NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6403 8.2048 117.5817 55.1235 32.5924 174.2666 2 R 4.2613 9.0870 118.7105 55.5515 32.9031 174.9680 3 L 2.9868 8.8590 115.7646 51.0780 43.8584 176.1620 4 P 4.8843 0.0000 0.0000 62.7317 32.9645 176.1985 5 I 4.8464 8.6810 123.5799 59.0602 42.1594 173.6453 6 L 5.0298 8.6207 129.2221 53.4904 44.8331 174.9180 7 I 4.6734 8.8407 128.3333 59.7176 39.5750 174.9252 8 I 4.6651 8.7845 129.3245 59.9756 38.3056 174.5515 9 N 4.9593 9.2950 128.3867 52.4490 39.4633 175.9313 10 F 4.7468 9.5688 126.3912 58.2082 40.3189 177.1751 11 K 3.5234 8.1135 120.4823 57.9829 30.9273 175.6931 12 A 4.7134 7.9159 126.5007 52.8727 19.7366 175.9789 13 Y 4.3656 7.5886 117.8229 59.4652 38.6230 178.1729 14 G 3.7129 8.9303 113.2944 48.5936 0.0000 175.2659 15 E 4.0210 8.3157 117.7677 58.2036 29.4801 177.2004 16 A 4.4259 8.1273 120.5873 51.4348 19.7497 175.5848 17 A 4.5471 8.0680 121.8747 52.1301 21.4804 179.3391 18 G 3.7936 8.5451 107.6248 46.3255 0.0000 176.9195 19 K 3.9710 8.6805 119.2668 59.5439 31.8844 178.8129 20 R 3.9312 7.9275 117.9162 58.9934 29.8212 178.8267 21 A 4.2240 8.0121 122.1241 54.7313 18.3433 179.8914 22 V 3.6288 7.8034 116.2381 65.9771 31.6597 177.8653 23 E 3.9449 8.2981 118.4139 59.3581 29.3353 179.0721 24 L 3.8700 8.2961 120.3950 58.1285 42.0560 178.7448 25 A 4.2216 8.3954 120.7626 55.3345 18.2466 179.8118 26 K 3.9733 8.5079 116.9864 59.5184 32.1138 179.4365 27 A 4.0978 8.3264 120.9604 55.1282 18.1892 179.5830 28 A 3.9948 8.2568 119.4210 55.2150 18.4061 179.4690 29 E 3.8856 8.5794 118.2843 59.3963 29.7397 179.1460 30 R 3.9378 8.4582 118.2289 59.3215 30.1562 178.6590 31 A 4.0382 8.2595 120.1815 55.2885 18.3651 179.3461 32 A 3.9389 8.2592 119.2614 55.5239 18.2203 180.1466 33 R 3.8897 8.0041 115.1521 59.5117 30.2607 178.7218 34 E 4.1456 8.5371 117.4457 59.1256 29.6166 178.7128 35 L 4.4610 8.1290 116.3449 53.6298 42.4558 176.7135 36 G 3.8940 8.2167 106.8234 46.7843 0.0000 173.7174 37 V 4.3140 7.6410 117.2297 60.3995 34.3507 174.8856 38 N 4.6147 8.4843 124.7042 53.1757 38.8106 172.4084 39 I 4.7283 8.0447 125.6774 59.4792 38.8812 175.2177 40 V 4.5090 9.0401 127.6155 60.8861 34.5303 174.5750 41 V 4.6762 8.0304 124.0309 59.8796 34.6192 174.4386 42 A 5.5773 8.6102 125.1898 48.2327 19.8050 173.7686 43 P 4.6307 0.0000 0.0000 61.8140 33.1648 176.2550 44 N 4.6566 8.8075 117.3193 52.8551 38.2652 175.5143 45 H 4.1531 8.9183 117.2352 59.6416 28.5515 177.7050 46 L 4.1011 7.7237 118.3067 57.0648 41.3576 178.4466 47 E 4.5844 8.3150 116.2002 55.7105 29.9531 177.3751 48 L 4.0691 7.8850 122.6801 58.2164 42.2416 179.1069 49 G 3.5935 8.0344 104.9348 47.6757 0.0000 174.9370 50 L 3.9428 7.8777 121.3860 57.9606 42.3282 178.8076 51 V 3.7647 8.2638 118.3682 66.1708 31.2529 178.0095 52 S 4.1542 8.1490 114.0875 61.4581 62.7434 175.8218 53 Q 4.3967 7.8057 117.5364 56.1901 28.7986 176.3225 54 S 4.6963 8.2120 115.8157 58.3827 64.7542 174.0111 55 V 4.5997 7.4589 111.5182 59.9738 35.3604 174.6320 56 D 4.8341 9.7602 120.3885 54.1070 41.8309 177.3257 57 I 4.0388 7.4412 112.5688 59.5227 38.8699 173.8048 58 P 4.4343 0.0000 0.0000 62.7164 32.7065 175.4601 59 V 4.7052 8.4534 122.9451 61.4392 34.0989 173.7171 60 Y 5.4557 9.0544 125.5708 56.3034 40.8046 175.0954 61 A 4.6299 8.6637 124.2145 51.6095 19.7303 178.9117 62 Q 3.9571 9.0253 119.0498 57.0239 29.1365 176.2469 63 G 4.4234 7.4872 105.2551 45.5567 0.0000 171.2213 64 A 4.6644 7.9607 120.4089 51.3889 21.5811 175.7331 65 D 4.8838 8.8323 116.4105 52.7251 41.3509 175.5949 66 V 4.2964 7.4808 118.7778 61.6254 35.0583 175.4052 67 E 4.0685 9.0411 125.9958 58.6457 29.8969 176.6940 68 A 4.9172 7.6680 120.2259 49.6073 21.9172 175.7438 69 G 3.8355 8.3841 109.0311 45.3533 0.0000 173.8061 70 G 3.5853 8.0266 104.3062 44.7118 0.0000 173.3964 71 A 4.2891 7.7741 120.3387 51.6686 17.4150 178.1447 72 H 5.0146 7.4185 121.0554 52.8843 29.7061 173.7902 73 T 3.9492 7.8529 115.5258 65.3335 69.1772 174.4817 74 A 3.6849 8.7335 126.3592 53.0097 16.2843 176.5234 75 H 4.9258 7.9449 113.8656 54.9109 31.7164 174.6246 76 V 4.3292 8.6958 120.7109 61.4057 33.3606 174.8000 77 S 5.6225 8.3208 122.6006 56.3749 65.2906 175.3913 78 L 3.9957 8.4828 121.2745 57.9838 41.3192 179.7219 79 E 3.9582 7.9930 118.5753 59.5460 29.3887 179.1570 80 N 4.8255 8.1260 117.7995 55.6969 38.4206 177.6174 81 I 3.6908 7.6009 121.3458 64.1771 37.2265 178.3390 82 K 3.9223 8.0051 120.4700 59.6466 31.9603 178.7906 83 E 4.0245 8.6031 118.9222 58.9771 29.1283 178.5767 84 A 4.3105 7.8946 119.2863 52.5629 18.7456 178.0374 85 G 4.0678 7.7181 105.5407 45.0091 0.0000 174.4932 86 G 3.8103 8.1274 108.6862 45.6479 0.0000 174.2155 87 S 4.6128 9.1465 117.0413 58.7957 65.0685 173.8370 88 G 3.9242 7.6607 105.2642 46.2599 0.0000 172.2983 89 V 4.9596 7.7508 117.7752 60.5285 35.2313 173.1904 90 I 4.9575 8.6541 123.9066 59.8201 39.3561 174.7219 91 L 4.9302 9.0181 126.3474 53.1658 45.6359 175.9366 92 N 4.4517 8.8688 117.3995 54.7932 37.3972 173.9736 93 H 4.2749 8.1160 115.0768 55.3650 30.7565 175.4301 94 S 3.6916 8.4378 120.0225 61.6912 62.0656 175.2322 95 E 4.2403 8.4728 116.3572 57.4853 30.2008 176.5279 96 A 4.7187 8.6217 122.6847 49.9513 19.3271 174.5668 97 P 4.5409 0.0000 0.0000 62.2911 32.5067 176.7466 98 L 4.7974 8.4128 121.0620 52.4810 44.5930 177.1017 99 K 4.1593 8.2326 120.1136 55.8682 33.7962 177.7392 100 L 3.8768 8.5669 125.5360 58.6978 41.8608 179.0831 101 N 4.2952 8.1662 115.4938 56.5956 38.4392 177.0071 102 D 4.3059 7.9802 119.5785 57.1552 41.0110 178.1826 103 L 3.8905 8.3973 121.0574 58.1344 42.0499 178.9110 104 A 3.9329 8.3158 120.8669 55.2715 18.3416 179.8326 105 R 3.8393 7.6920 116.4331 59.3966 30.1069 179.2925 106 L 3.9573 8.2349 119.1562 57.6870 41.6241 179.7266 107 V 3.4882 7.8935 117.8738 65.9006 31.5048 177.8738 108 A 3.9009 7.7038 119.8889 55.1246 18.2826 179.4836 109 K 3.8414 8.4671 118.3206 59.4609 32.1403 178.7228 110 A 3.9555 8.3294 121.4341 55.2445 18.2780 179.8094 111 K 3.9173 7.9395 116.8766 59.6779 31.8926 179.5851 112 S 4.0879 7.9583 112.3603 61.0645 62.3788 175.4298 113 L 4.3132 7.7455 119.3449 54.8227 41.6668 177.7844 114 G 3.9252 8.0006 107.4562 45.2510 0.0000 173.5141 115 L 4.5041 7.7538 119.3814 53.9476 42.5757 176.7045 116 D 4.5728 8.6722 122.7187 54.1658 42.5448 175.8448 117 V 4.6110 8.5267 120.3091 59.9957 35.0434 174.1037 118 V 4.8723 8.6261 124.1258 60.9723 34.6302 174.0001 119 V 4.7931 8.5827 127.5804 61.4068 33.6163 174.5469 120 C 5.0645 9.0887 125.8866 59.4348 29.6156 172.9140 121 A 4.7939 8.4765 121.8034 50.1711 22.0544 175.8972 122 P 4.8167 0.0000 0.0000 64.4447 32.1475 175.9637 123 D 4.7008 7.5836 117.5924 50.4295 43.4402 174.0542 124 P 4.4139 0.0000 0.0000 65.2329 31.2835 178.8437 125 R 3.9061 7.9633 116.9033 59.9147 29.9594 178.5485 126 T 3.9632 8.8625 115.8483 66.6319 68.4010 177.0186 127 S 4.1396 8.2527 117.3758 61.3669 62.5620 176.4793 128 L 4.1201 8.0911 122.6735 57.9744 42.2224 178.5791 129 A 4.1212 8.0768 120.6367 55.0091 18.3452 179.3815 130 A 3.8585 8.3371 119.4448 55.3924 18.4970 179.7990 131 A 3.8938 8.5487 119.1391 54.9456 18.1495 179.6192 132 A 2.5800 7.2480 118.4075 54.3822 18.3951 179.2414 133 L 4.0424 7.4823 116.2672 55.5100 41.8353 177.4843 134 G 3.6706 7.6050 107.0423 45.4165 0.0000 172.0486 135 P 4.4577 0.0000 0.0000 61.8974 32.5593 175.7606 136 H 4.4690 8.4890 114.8229 58.6889 29.6041 175.7398 137 A 5.1853 7.8282 117.4243 50.5884 23.0071 175.1843 138 V 4.8033 8.9518 118.9715 60.9972 35.2306 174.5819 139 A 5.7321 9.3738 129.2555 49.0360 21.0348 175.4108 140 V 4.1499 8.2316 122.0026 62.5047 32.9016 175.1588 141 E 4.8639 9.4170 126.6250 52.4657 32.5250 172.5949 142 P 4.6313 0.0000 0.0000 61.9265 31.7819 175.9986 143 P 4.2928 0.0000 0.0000 65.5736 31.4947 178.6567 144 E 4.0008 8.1466 116.3684 58.7135 29.6915 177.7233 145 L 4.2545 7.8667 118.0917 55.5784 42.3901 176.9057 146 I 3.7611 7.2414 120.0228 62.9031 37.2710 176.1835 147 G 3.9880 8.8402 111.9001 46.3669 0.0000 174.0994 148 T 4.0649 8.0820 109.7471 61.6357 69.4155 176.3007 149 G 3.8068 8.2900 109.5744 45.2785 0.0000 173.7665 150 R 3.8936 7.6454 119.5388 54.0539 29.1304 175.3077 151 A 4.2205 8.4361 125.1950 52.2144 20.0152 178.0261 152 V 3.5161 8.5315 124.6162 64.9830 31.2442 178.8677 153 S 4.2877 8.1317 112.4897 59.9303 63.0777 175.2303 154 R 4.3834 7.8122 120.2148 57.9156 31.6111 177.0017 155 Y 4.2660 8.9434 115.2393 58.7646 39.6124 175.9567 156 K 5.0097 8.7387 121.3221 52.7672 32.7509 175.4006 157 P 4.3206 0.0000 0.0000 66.1884 31.3156 177.5341 158 E 3.9513 8.3378 117.6564 59.4265 29.2044 178.9681 159 A 4.0237 7.9527 120.2100 55.0884 18.3024 179.8925 160 I 3.6877 7.6228 117.7706 64.4813 37.4295 178.3199 161 V 3.5769 7.7779 119.0684 66.2387 31.2284 177.6508 162 E 3.9455 8.4496 118.9938 59.5232 29.3227 178.9338 163 T 3.8724 7.7177 115.8620 66.6855 68.5916 176.8165 164 V 3.7217 8.1938 120.6443 65.8553 31.5012 178.3565 165 G 3.5574 8.2520 105.3888 47.8056 0.0000 175.7142 166 L 4.0193 8.2153 122.5294 57.4444 41.6555 179.9311 167 V 3.7439 8.4092 118.7691 65.9973 31.2878 178.2080 168 S 4.1830 8.0414 112.9061 60.9910 62.9638 176.1572 169 R 3.9018 7.8596 122.1467 58.9623 29.8674 177.0954 170 H 4.2664 7.8703 113.8643 55.9271 31.3825 175.4179 171 F 5.6364 7.9836 117.3897 53.7427 38.9725 173.9192 172 P 4.2801 0.0000 0.0000 65.3717 31.7783 178.3122 173 E 4.1426 8.2437 117.7369 57.8635 29.9003 175.8642 174 V 4.4372 7.8289 119.8849 61.8885 32.5082 175.9017 175 S 4.7537 9.0127 124.0645 57.7065 65.3129 173.0488 176 V 4.9934 8.2672 121.0252 61.2376 34.5172 174.3355 177 I 5.0894 8.7054 119.9709 59.6484 41.8345 173.4177 178 T 5.0911 8.3024 114.6084 61.3303 71.4278 171.9483 179 G 4.4283 9.0602 109.6770 46.2939 0.0000 172.7493 180 A 4.0414 8.2750 118.8191 53.7227 19.0940 179.6372 181 G 4.0422 8.7343 110.2063 46.3134 0.0000 173.3485 182 I 3.7787 7.6893 120.7873 61.7531 37.0477 175.3144 183 E 4.6361 9.4756 123.1113 55.3347 31.1014 176.0673 184 S 5.0055 7.8934 113.9217 55.6999 67.7370 174.7771 185 G 3.6183 9.3593 108.9529 47.8400 0.0000 175.8813 186 D 4.3778 8.0325 120.8227 57.4061 40.9255 178.2549 187 D 4.4101 8.1508 119.5202 57.2167 40.6874 179.1072 188 V 3.5459 7.6546 118.5903 65.8418 31.5247 177.7326 189 A 3.9576 8.1238 120.3838 55.4019 18.0111 179.3881 190 A 3.9085 8.1908 117.7982 55.2454 18.7850 179.4687 191 A 4.0979 8.0016 119.2031 55.4029 18.5043 179.8838 192 L 3.9911 8.2134 117.7828 58.0254 41.4580 179.9866 193 R 4.0862 8.1158 117.0815 58.5016 29.9893 177.9865 194 L 4.4317 7.3650 116.9151 54.7112 41.7870 177.5121 195 G 4.0342 7.9833 107.7217 45.3420 0.0000 174.5965 196 T 4.3106 7.4846 115.5252 63.8033 69.3146 174.2254 197 R 4.5514 10.0135 121.6333 54.4586 30.3175 176.4234 198 G 4.1959 6.9365 105.1625 46.8224 0.0000 171.4938 199 V 4.8550 8.1633 118.4402 61.2427 34.9751 173.8313 200 L 5.3589 8.8391 126.4941 53.1994 44.9466 175.2508 201 L 4.6891 9.1061 125.1251 54.9288 44.1999 174.5954 202 A 4.8150 8.5924 118.5285 50.8039 21.8329 178.3835 203 S 3.7928 8.0982 108.7554 61.3803 63.0548 176.7295 204 A 3.9092 7.9998 121.8681 55.4369 18.4699 179.1927 205 A 4.0370 7.8037 118.1422 55.3126 18.6695 179.6948 206 V 3.3906 7.7465 115.5737 65.4442 31.5392 176.8588 207 K 4.2298 7.8731 114.9708 55.7695 32.1738 176.4657 208 A 4.1768 7.4162 122.2298 51.7801 18.8433 178.8040 209 K 4.1176 8.6030 120.7548 58.7448 32.6579 177.1531 210 D 4.8203 7.5297 118.0146 50.2670 41.2530 173.4474 211 P 4.1850 0.0000 0.0000 65.4312 31.6932 176.6319 212 Y 4.0675 8.1386 117.0471 60.8218 38.7319 177.9437 213 A 3.7571 8.2920 121.4309 54.9555 18.4154 179.4843 214 K 3.8193 8.3459 118.4621 59.8301 32.3141 179.1408 215 I 3.6420 8.3459 120.4309 64.1765 36.9410 178.6617 216 V 3.4156 7.6199 119.3126 65.6713 31.0725 177.6125 217 E 3.8673 7.7885 117.9415 59.4732 29.5860 178.6082 218 L 4.0936 7.9336 117.5176 57.5219 41.9108 178.8581 219 A 4.2084 8.5119 120.4577 53.6680 18.6501 179.1528 220 K 3.7204 8.0179 118.9052 59.5493 31.9757 176.9617 221 P 4.4928 0.0000 0.0000 65.2983 30.9630 178.4102 222 L 4.0651 7.9142 117.7178 57.0980 41.6094 178.7300 223 S 4.3788 7.9102 112.7661 59.9833 63.4344 175.3993 224 E 4.4070 7.9811 120.6460 56.3392 30.9845 176.2133 225 L 4.2916 7.2964 124.2957 53.6759 40.8526 176.9006 *226 R 4.1530 7.9267 120.2092 55.8724 30.0397 175.9108 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 8.20 4.64 0.00 2.37 2.24 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 2 R 9.09 4.26 0.00 1.91 1.90 0.00 3.23 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 3 L 8.86 2.99 0.00 1.67 1.46 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.88 0.00 1.94 1.98 0.00 3.62 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 5 I 8.68 4.85 2.05 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 1.07 1.84 0.95 0.00 0.00 6 L 8.62 5.03 0.00 1.78 1.46 0.92 1.02 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 7 I 8.84 4.67 1.89 0.00 0.00 1.00 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 0.53 0.86 0.00 0.00 8 I 8.78 4.67 2.11 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.17 1.13 0.00 0.00 9 N 9.30 4.96 0.00 2.86 2.90 0.00 0.00 6.86 7.53 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 10 F 9.57 4.75 0.00 3.19 3.06 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 11 K 8.11 3.52 0.00 1.44 1.27 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.40 1.58 7.81 12 A 7.92 4.71 1.14 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 13 Y 7.59 4.37 0.00 3.17 2.97 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 14 G 8.93 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 15 E 8.32 4.02 0.00 1.85 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 16 A 8.13 4.43 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.07 4.55 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 8.55 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.68 3.97 0.00 1.86 1.89 0.00 1.59 0.00 0.00 1.83 0.00 0.00 3.13 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.61 7.81 20 R 7.93 3.93 0.00 2.03 2.05 0.00 3.11 0.00 0.00 3.19 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 21 A 8.01 4.22 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 V 7.80 3.63 2.25 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 1.18 0.00 0.00 0.97 0.00 0.00 23 E 8.30 3.94 0.00 2.22 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 2.33 2.44 0.00 24 L 8.30 3.87 0.00 1.52 1.48 0.80 -0.15 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 25 A 8.40 4.22 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.51 3.97 0.00 2.04 1.89 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.58 7.81 27 A 8.33 4.10 1.48 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 0.00 0.00 0.00 28 A 8.26 3.99 1.49 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 0.00 0.00 29 E 8.58 3.89 0.00 2.13 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 2.33 2.37 0.00 30 R 8.46 3.94 0.00 2.23 2.08 0.00 3.04 0.00 0.00 2.99 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 31 A 8.26 4.04 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 32 A 8.26 3.94 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.00 3.89 0.00 1.96 2.03 0.00 3.19 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.82 0.00 34 E 8.54 4.15 0.00 2.23 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 0.00 2.51 2.48 0.00 35 L 8.13 4.46 0.00 1.60 1.70 0.91 0.86 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 36 G 8.22 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 37 V 7.64 4.31 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 0.83 0.00 0.00 0.92 0.00 0.00 38 N 8.48 4.61 0.00 2.89 2.90 0.00 0.00 7.02 7.89 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 39 I 8.04 4.73 1.86 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 1.21 0.88 0.90 0.00 0.00 40 V 9.04 4.51 1.68 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 -0.06 0.00 0.00 0.57 0.00 0.00 41 V 8.03 4.68 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 0.45 0.00 0.00 0.99 0.00 0.00 42 A 8.61 5.58 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 43 P 0.00 4.63 0.00 2.10 1.87 0.00 3.77 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.85 0.00 44 N 8.81 4.66 0.00 2.96 3.24 0.00 0.00 5.88 7.90 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 45 H 8.92 4.15 0.00 3.21 3.40 0.00 5.65 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 46 L 7.72 4.10 0.00 1.77 1.77 0.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.31 4.58 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 48 L 7.89 4.07 0.00 1.75 1.69 0.94 1.08 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 49 G 8.03 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 7.88 3.94 0.00 1.65 1.92 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.26 3.76 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 1.08 0.00 0.00 1.08 0.00 0.00 52 S 8.15 4.15 0.00 4.12 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 53 Q 7.81 4.40 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 54 S 8.21 4.70 0.00 3.93 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 7.46 4.60 2.20 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 0.78 0.00 0.00 1.02 0.00 0.00 56 D 9.76 4.83 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 57 I 7.44 4.04 2.01 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 1.41 0.49 0.91 0.00 0.00 58 P 0.00 4.43 0.00 1.91 2.08 0.00 3.45 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 2.20 2.08 0.00 59 V 8.45 4.71 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.96 0.00 0.00 60 Y 9.05 5.46 0.00 2.78 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 61 A 8.66 4.63 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 62 Q 9.03 3.96 0.00 1.91 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.99 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 63 G 7.49 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 64 A 7.96 4.66 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 65 D 8.83 4.88 0.00 2.63 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 66 V 7.48 4.30 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.68 0.00 0.00 67 E 9.04 4.07 0.00 1.93 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.28 0.00 68 A 7.67 4.92 1.30 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 0.00 0.00 69 G 8.38 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 70 G 8.03 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.77 4.29 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 H 7.42 5.01 0.00 3.18 3.19 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 73 T 7.85 3.95 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 1.21 0.00 0.00 74 A 8.73 3.68 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 75 H 7.94 4.93 0.00 3.26 3.33 0.00 5.61 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.70 4.33 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 0.95 0.00 0.00 0.62 0.00 0.00 77 S 8.32 5.62 0.00 3.97 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 78 L 8.48 4.00 0.00 1.85 1.73 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 79 E 7.99 3.96 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.57 0.00 80 N 8.13 4.83 0.00 2.93 2.86 0.00 0.00 6.59 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.60 3.69 2.03 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 1.40 0.83 0.90 0.00 0.00 82 K 8.01 3.92 0.00 1.83 1.97 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.48 7.81 83 E 8.60 4.02 0.00 2.15 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 2.33 2.43 0.00 84 A 7.89 4.31 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 7.72 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 86 G 8.13 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 9.15 4.61 0.00 3.93 4.05 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 88 G 7.66 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 89 V 7.75 4.96 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.90 0.00 0.00 90 I 8.65 4.96 2.05 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.84 0.97 0.00 0.00 91 L 9.02 4.93 0.00 1.49 1.50 0.88 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.87 4.45 0.00 2.82 2.99 0.00 0.00 6.98 7.89 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 93 H 8.12 4.27 0.00 3.28 3.16 0.00 5.96 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.44 3.69 0.00 3.71 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 95 E 8.47 4.24 0.00 2.04 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 2.30 2.36 0.00 96 A 8.62 4.72 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.54 0.00 2.19 2.07 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 98 L 8.41 4.80 0.00 1.62 1.58 0.91 0.79 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 99 K 8.23 4.16 0.00 1.78 1.71 0.00 1.83 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.48 7.81 100 L 8.57 3.88 0.00 1.73 1.66 0.89 0.65 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 0.00 101 N 8.17 4.30 0.00 2.75 2.84 0.00 0.00 7.05 8.08 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 0.00 102 D 7.98 4.31 0.00 2.81 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 0.00 103 L 8.40 3.89 0.00 1.91 1.85 0.90 0.97 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 0.00 104 A 8.32 3.93 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 0.00 105 R 7.69 3.84 0.00 1.93 2.14 0.00 3.18 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 106 L 8.23 3.96 0.00 1.62 1.68 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.89 3.49 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 0.95 0.00 0.00 0.94 0.00 0.00 108 A 7.70 3.90 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 0.00 109 K 8.47 3.84 0.00 1.93 1.97 0.00 1.51 0.00 0.00 1.63 0.00 0.00 3.21 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.48 7.81 110 A 8.33 3.96 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 0.00 111 K 7.94 3.92 0.00 1.94 1.85 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.36 7.81 112 S 7.96 4.09 0.00 3.86 4.05 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 0.00 113 L 7.75 4.31 0.00 1.83 1.68 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.00 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 0.00 0.00 0.00 115 L 7.75 4.50 0.00 1.63 1.50 0.91 1.23 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 0.00 116 D 8.67 4.57 0.00 2.10 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 0.00 117 V 8.53 4.61 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 0.67 0.00 0.00 0.87 0.00 0.00 118 V 8.63 4.87 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 0.99 0.00 0.00 1.03 0.00 0.00 119 V 8.58 4.79 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.90 0.00 0.00 120 C 9.09 5.06 0.00 2.99 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 0.00 121 A 8.48 4.79 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 0.00 122 P 0.00 4.82 0.00 2.17 2.18 0.00 3.11 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 123 D 7.58 4.70 0.00 2.92 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 0.00 124 P 0.00 4.41 0.00 2.19 2.16 0.00 3.89 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 2.13 2.23 0.00 125 R 7.96 3.91 0.00 1.88 1.93 0.00 3.19 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 1.74 0.00 126 T 8.86 3.96 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 127 S 8.25 4.14 0.00 4.06 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 8.09 4.12 0.00 1.74 1.95 1.09 1.01 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 0.00 129 A 8.08 4.12 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 0.00 130 A 8.34 3.86 1.37 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 0.00 0.00 131 A 8.55 3.89 1.48 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 0.00 0.00 0.00 132 A 7.25 2.58 1.13 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 0.00 0.00 133 L 7.48 4.04 0.00 1.64 1.64 0.86 0.75 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 0.00 134 G 7.60 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 P 0.00 4.46 0.00 2.42 2.03 0.00 3.66 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 136 H 8.49 4.47 0.00 3.24 3.40 0.00 5.61 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 0.00 137 A 7.83 5.19 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 0.00 138 V 8.95 4.80 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 0.97 0.00 0.00 0.95 0.00 0.00 139 A 9.37 5.73 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 0.00 140 V 8.23 4.15 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 0.77 0.00 0.00 0.95 0.00 0.00 141 E 9.42 4.86 0.00 2.11 1.78 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 2.18 2.24 0.00 142 P 0.00 4.63 0.00 2.23 2.07 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 143 P 0.00 4.29 0.00 2.17 2.09 0.00 3.60 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 144 E 8.15 4.00 0.00 1.93 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 2.40 0.00 145 L 7.87 4.25 0.00 1.72 1.82 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 146 I 7.24 3.76 1.97 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 1.25 0.73 1.02 0.00 0.00 147 G 8.84 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 T 8.08 4.06 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 1.21 0.00 0.00 149 G 8.29 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 R 7.65 3.89 0.00 1.30 0.66 0.00 2.95 0.00 0.00 2.90 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 1.15 0.00 151 A 8.44 4.22 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 V 8.53 3.52 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.97 0.00 0.00 153 S 8.13 4.29 0.00 4.07 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 R 7.81 4.38 0.00 2.07 1.85 0.00 3.21 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.71 0.00 155 Y 8.94 4.27 0.00 2.99 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 0.00 156 K 8.74 5.01 0.00 1.77 1.69 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.47 7.81 157 P 0.00 4.32 0.00 2.30 2.31 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 158 E 8.34 3.95 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 159 A 7.95 4.02 1.37 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 0.00 0.00 160 I 7.62 3.69 2.02 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 1.55 0.72 0.93 0.00 0.00 161 V 7.78 3.58 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 1.00 0.00 0.00 0.98 0.00 0.00 162 E 8.45 3.95 0.00 2.31 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 2.32 2.36 0.00 163 T 7.72 3.87 4.40 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 1.24 0.00 0.00 164 V 8.19 3.72 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.02 0.00 0.00 165 G 8.25 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 L 8.22 4.02 0.00 1.72 1.78 0.95 0.74 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 0.00 167 V 8.41 3.74 2.20 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 1.23 0.00 0.00 1.05 0.00 0.00 168 S 8.04 4.18 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 0.00 169 R 7.86 3.90 0.00 1.85 2.11 0.00 3.13 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.46 0.00 170 H 7.87 4.27 0.00 2.51 1.67 0.00 5.65 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 F 7.98 5.64 0.00 3.18 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 0.00 172 P 0.00 4.28 0.00 2.18 2.37 0.00 3.85 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 173 E 8.24 4.14 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.40 0.00 174 V 7.83 4.44 2.32 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 0.77 0.00 0.00 1.02 0.00 0.00 175 S 9.01 4.75 0.00 3.85 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 0.00 176 V 8.27 4.99 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 0.93 0.00 0.00 0.97 0.00 0.00 177 I 8.71 5.09 1.94 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.61 0.94 0.00 0.00 178 T 8.30 5.09 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 179 G 9.06 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 0.00 0.00 0.00 0.00 180 A 8.27 4.04 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 G 8.73 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 0.00 0.00 0.00 182 I 7.69 3.78 1.89 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 1.50 0.60 0.93 0.00 0.00 183 E 9.48 4.64 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.32 0.00 184 S 7.89 5.01 0.00 4.10 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 G 9.36 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 D 8.03 4.38 0.00 2.71 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 0.00 187 D 8.15 4.41 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 0.00 188 V 7.65 3.55 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.03 0.00 0.00 189 A 8.12 3.96 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 0.00 190 A 8.19 3.91 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 0.00 191 A 8.00 4.10 1.42 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 0.00 192 L 8.21 3.99 0.00 1.83 1.74 0.92 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 193 R 8.12 4.09 0.00 1.91 2.00 0.00 3.15 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 194 L 7.36 4.43 0.00 1.82 1.70 0.97 0.83 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 0.00 195 G 7.98 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 0.00 0.00 0.00 196 T 7.48 4.31 4.45 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 1.29 0.00 0.00 197 R 10.01 4.55 0.00 1.77 1.90 0.00 3.46 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 198 G 6.94 4.20 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 0.00 199 V 8.16 4.85 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.95 0.00 0.00 200 L 8.84 5.36 0.00 1.82 1.49 1.01 0.52 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 0.00 201 L 9.11 4.69 0.00 1.77 1.72 0.95 0.73 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 0.00 202 A 8.59 4.81 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 S 8.10 3.79 0.00 3.85 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 A 8.00 3.91 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 0.00 205 A 7.80 4.04 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 0.00 206 V 7.75 3.39 1.89 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 0.64 0.00 0.00 0.97 0.00 0.00 207 K 7.87 4.23 0.00 1.68 1.66 0.00 1.43 0.00 0.00 1.52 0.00 0.00 3.08 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 0.88 7.81 208 A 7.42 4.18 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 K 8.60 4.12 0.00 1.74 1.87 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.40 7.81 210 D 7.53 4.82 0.00 2.63 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 P 0.00 4.18 0.00 2.21 2.09 0.00 3.68 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.25 0.00 212 Y 8.14 4.07 0.00 3.07 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 0.00 213 A 8.29 3.76 1.42 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 0.00 214 K 8.35 3.82 0.00 1.88 1.91 0.00 1.60 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.58 1.49 7.81 215 I 8.35 3.64 1.83 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 1.40 0.46 0.88 0.00 0.00 216 V 7.62 3.42 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.20 0.00 0.00 217 E 7.79 3.87 0.00 1.96 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 0.00 2.30 2.33 0.00 218 L 7.93 4.09 0.00 1.75 1.70 0.90 1.11 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 0.00 219 A 8.51 4.21 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 0.00 220 K 8.02 3.72 0.00 2.05 1.82 0.00 1.62 0.00 0.00 1.62 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.59 1.48 7.81 221 P 0.00 4.49 0.00 2.19 2.09 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 2.25 2.17 0.00 222 L 7.91 4.07 0.00 1.70 1.73 0.93 1.09 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 0.00 223 S 7.91 4.38 0.00 4.03 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 0.00 224 E 7.98 4.41 0.00 1.95 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 2.26 2.45 0.00 225 L 7.30 4.29 0.00 1.57 1.58 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 *226 R 7.93 4.15 0.00 1.62 1.73 0.00 3.28 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.