 4.18 0.00 2.86 2.86 0.00 0.00 6.67 7.12 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 32 I 7.62 4.70 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.60 0.92 0.00 0.00 33 K 8.25 4.35 0.00 1.82 1.77 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.40 7.81 34 K 8.76 3.76 0.00 1.86 1.81 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.29 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.53 7.81 35 A 8.23 4.41 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 36 S 8.23 4.33 0.00 4.03 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 37 L 8.32 4.10 0.00 1.68 1.43 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 7.04 5.19 0.00 3.05 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 7.64 4.17 0.00 2.95 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.01 4.40 0.00 3.18 2.53 0.00 5.70 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Y 7.80 4.92 0.00 3.02 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 42 D 8.93 4.71 0.00 2.78 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 43 N 7.71 4.75 0.00 3.07 3.03 0.00 0.00 5.91 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 44 K 8.51 4.06 0.00 1.90 1.93 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.68 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.77 1.67 7.81 45 E 8.45 4.14 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 46 E 9.04 4.16 0.00 2.32 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 2.55 2.66 0.00 47 I 7.59 3.23 2.12 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 0.60 0.95 0.85 0.00 0.00 48 Y 8.47 3.95 0.00 2.78 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 R 8.41 3.74 0.00 1.94 2.18 0.00 3.17 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 50 K 8.08 4.04 0.00 1.86 1.90 0.00 2.01 0.00 0.00 1.95 0.00 0.00 3.07 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.55 1.80 7.81 51 S 8.03 4.12 0.00 3.92 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 52 V 7.80 3.46 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 1.13 0.00 0.00 0.03 0.00 0.00 53 E 8.42 4.03 0.00 2.24 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 2.48 2.57 0.00 54 N 8.53 4.41 0.00 2.94 3.13 0.00 0.00 6.84 7.92 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 55 C 8.41 4.48 0.00 3.28 3.19 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 56 F 8.57 4.37 0.00 3.17 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 57 N 8.73 4.49 0.00 3.01 2.98 0.00 0.00 6.66 7.02 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 58 Y 8.37 3.86 0.00 2.65 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 59 F 8.38 4.21 0.00 3.33 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 I 8.41 3.93 2.11 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.12 1.04 0.00 0.00 61 D 8.47 4.40 0.00 2.87 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 62 F 7.95 3.83 0.00 2.76 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 63 L 7.88 4.55 0.00 2.11 1.95 1.15 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.32 4.46 0.00 1.66 1.79 0.99 0.95 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 65 R 7.94 4.36 0.00 1.78 1.87 0.00 3.10 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 *68 D 8.62 4.29 0.00 2.73 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 69 D 8.42 4.36 0.00 2.60 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 70 N 7.42 4.77 0.00 2.64 2.61 0.00 0.00 6.93 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 71 Y 8.38 4.32 0.00 2.86 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.30 4.52 0.00 4.04 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 73 I 8.26 4.00 1.96 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.23 1.17 0.00 0.00 74 D 8.26 4.50 0.00 2.78 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.17 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 76 L 8.23 3.62 0.00 1.67 1.97 0.61 0.92 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 77 Y 8.15 3.95 0.00 3.08 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 78 Q 8.21 4.17 0.00 2.45 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.53 0.00 79 F 8.61 4.32 0.00 3.27 3.19 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 80 L 8.18 3.93 0.00 2.03 1.75 0.84 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 81 F 8.70 4.23 0.00 3.36 3.36 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 82 K 8.70 4.10 0.00 2.14 2.03 0.00 1.78 0.00 0.00 1.81 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.76 1.83 7.81 83 F 8.37 3.75 0.00 2.89 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.58 2.64 1.58 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.57 -0.52 0.00 0.00 85 F 8.06 4.03 0.00 2.28 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 86 D 8.35 4.70 0.00 2.97 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 87 V 6.90 3.63 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 -0.29 0.00 0.00 88 D 8.88 4.39 0.00 2.73 2.42 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 89 E 8.90 3.93 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 90 R 8.58 3.82 0.00 1.64 1.69 0.00 2.96 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 91 Y 7.72 3.86 0.00 2.84 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 92 I 7.81 3.97 1.88 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.51 0.69 0.00 0.00 93 K 8.12 3.94 0.00 1.99 1.85 0.00 1.59 0.00 0.00 1.47 0.00 0.00 2.72 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.49 1.33 7.81 94 L 7.93 4.01 0.00 1.74 1.85 1.03 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 95 Y 8.40 3.93 0.00 3.47 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 96 V 8.30 3.73 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 1.08 0.00 0.00 1.20 0.00 0.00 97 Q 8.12 4.30 0.00 2.44 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.54 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 98 L 7.92 4.02 0.00 1.55 1.65 0.27 0.56 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 99 S 7.63 4.37 0.00 4.07 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 0.00 100 S 7.73 4.61 0.00 3.93 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 0.00 101 A 7.74 3.92 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 0.00 102 P 0.00 4.26 0.00 1.98 1.79 0.00 3.32 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.03 0.00 103 E 8.88 3.84 0.00 1.97 1.94 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 2.36 2.32 0.00 104 A 7.97 4.09 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 0.00 105 L 7.93 4.44 0.00 1.82 1.69 1.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 106 N 8.02 4.22 0.00 2.81 2.81 0.00 0.00 6.79 7.24 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 0.00 107 S 7.97 4.07 0.00 3.93 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 0.00 108 E 8.12 3.84 0.00 2.05 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 2.41 2.31 0.00 109 I 8.11 3.63 1.93 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.54 0.96 0.00 0.00 110 K 8.48 3.81 0.00 1.80 1.91 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.43 7.81 111 H 8.16 4.07 0.00 3.22 3.22 0.00 5.68 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 0.00 112 H 8.08 3.84 0.00 2.27 1.31 0.00 5.62 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 0.00 113 L 7.93 4.20 0.00 1.84 1.77 0.92 1.12 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 0.00 114 Q 8.02 3.98 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 115 E 8.17 3.94 0.00 2.15 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 2.38 2.35 0.00 116 I 8.08 3.94 2.28 0.00 0.00 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 1.72 0.94 1.34 0.00 0.00 117 N 8.67 4.53 0.00 2.80 2.89 0.00 0.00 6.99 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 T 7.96 3.93 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 1.24 0.00 0.00 119 T 8.14 3.93 4.51 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 1.34 0.00 0.00 120 L 8.58 4.06 0.00 1.92 1.90 1.08 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 121 H 8.53 4.09 0.00 3.31 3.50 0.00 5.64 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 0.00 122 D 8.21 4.43 0.00 2.86 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.45 4.14 0.00 2.28 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 124 L 8.40 4.27 0.00 1.72 1.76 0.87 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 125 I 7.87 3.90 1.94 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 0.65 0.91 0.00 0.00 126 K 7.62 3.76 0.00 1.21 0.74 0.00 1.38 0.00 0.00 0.99 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.06 1.42 7.81 127 Y 7.83 4.38 0.00 3.48 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Y 7.69 3.74 0.00 2.81 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 0.00 129 D 7.55 4.41 0.00 2.50 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 0.00 130 P 0.00 3.96 0.00 1.95 2.05 0.00 3.50 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 131 T 7.81 3.85 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 0.97 0.00 0.00 132 H 7.97 4.42 0.00 3.03 3.35 0.00 5.86 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 I 7.62 4.38 1.55 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 1.11 0.30 1.03 0.00 0.00 134 A 8.84 4.16 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.01 4.22 0.00 1.89 1.80 1.07 1.28 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 0.00 136 D 8.50 4.66 0.00 2.72 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 0.00 137 K 8.28 2.52 0.00 1.14 1.54 0.00 1.68 0.00 0.00 1.77 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.24 0.87 7.81 138 E 7.95 3.91 0.00 1.97 1.94 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 2.36 2.31 0.00 139 D 7.98 4.29 0.00 2.86 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 0.00 140 F 8.25 4.04 0.00 3.17 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 0.00 141 I 7.78 3.38 1.91 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 1.80 0.64 0.84 0.00 0.00 142 N 8.33 4.19 0.00 2.73 2.73 0.00 0.00 6.70 6.31 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 0.00 143 L 7.60 3.35 0.00 1.21 1.27 -0.12 0.17 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 0.00 144 I 6.90 3.45 1.64 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.07 0.90 0.00 0.00 145 L 7.82 3.92 0.00 1.71 1.65 0.88 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 146 L 7.63 3.90 0.00 1.75 1.45 0.85 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 147 F 7.67 4.77 0.00 3.30 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 L 8.26 4.04 0.00 1.65 1.47 0.85 -0.14 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 0.00 149 E 8.66 4.26 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 150 T 8.40 4.04 4.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 151 W 8.46 3.88 0.00 3.30 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 0.00 152 Y 8.12 3.72 0.00 3.34 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 F 8.16 4.08 0.00 3.18 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 R 8.43 3.73 0.00 1.49 1.79 0.00 3.22 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.84 0.00 155 A 7.38 3.14 0.02 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 0.00 156 S 7.57 3.86 0.00 3.97 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 0.00 157 F 7.87 3.79 0.00 2.84 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 S 8.30 4.20 0.00 3.86 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 0.00 159 Q 8.05 3.91 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.70 0.00 0.00 0.00 0.00 0.00 2.43 2.17 0.00 160 K 7.06 3.73 0.00 1.19 0.96 0.00 1.34 0.00 0.00 0.96 0.00 0.00 2.78 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.30 0.86 7.81 161 F 8.23 4.87 0.00 3.15 3.08 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 0.00 162 G 8.32 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 0.00 163 I 8.16 4.33 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 1.55 1.12 0.93 0.00 0.00 164 I 8.18 4.09 1.84 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 1.64 1.99 0.90 0.00 0.00 165 E 8.23 4.05 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 166 D 8.05 4.40 0.00 2.82 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 0.00 167 S 8.16 4.25 0.00 4.20 4.12 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 0.00 168 K 8.62 3.33 0.00 1.47 0.74 0.00 1.49 0.00 0.00 1.07 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.23 1.67 7.81 169 N 8.14 4.48 0.00 2.90 2.93 0.00 0.00 6.72 6.98 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 0.00 170 R 8.22 3.89 0.00 1.98 2.13 0.00 3.20 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 171 F 8.55 4.20 0.00 3.40 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 0.00 172 K 7.95 3.56 0.00 1.93 1.75 0.00 1.27 0.00 0.00 1.76 0.00 0.00 2.67 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.79 1.54 7.81 173 D 7.92 4.21 0.00 2.92 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 0.00 174 Q 7.93 3.95 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.65 0.00 175 V 7.48 2.79 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 -0.34 0.00 0.00 176 Y 8.17 4.17 0.00 3.21 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 0.00 177 S 8.22 4.17 0.00 4.05 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 0.00 178 L 8.09 4.22 0.00 2.00 2.16 1.15 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 179 L 8.66 4.16 0.00 1.75 1.43 0.04 0.62 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 0.00 180 N 8.31 4.45 0.00 3.08 3.10 0.00 0.00 7.28 7.25 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 0.00 181 V 7.60 3.79 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 0.91 0.00 0.00 0.81 0.00 0.00 182 F 8.52 4.23 0.00 3.27 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 0.00 183 L 8.28 4.50 0.00 1.85 1.71 1.08 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.