NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2612 8.3149 121.7888 56.1744 34.2164 176.3071 3 R 4.0248 7.8030 116.7906 55.3661 30.9512 174.3459 4 K 4.7019 10.0861 122.1110 55.6112 35.7021 175.4736 5 N 5.2144 9.4126 120.4852 51.9541 40.7452 173.6937 6 I 4.8127 8.4464 125.8284 59.2277 39.5227 175.2483 7 A 4.2956 8.5749 130.2148 51.2605 19.8693 175.7547 8 L 4.8434 8.5980 123.6518 53.1905 45.6105 175.2123 9 I 4.8763 8.4370 127.2557 58.7058 39.7018 172.8717 10 P 4.7118 0.0000 0.0000 61.6595 31.9175 176.7868 11 A 4.7100 8.5289 129.4722 50.2599 18.2638 176.0766 12 A 4.6746 7.6401 119.2960 52.0335 17.8846 179.0912 *25 Q 4.2349 8.0007 119.6734 56.1516 31.4928 177.1960 26 Y 4.9946 7.8154 114.9747 57.6811 39.0881 176.2451 27 V 3.7596 7.8545 120.6792 63.3211 32.9080 174.2000 28 E 5.0165 8.6585 125.9610 54.9459 31.5098 175.7820 29 I 4.5237 8.5148 124.4685 60.9379 41.9835 174.4515 30 G 4.0858 8.6739 114.1994 46.8519 0.0000 174.5582 31 S 4.6357 8.7175 118.5308 57.9696 63.8668 173.7965 32 K 4.7397 7.6450 119.1224 53.9908 36.3426 175.7791 33 T 5.2378 8.4418 112.6133 60.7041 70.9960 175.7359 34 V 3.6308 8.3654 120.1407 66.1647 31.4749 177.3959 35 L 3.9732 8.3346 120.2928 58.5032 41.7864 178.7776 36 E 4.0701 8.1366 118.2211 59.9081 29.1786 179.1598 37 H 4.2255 8.0559 114.9077 58.6541 29.0635 177.7986 38 V 3.7116 7.8158 120.0631 66.1650 31.5099 178.0568 39 L 4.0934 8.0740 118.7947 57.7193 41.1174 179.9307 40 G 3.7094 7.7589 105.9427 47.7869 0.0000 175.7181 41 I 3.5946 7.3317 121.1999 64.0845 37.2371 178.3506 42 F 4.4632 7.7141 117.7851 60.7361 38.8427 177.5085 43 E 3.7773 8.1615 116.8457 59.2595 29.3975 178.2646 44 R 4.3300 7.7589 112.4477 56.1302 30.1248 175.2555 45 H 4.5685 8.8362 121.1284 54.8285 30.5907 175.3564 46 E 3.9016 8.8659 126.8725 59.6372 29.3716 178.2982 47 A 4.1729 7.9593 118.6923 53.4227 18.9637 177.1606 48 V 4.1862 7.5841 116.4686 62.1637 32.2780 175.4881 49 D 4.6754 8.9157 127.3262 56.2444 41.7396 176.3611 50 L 4.4097 7.2840 117.0791 54.4963 45.7577 173.3472 51 T 4.8535 8.1155 119.6504 61.6562 72.5127 173.0056 52 V 4.4387 8.5945 124.8851 60.8446 35.3461 174.2079 53 V 4.7236 8.4578 126.4437 61.0694 34.5526 174.0993 54 V 4.7631 8.4227 128.2137 61.7052 33.1786 175.2217 55 V 4.9824 8.7668 121.4517 59.1316 35.4387 175.5215 56 S 4.6326 8.4637 115.6778 57.6246 63.5848 173.4443 57 P 4.5217 0.0000 0.0000 64.2763 31.0581 176.7901 58 E 4.6156 7.8590 116.0323 55.5753 30.7275 175.3063 59 D 4.5082 8.2365 120.2384 54.8707 41.5690 176.5665 60 T 4.2419 8.7139 123.3762 66.2643 69.1824 176.9140 61 F 4.0316 8.2474 121.3376 60.2884 39.2719 176.6274 62 A 3.9165 8.1809 120.4765 55.6876 18.0013 179.0159 63 D 4.3761 7.4324 117.7361 57.9059 40.9296 179.8113 64 K 4.0305 7.4415 124.0845 59.4008 31.8229 184.1148 65 V 3.6953 6.9852 119.0926 65.5385 31.5047 177.5214 66 Q 3.9982 8.1098 119.5745 59.7871 28.6001 178.6527 67 T 3.8375 7.3109 115.0615 66.4801 68.5459 175.6600 68 A 4.3051 7.7801 120.6527 52.2849 20.5215 177.5447 69 F 4.6568 7.8799 116.4697 54.2418 39.4846 173.5137 70 P 4.3004 0.0000 0.0000 65.7867 31.4425 179.0486 71 Q 4.1139 8.0224 116.0241 57.5984 28.9893 176.3998 72 V 3.8730 7.3662 118.0408 62.5258 32.5374 175.4937 73 R 4.3084 8.2586 126.2561 55.0283 31.7111 175.7576 74 V 4.3948 8.1144 124.0935 61.4151 31.3479 174.5332 75 W 5.0171 8.9935 127.7475 54.5971 31.0144 177.3273 76 K 4.9214 8.4069 123.0386 56.6287 31.4775 176.3262 77 N 5.0144 7.9190 110.0537 52.7358 39.7431 176.1255 78 G 3.8631 8.1919 107.1355 45.8473 0.0000 175.0897 79 G 4.2912 8.2756 110.4591 44.9723 0.0000 173.4862 80 Q 4.4541 8.8848 117.9885 56.0896 30.3948 175.8829 81 T 4.6749 7.4518 107.2825 58.9813 71.6032 174.5763 82 R 3.8306 8.8212 123.2390 60.0011 29.8249 178.6418 83 A 3.9798 7.9718 119.7756 54.9089 18.3019 179.1124 84 E 3.8579 8.4015 118.3788 59.7605 29.8369 179.1938 85 T 3.8786 7.8785 109.3874 64.8606 68.7523 176.3525 86 V 3.6344 8.1195 121.2602 65.5123 31.5268 178.0360 87 R 3.8766 8.1575 118.6682 59.6147 30.0953 178.2270 88 N 4.4751 8.5093 116.6267 56.2520 38.5045 177.6841 89 G 3.8230 8.2532 107.1187 47.9777 0.0000 176.0286 90 V 3.7094 7.8199 120.5041 65.3876 31.5668 177.9163 91 A 3.9910 8.1452 120.6313 55.1472 18.3204 179.5489 92 K 3.7446 7.9783 117.9015 59.5931 32.2178 178.9244 93 L 4.3668 8.2795 119.2053 57.5590 41.4281 179.5565 94 L 4.0044 7.6501 118.9436 57.4233 41.6688 178.5740 95 E 3.8507 7.8756 117.6711 59.8848 29.6782 178.4610 96 T 3.9956 7.3919 114.1895 64.9459 68.5527 175.3898 97 G 3.9954 7.8785 106.7179 45.3095 0.0000 174.2439 98 L 4.1000 7.9214 120.1135 56.3888 41.9738 177.1492 99 A 4.8100 8.3439 120.9275 50.1084 21.0949 175.9346 100 A 4.5580 10.6000 125.2710 50.6031 20.7778 178.1364 101 E 3.9294 8.9255 119.4489 59.9970 29.4473 179.5172 102 T 4.3885 7.7363 104.4255 61.8517 69.4744 174.3489 103 D 4.6193 8.2843 123.6709 54.6367 42.4016 175.0141 104 N 5.0718 8.9213 119.4548 52.6621 40.5087 174.1412 105 I 4.6994 8.8566 124.7660 59.7183 39.9877 174.8529 106 L 4.5681 8.6252 128.7237 53.0885 42.2678 175.1603 107 V 4.2797 8.5495 124.8328 62.7143 32.4701 174.1281 108 H 5.2731 8.8350 127.8606 54.0253 33.1028 172.9927 109 D 4.3859 8.5202 124.7221 54.2352 41.1578 177.7538 110 A 4.0236 8.5802 126.0707 54.5023 18.8335 177.9412 111 A 4.4100 7.8823 117.1238 52.6339 19.5605 177.2646 112 R 5.1410 7.6013 116.2854 54.3330 28.4635 175.9641 113 C 4.4693 7.9808 111.4610 58.6512 30.4433 174.7604 114 C 4.6542 7.7308 116.2456 59.3170 28.5237 173.1684 115 L 3.9269 8.0773 122.2040 54.8978 41.9768 175.7561 116 P 4.4137 0.0000 0.0000 62.7388 33.5287 177.2887 117 S 4.0940 8.5149 113.8948 61.3602 62.4038 176.1174 118 E 4.0078 8.1434 121.6162 58.8360 29.5678 178.4130 119 A 3.9977 7.8697 120.7340 54.8932 18.5570 179.1461 120 L 3.8635 7.8454 118.3758 58.1038 42.0335 179.0540 121 A 4.0358 7.8887 120.3229 55.2224 18.3432 179.8110 122 R 3.8456 7.9749 116.5808 59.1698 30.1420 179.0590 123 L 3.8653 7.7709 119.6312 58.3234 42.1774 179.0471 124 I 3.7110 7.6914 119.7372 64.3166 36.7741 178.1605 125 E 3.9119 8.2065 119.2849 59.3255 29.6579 178.3743 126 Q 4.2244 8.4918 116.2556 57.0565 29.2607 176.9035 127 A 4.7098 8.4215 120.2369 51.7306 20.2344 178.2835 128 G 3.5786 8.0792 106.1531 47.8256 0.0000 174.3880 129 N 4.7931 8.1355 113.9664 52.5583 39.4941 173.5628 130 A 4.6352 7.5626 122.7432 49.9761 20.6273 178.4285 131 A 4.0728 8.7919 126.7508 55.1565 18.5916 178.5115 132 E 4.0855 8.1136 112.2277 57.3134 30.5692 177.7544 133 G 3.6575 8.5962 107.8615 46.4761 0.0000 171.9428 134 G 4.3318 6.7760 104.2153 46.0686 0.0000 172.6110 135 I 5.1603 7.6367 112.2724 58.7882 41.6365 174.5466 136 L 4.7935 8.3236 123.7244 55.0486 43.0144 175.9699 137 A 5.1528 9.0980 123.0618 51.0710 23.4314 175.3519 138 V 4.7927 9.1731 113.5636 58.6200 34.8721 173.8433 139 P 3.7364 0.0000 0.0000 62.4262 31.9077 176.4498 140 V 3.7319 8.0043 124.2275 62.9360 30.7860 175.3895 141 A 4.3142 8.5455 131.2659 52.8991 19.8394 176.7571 142 D 4.7755 7.6679 114.7757 52.9436 42.3275 176.5081 143 T 3.9009 8.3248 118.5918 64.2639 69.2266 173.5694 144 L 4.7182 8.3377 125.1461 53.3400 43.9758 175.5153 145 K 4.9623 8.4674 121.3724 54.5809 35.6017 175.4605 146 R 4.4523 9.5051 125.8938 55.3837 31.5039 174.9972 147 A 4.7412 8.5561 127.3839 51.1175 20.8253 174.1622 148 E 4.3017 9.2165 117.8820 56.0340 32.7439 176.0891 149 S 4.6227 8.0177 114.2789 57.4401 63.0874 174.7237 150 G 4.0627 8.9984 107.0966 45.1786 0.0000 172.2528 151 Q 4.6084 7.5014 116.2730 53.7258 31.8747 174.2966 152 I 4.3000 8.2948 120.3521 61.5384 37.4978 176.1109 153 S 4.6975 8.3735 119.8450 59.2909 64.5764 173.8273 154 A 4.3856 7.5376 119.5842 51.6653 22.4363 175.3586 155 T 4.8340 8.5571 116.5648 61.9803 69.5586 174.8647 156 V 4.1050 8.0354 126.7726 60.2783 32.9236 175.9641 157 D 4.3757 8.7561 123.6252 54.7030 41.7573 175.8772 158 R 4.4573 8.4433 121.1941 55.5965 30.0257 175.5345 159 S 4.1521 7.9767 113.8717 60.1846 62.4602 174.1348 160 G 4.0249 8.8206 114.7231 46.3494 0.0000 172.6652 161 L 4.9459 7.6514 119.1682 53.0232 43.9114 175.7603 162 W 5.4428 8.7150 120.0080 55.2493 33.7657 174.2938 163 Q 4.7559 9.3939 121.3211 54.2123 30.3722 174.9354 164 A 4.5077 8.7545 126.4399 52.1343 19.4255 176.5047 165 Q 5.0964 8.6234 122.4945 54.3820 32.0022 174.7671 166 T 4.8369 8.2820 108.1435 59.9037 72.2397 172.0474 167 P 4.8550 0.0000 0.0000 62.8664 33.3912 175.5092 168 Q 4.5471 8.9259 120.4526 54.2851 31.3405 174.5980 169 L 4.8903 8.0226 127.7866 53.5314 43.5640 175.3596 170 F 5.2098 8.6085 123.9491 55.5589 44.2366 174.4297 171 Q 4.4913 8.9009 119.5190 55.8695 29.5728 177.2716 172 A 4.1492 9.1405 125.3409 55.6558 18.5051 180.6608 173 G 3.5753 8.2322 103.9413 47.7344 0.0000 175.6755 174 L 3.9485 7.8626 122.1862 57.8435 42.3389 178.7075 175 L 3.8351 8.0881 120.3162 58.3288 41.8490 178.1334 176 H 4.0863 8.1366 117.1006 59.5199 30.0263 176.8400 177 R 3.9672 8.0236 119.8772 59.2862 29.7397 178.2836 178 A 4.0580 8.1878 119.7045 54.1150 18.3479 178.4734 179 L 4.4788 7.3456 115.0836 54.4656 42.0046 176.7879 180 A 4.1315 7.4633 120.9530 52.9635 18.2400 179.1831 *186 G 3.7729 7.7049 106.6475 46.4877 0.0000 172.5979 187 I 4.5282 7.4440 120.9955 59.9161 40.6926 174.3503 188 T 4.1427 8.5017 112.1210 61.8513 69.7798 175.7941 189 D 4.7643 8.6036 119.2253 51.4411 42.1355 177.6673 190 E 4.0634 8.8228 118.2734 59.5652 29.2754 179.2867 191 A 4.0587 8.8084 121.2473 55.3688 17.8716 179.8227 192 S 4.2992 8.6573 113.6273 60.7086 62.9274 176.6007 193 A 3.9923 7.5568 123.6548 54.7627 18.2918 179.3924 194 V 3.5262 7.3785 116.4111 65.8544 31.1657 177.7446 195 E 4.4847 8.0935 119.7448 58.9148 29.0995 179.5644 196 K 4.0816 7.5030 115.9792 58.8176 32.1456 178.5101 197 L 4.2795 7.7525 117.7295 55.1070 41.7124 177.6250 198 G 3.8538 7.9760 107.3198 45.3869 0.0000 173.1293 199 V 4.1790 7.4831 118.7340 60.7455 33.0839 174.9426 200 R 4.5178 8.2625 125.7106 53.8049 30.6608 174.1305 201 P 4.6440 0.0000 0.0000 62.1965 32.5825 176.7009 202 L 4.2371 8.7542 122.4155 54.6174 43.3881 176.0131 203 L 4.5287 8.0480 120.6879 53.2498 43.1190 175.9466 204 I 4.4650 8.3993 125.7103 58.9533 39.9011 175.2970 205 Q 4.2988 8.9301 127.4421 56.4355 29.0398 175.9521 206 G 4.2837 8.4051 115.8827 45.7400 0.0000 173.1372 207 D 4.5949 9.2533 120.7569 53.0322 44.5632 176.6806 208 A 4.2798 8.7136 127.9279 55.1578 18.5283 179.0671 209 R 4.0714 8.8197 113.8507 58.0275 30.7334 176.3470 210 N 4.6612 8.2790 121.3186 53.3580 38.4377 175.1317 211 L 4.5337 7.3547 118.7323 52.8190 43.0355 177.4990 212 K 4.3469 8.3257 121.1976 55.8653 32.8205 176.3817 213 L 4.3917 8.3000 129.3712 54.2617 41.1669 175.7696 214 T 4.6385 8.3524 114.9799 60.7665 70.6329 174.0130 215 Q 4.6012 7.6040 119.5936 52.7970 32.0751 173.7471 216 P 4.2158 0.0000 0.0000 66.3131 31.1225 178.4479 217 Q 4.0243 8.1722 116.2479 59.0498 28.9784 177.3248 218 D 4.6963 8.5779 117.9674 54.6463 41.2057 178.0995 219 A 4.0563 8.2077 122.6582 54.9436 18.2784 179.0691 220 Y 4.0251 7.9925 118.0069 61.1598 39.0690 178.0954 221 I 3.4394 7.7278 120.1571 64.0390 37.2110 178.6458 222 V 3.4806 7.5212 119.2785 65.9794 31.1949 178.0283 223 R 3.8313 7.8043 117.2841 59.3948 29.9094 177.9167 224 L 3.9762 7.4143 119.3007 57.7825 42.4711 178.5084 225 L 4.1511 7.7387 119.0304 57.1730 41.4616 178.5907 226 L 4.2430 7.7450 116.8307 56.0107 41.6153 176.8120 227 D 4.5443 7.4522 123.2378 54.3033 41.0532 176.0233 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 K 8.31 4.26 0.00 1.71 1.91 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.53 7.81 3 R 7.80 4.02 0.00 1.92 1.84 0.00 3.41 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 4 K 10.09 4.70 0.00 1.65 1.79 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.58 7.81 5 N 9.41 5.21 0.00 2.77 2.71 0.00 0.00 7.12 7.42 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 6 I 8.45 4.81 1.81 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 1.12 0.68 0.85 0.00 0.00 7 A 8.57 4.30 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 L 8.60 4.84 0.00 1.62 1.40 0.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 9 I 8.44 4.88 1.80 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.78 0.91 0.00 0.00 10 P 0.00 4.71 0.00 2.08 2.08 0.00 3.88 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 11 A 8.53 4.71 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 A 7.64 4.67 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 *25 Q 8.00 4.23 0.00 1.98 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.75 0.00 0.00 0.00 0.00 0.00 1.58 1.36 0.00 26 Y 7.82 4.99 0.00 2.82 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.85 3.76 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 0.99 0.00 0.00 0.94 0.00 0.00 28 E 8.66 5.02 0.00 1.88 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 29 I 8.51 4.52 1.87 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 1.24 1.20 0.90 0.00 0.00 30 G 8.67 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 0.00 0.00 0.00 31 S 8.72 4.64 0.00 3.99 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 32 K 7.64 4.74 0.00 1.76 1.73 0.00 1.53 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.42 7.81 33 T 8.44 5.24 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 34 V 8.37 3.63 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 1.06 0.00 0.00 0.95 0.00 0.00 35 L 8.33 3.97 0.00 1.90 1.88 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.14 4.07 0.00 2.35 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 0.00 2.73 2.60 0.00 37 H 8.06 4.23 0.00 3.40 3.37 0.00 5.66 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.82 3.71 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 1.21 0.00 0.00 1.13 0.00 0.00 39 L 8.07 4.09 0.00 1.02 0.88 0.52 0.58 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 40 G 7.76 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 I 7.33 3.59 1.28 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 1.38 0.61 0.53 0.00 0.00 42 F 7.71 4.46 0.00 3.15 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.16 3.78 0.00 2.12 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 2.49 2.53 0.00 44 R 7.76 4.33 0.00 1.89 2.06 0.00 3.05 0.00 0.00 3.15 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.55 0.00 45 H 8.84 4.57 0.00 3.41 3.35 0.00 5.80 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.87 3.90 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.23 0.00 47 A 7.96 4.17 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 48 V 7.58 4.19 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 0.81 0.00 0.00 1.05 0.00 0.00 49 D 8.92 4.68 0.00 2.63 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 50 L 7.28 4.41 0.00 1.67 1.38 0.86 0.69 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 51 T 8.12 4.85 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 0.99 0.00 0.00 52 V 8.59 4.44 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 -0.08 0.00 0.00 0.21 0.00 0.00 53 V 8.46 4.72 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 0.99 0.00 0.00 0.81 0.00 0.00 54 V 8.42 4.76 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.05 0.00 0.00 55 V 8.77 4.98 2.30 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 0.79 0.00 0.00 1.08 0.00 0.00 56 S 8.46 4.63 0.00 4.18 4.03 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 57 P 0.00 4.52 0.00 2.08 2.24 0.00 3.64 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 2.04 2.12 0.00 58 E 7.86 4.62 0.00 1.93 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 2.21 2.33 0.00 59 D 8.24 4.51 0.00 2.84 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 T 8.71 4.24 4.30 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 1.25 0.00 0.00 61 F 8.25 4.03 0.00 2.77 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 62 A 8.18 3.92 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 63 D 7.43 4.38 0.00 2.49 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 64 K 7.44 4.03 0.00 1.80 1.80 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.31 7.81 65 V 6.99 3.70 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.70 0.00 0.00 66 Q 8.11 4.00 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.52 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 67 T 7.31 3.84 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 68 A 7.78 4.31 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 F 7.88 4.66 0.00 3.12 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 70 P 0.00 4.30 0.00 2.18 2.19 0.00 3.72 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 1.99 1.97 0.00 71 Q 8.02 4.11 0.00 2.31 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.99 0.00 0.00 0.00 0.00 0.00 2.39 2.32 0.00 72 V 7.37 3.87 2.29 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 0.60 0.00 0.00 0.95 0.00 0.00 73 R 8.26 4.31 0.00 1.16 1.62 0.00 3.29 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.32 0.00 74 V 8.11 4.39 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.95 0.00 0.00 75 W 8.99 5.02 0.00 3.32 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 76 K 8.41 4.92 0.00 1.77 1.83 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.51 7.81 77 N 7.92 5.01 0.00 2.75 2.79 0.00 0.00 7.16 7.65 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 78 G 8.19 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 G 8.28 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 0.00 0.00 0.00 0.00 80 Q 8.88 4.45 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.56 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 81 T 7.45 4.67 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 82 R 8.82 3.83 0.00 1.90 1.99 0.00 3.18 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 83 A 7.97 3.98 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.40 3.86 0.00 2.05 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 2.31 2.32 0.00 85 T 7.88 3.88 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 1.35 0.00 0.00 86 V 8.12 3.63 2.28 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 1.01 0.00 0.00 1.05 0.00 0.00 87 R 8.16 3.88 0.00 2.07 2.13 0.00 3.12 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 1.63 1.66 0.00 88 N 8.51 4.48 0.00 2.98 2.89 0.00 0.00 6.99 8.35 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 89 G 8.25 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 7.82 3.71 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 0.99 0.00 0.00 91 A 8.15 3.99 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 K 7.98 3.74 0.00 1.59 1.75 0.00 1.01 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.30 0.84 7.81 93 L 8.28 4.37 0.00 2.05 1.83 0.94 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 94 L 7.65 4.00 0.00 1.81 1.64 0.95 0.70 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 95 E 7.88 3.85 0.00 1.92 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 2.29 2.46 0.00 96 T 7.39 4.00 4.54 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 1.34 0.00 0.00 97 G 7.88 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 98 L 7.92 4.10 0.00 1.79 1.82 1.20 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 99 A 8.34 4.81 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 0.00 100 A 10.60 4.56 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 0.00 101 E 8.93 3.93 0.00 2.01 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 2.41 2.28 0.00 102 T 7.74 4.39 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 1.22 0.00 0.00 103 D 8.28 4.62 0.00 2.78 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 0.00 104 N 8.92 5.07 0.00 2.88 2.69 0.00 0.00 6.94 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 0.00 105 I 8.86 4.70 1.91 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 1.22 0.82 0.91 0.00 0.00 106 L 8.63 4.57 0.00 1.47 1.55 0.85 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 0.00 107 V 8.55 4.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.98 0.00 0.00 108 H 8.83 5.27 0.00 3.17 3.17 0.00 6.01 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.52 4.39 0.00 2.63 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 A 8.58 4.02 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 0.00 111 A 7.88 4.41 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 0.00 112 R 7.60 5.14 0.00 1.77 2.05 0.00 3.10 0.00 0.00 3.38 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.46 0.00 113 C 7.98 4.47 0.00 3.08 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 0.00 114 C 7.73 4.65 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 0.00 115 L 8.08 3.93 0.00 1.72 1.49 0.94 0.62 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 0.00 116 P 0.00 4.41 0.00 2.28 2.13 0.00 3.73 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 2.05 2.00 0.00 117 S 8.51 4.09 0.00 3.91 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 0.00 118 E 8.14 4.01 0.00 2.07 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 2.38 2.37 0.00 119 A 7.87 4.00 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 0.00 120 L 7.85 3.86 0.00 1.68 1.52 0.99 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 121 A 7.89 4.04 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 R 7.97 3.85 0.00 2.05 1.99 0.00 3.15 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 123 L 7.77 3.87 0.00 1.76 1.78 0.82 0.93 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 0.00 124 I 7.69 3.71 1.87 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 1.39 0.61 0.91 0.00 0.00 125 E 8.21 3.91 0.00 1.98 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 2.32 2.39 0.00 126 Q 8.49 4.22 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.49 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 127 A 8.42 4.71 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.08 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 0.00 0.00 0.00 129 N 8.14 4.79 0.00 2.69 2.81 0.00 0.00 6.73 7.35 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 0.00 130 A 7.56 4.64 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 0.00 131 A 8.79 4.07 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 0.00 132 E 8.11 4.09 0.00 2.14 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 2.30 2.48 0.00 133 G 8.60 3.66 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 0.00 0.00 0.00 134 G 6.78 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 0.00 0.00 0.00 0.00 135 I 7.64 5.16 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 1.18 1.22 0.96 0.00 0.00 136 L 8.32 4.79 0.00 1.60 1.65 0.93 0.75 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 0.00 137 A 9.10 5.15 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 V 9.17 4.79 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 0.78 0.00 0.00 0.94 0.00 0.00 139 P 0.00 3.74 0.00 1.46 1.04 0.00 3.42 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.44 0.00 140 V 8.00 3.73 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 0.68 0.00 0.00 0.92 0.00 0.00 141 A 8.55 4.31 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 0.00 142 D 7.67 4.78 0.00 2.65 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 T 8.32 3.90 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 1.20 0.00 0.00 144 L 8.34 4.72 0.00 1.81 1.56 0.93 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 145 K 8.47 4.96 0.00 1.58 1.67 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.33 7.81 146 R 9.51 4.45 0.00 1.82 1.78 0.00 3.07 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 147 A 8.56 4.74 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 0.00 148 E 9.22 4.30 0.00 1.90 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.20 0.00 149 S 8.02 4.62 0.00 3.81 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 G 9.00 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 0.00 0.00 0.00 151 Q 7.50 4.61 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.05 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 152 I 8.29 4.30 1.87 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 1.47 0.53 0.96 0.00 0.00 153 S 8.37 4.70 0.00 3.88 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 0.00 154 A 7.54 4.39 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 0.00 155 T 8.56 4.83 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 156 V 8.04 4.10 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 0.69 0.00 0.00 0.94 0.00 0.00 157 D 8.76 4.38 0.00 2.64 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 R 8.44 4.46 0.00 1.97 2.10 0.00 3.18 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.49 0.00 159 S 7.98 4.15 0.00 4.01 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 0.00 160 G 8.82 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 0.00 161 L 7.65 4.95 0.00 1.76 1.64 0.99 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 162 W 8.71 5.44 0.00 3.04 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 9.39 4.76 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.02 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 164 A 8.75 4.51 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 Q 8.62 5.10 0.00 1.96 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.65 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 166 T 8.28 4.84 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 1.28 0.00 0.00 167 P 0.00 4.86 0.00 2.11 2.05 0.00 3.57 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.26 0.00 168 Q 8.93 4.55 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 169 L 8.02 4.89 0.00 1.61 1.28 0.80 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 170 F 8.61 5.21 0.00 3.12 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 Q 8.90 4.49 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.84 0.00 0.00 0.00 0.00 0.00 2.48 2.41 0.00 172 A 9.14 4.15 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 0.00 173 G 8.23 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 0.00 0.00 0.00 174 L 7.86 3.95 0.00 1.79 1.90 0.88 0.64 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 0.00 175 L 8.09 3.84 0.00 1.90 1.71 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 176 H 8.14 4.09 0.00 3.25 3.52 0.00 6.00 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 R 8.02 3.97 0.00 2.14 2.04 0.00 3.26 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.51 0.00 178 A 8.19 4.06 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 0.00 179 L 7.35 4.48 0.00 1.62 1.67 0.93 0.69 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 0.00 180 A 7.46 4.13 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *186 G 7.70 3.77 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 0.00 0.00 0.00 187 I 7.44 4.53 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.65 0.90 0.00 0.00 188 T 8.50 4.14 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 1.22 0.00 0.00 189 D 8.60 4.76 0.00 2.97 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 0.00 190 E 8.82 4.06 0.00 2.41 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 2.51 2.49 0.00 191 A 8.81 4.06 1.57 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 0.00 192 S 8.66 4.30 0.00 4.07 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 A 7.56 3.99 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 V 7.38 3.53 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 0.86 0.00 0.00 0.02 0.00 0.00 195 E 8.09 4.48 0.00 2.18 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 2.32 2.35 0.00 196 K 7.50 4.08 0.00 1.87 1.85 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.15 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.72 7.81 197 L 7.75 4.28 0.00 1.81 1.67 0.88 0.81 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 0.00 198 G 7.98 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 0.00 199 V 7.48 4.18 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 1.02 0.00 0.00 0.90 0.00 0.00 200 R 8.26 4.52 0.00 1.80 1.84 0.00 3.25 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 201 P 0.00 4.64 0.00 2.05 2.28 0.00 3.69 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.28 0.00 202 L 8.75 4.24 0.00 1.51 1.48 0.88 0.80 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 0.00 203 L 8.05 4.53 0.00 0.66 0.39 -0.11 0.44 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 0.00 204 I 8.40 4.47 1.96 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 1.07 0.53 0.91 0.00 0.00 205 Q 8.93 4.30 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.78 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 206 G 8.41 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 0.00 207 D 9.25 4.59 0.00 2.69 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 A 8.71 4.28 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 R 8.82 4.07 0.00 1.75 1.97 0.00 3.14 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 210 N 8.28 4.66 0.00 2.61 3.06 0.00 0.00 6.99 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 0.00 211 L 7.35 4.53 0.00 1.61 1.51 0.92 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 212 K 8.33 4.35 0.00 1.70 1.73 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.40 7.81 213 L 8.30 4.39 0.00 1.63 1.58 0.92 0.99 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 0.00 214 T 8.35 4.64 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 0.00 215 Q 7.60 4.60 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 216 P 0.00 4.22 0.00 2.18 2.18 0.00 3.62 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 217 Q 8.17 4.02 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 218 D 8.58 4.70 0.00 2.85 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 0.00 219 A 8.21 4.06 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 0.00 220 Y 7.99 4.03 0.00 3.01 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 0.00 221 I 7.73 3.44 1.85 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 1.62 0.60 0.87 0.00 0.00 222 V 7.52 3.48 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 0.94 0.00 0.00 0.93 0.00 0.00 223 R 7.80 3.83 0.00 1.83 2.13 0.00 3.36 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 224 L 7.41 3.98 0.00 1.34 1.56 0.81 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 225 L 7.74 4.15 0.00 1.83 1.64 0.91 0.58 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 0.00 226 L 7.75 4.24 0.00 1.58 1.69 0.60 1.05 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 0.00 227 D 7.45 4.54 0.00 2.69 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.