NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2473 7.8827 121.4459 61.1822 38.7370 173.7525 17 V 4.3611 8.7065 125.8794 61.7418 32.8633 174.4512 18 G 4.0306 8.5352 114.1990 46.7430 0.0000 173.3189 19 G 4.2563 7.7303 109.8866 44.2228 0.0000 172.6131 20 Y 4.9682 8.0730 117.1880 55.2432 42.2427 174.9414 21 T 4.2635 8.6063 117.2753 64.0870 68.4674 175.1230 22 C 4.3095 8.7225 125.4167 60.8710 36.8589 174.9012 23 G 4.0048 9.0835 106.8850 44.8275 0.0000 172.1716 24 A 4.1108 8.3814 125.6703 53.0629 17.8750 176.8522 25 N 4.1808 8.6596 122.1774 55.2147 36.1503 175.4727 26 T 4.2923 7.7448 106.2977 62.2596 70.2936 175.3228 27 V 4.0439 6.9723 121.9310 60.0407 31.3580 173.6543 28 P 4.8272 0.0000 0.0000 64.0141 31.9050 178.2974 29 Y 5.2447 6.9210 115.7710 57.0107 38.8725 174.6987 30 Q 4.5797 7.2407 123.3675 56.2365 29.5548 175.4883 31 V 4.8964 8.9928 118.8337 59.6253 36.4402 174.1831 32 S 5.0745 8.7073 116.6786 56.5420 65.0211 172.8032 33 L 4.4735 8.6135 127.9843 53.9713 42.8944 175.2517 34 N 5.7938 9.1534 122.6295 49.9522 41.9533 175.0199 *37 S 4.1752 8.4775 121.8892 58.3779 64.1384 174.5045 38 G 3.9767 9.5605 109.0886 46.1970 0.0000 173.0219 39 Y 4.5210 6.4555 114.9078 56.1802 39.9764 172.7347 40 H 4.6325 8.8907 121.8376 56.3419 30.4182 174.8600 41 F 5.0896 7.8513 119.2670 56.7770 39.6154 173.7172 42 C 4.7666 6.8638 114.9389 56.1713 44.7031 173.3607 43 G 4.3107 9.2450 110.3367 45.6369 0.0000 172.4512 44 G 4.3874 8.2751 105.2248 46.1543 0.0000 172.6142 45 S 5.4311 9.0992 116.0309 56.4150 66.7116 173.4858 46 L 4.7843 9.1643 127.7629 54.7435 42.4460 177.0766 47 I 4.3834 8.4328 119.7562 60.8337 38.9670 174.6369 48 N 4.4078 7.8372 117.5106 52.1086 39.1049 175.0701 49 S 4.1922 8.4298 113.3324 61.0190 62.8308 175.4201 50 Q 4.6403 9.2700 116.4796 55.2241 30.1836 175.1945 51 W 5.4708 8.5912 119.6725 55.0870 33.3008 174.4346 52 V 5.1523 9.0105 122.6674 61.0889 34.7890 174.3225 53 V 4.9070 9.1786 126.8239 60.4520 33.6987 174.8850 54 S 4.6772 8.8609 117.2128 57.4420 66.3945 172.0148 55 A 4.5464 8.5189 121.3246 51.0152 19.8520 178.6437 56 A 3.8327 8.3005 124.6673 55.1784 18.5015 179.2134 57 H 4.5521 8.4352 110.0277 57.5055 28.7109 175.4289 58 C 4.6708 7.7556 116.9835 57.2959 40.6316 173.3846 59 Y 4.3205 7.7015 121.7495 57.6305 38.8326 175.4021 60 K 3.2083 6.5465 122.4542 56.2720 34.2396 174.5321 61 S 4.2824 8.1498 116.6164 58.6920 63.8477 173.5920 62 G 3.7752 8.3006 107.0216 46.8409 0.0000 173.8903 63 I 4.2384 7.5193 119.6746 60.1158 39.2017 175.2365 64 Q 4.8376 8.9122 128.1136 54.1817 31.6264 174.3533 65 V 4.2129 8.9419 127.2901 62.2680 33.4952 174.7898 66 R 5.2097 8.8042 126.3064 54.7331 32.7153 175.0463 67 L 4.7382 9.2231 124.7107 52.5771 44.9902 177.3078 *69 G 4.0709 8.1855 106.0715 45.5508 0.0000 172.7137 70 E 4.5686 8.3160 118.2974 54.8930 30.4083 173.9200 71 D 4.8328 8.0217 117.6572 54.7929 44.3622 174.4004 72 N 5.5672 8.1554 117.2355 52.2814 39.4301 175.8883 73 I 4.0320 8.2670 118.6811 61.8716 37.9037 175.9342 74 N 4.8620 8.7380 117.8835 53.0203 39.3260 174.5173 75 V 4.3057 7.4675 118.2293 60.8404 34.4406 174.9229 76 V 4.1103 8.4842 127.0091 62.7247 30.9691 175.1972 77 E 4.3332 8.9158 127.3357 55.8088 30.0926 177.2120 78 G 4.0426 8.9401 106.7366 45.2623 0.0000 174.1279 79 N 5.0137 8.2014 115.7140 52.7724 40.2154 174.2726 80 E 4.5518 8.0153 117.2886 56.1204 31.4048 176.1703 81 Q 4.3007 9.0724 120.0301 54.3089 32.4756 174.2214 82 F 5.5912 8.6535 123.4760 56.1278 40.6512 175.3754 83 I 4.6538 8.8502 125.2958 59.2463 40.6462 175.7216 84 S 4.5761 8.7077 122.3707 58.4090 64.1796 173.1603 85 A 4.6630 8.4093 125.6283 51.8112 18.6305 177.6948 86 S 4.5712 9.0954 117.0823 59.9079 64.5629 174.6118 87 K 4.7384 7.5530 117.1984 55.6486 35.7121 175.0901 88 S 5.3118 8.7015 116.8014 57.0077 66.7231 173.7825 89 I 4.5794 9.1442 124.2214 59.5977 40.2519 174.8604 90 V 4.2394 8.4166 127.3398 62.0508 32.7419 175.1796 91 H 3.5754 8.5265 126.6474 55.7887 29.9888 174.3949 92 P 4.2676 0.0000 0.0000 65.4049 31.0791 177.1097 93 S 4.6783 7.8533 112.3356 57.9931 63.0618 173.1779 94 Y 4.2979 8.0434 123.4901 57.7735 39.0569 174.5311 95 N 4.6637 8.2490 125.7952 51.2760 40.0469 175.1373 96 S 4.1330 7.7538 120.7163 60.4280 63.5868 175.6971 97 N 4.3321 8.2264 118.7166 56.0267 38.2534 176.1603 98 T 3.9583 7.7397 104.8566 60.8641 69.8394 175.0936 99 L 3.7626 8.1437 121.0354 55.3243 39.8202 173.9103 100 N 4.4489 7.6555 118.2754 54.7074 39.4588 174.6466 101 N 5.0402 8.7288 120.2555 54.1461 35.9913 175.5456 102 D 4.7499 8.0132 117.2794 53.1538 39.4446 174.6851 103 I 4.9217 7.1457 121.0912 59.4815 42.3042 173.0123 104 M 5.4605 9.2876 124.1905 54.2045 35.0955 173.3176 105 L 5.3937 9.3496 120.3274 53.2634 45.2507 175.6302 106 I 5.0426 9.0160 122.8623 59.5357 40.7616 174.3002 107 K 3.8392 8.7753 129.5363 54.7478 33.5176 175.6220 108 L 4.3127 8.2220 128.1547 54.2783 41.7158 177.2882 109 K 4.1243 9.0910 123.9770 59.0586 32.5585 177.6634 110 S 4.5635 7.7217 111.3118 55.7030 66.0485 173.3503 111 A 4.2844 8.5261 123.8269 52.5380 18.6152 177.2622 112 A 4.2009 9.1597 124.1334 51.7106 19.8366 177.7908 113 S 4.4488 9.4832 116.0233 56.9625 62.4612 173.7902 114 L 4.6438 8.3911 128.1881 54.4513 43.1770 175.1936 115 N 4.8184 8.6628 124.6429 52.7282 39.2951 175.9547 116 S 4.4471 8.9409 110.1688 60.7458 63.6189 175.4512 117 R 4.0490 8.1464 118.2094 57.3550 30.3218 176.0547 118 V 4.3952 7.8478 116.9225 60.7955 32.5933 173.4483 119 A 5.2223 8.6366 128.2857 50.1384 23.0672 174.5530 120 S 5.2602 8.6929 113.3083 57.0741 65.4723 173.1737 121 I 4.3946 8.2501 121.6848 59.1415 39.2393 175.6137 122 S 4.3825 8.4245 124.4290 58.5126 63.9990 173.8626 123 L 4.2774 8.3037 122.6197 53.3507 42.5719 175.3373 124 P 4.4443 0.0000 0.0000 63.0050 31.5346 176.7556 125 T 4.1950 8.2500 110.0233 62.2113 69.9198 174.5053 *127 S 4.2448 7.5484 115.1410 58.0374 64.0480 174.0267 128 C 4.3910 8.4098 117.7651 56.7894 40.6194 173.4803 129 A 4.5002 8.0190 124.7610 51.1402 20.2445 176.8746 130 S 4.4951 8.0024 113.3132 56.3929 65.5444 173.1887 *132 A 4.2465 8.1870 123.0702 53.4684 19.2768 176.0983 133 G 4.0718 9.0710 109.4277 45.6291 0.0000 174.7301 134 T 3.9648 7.5727 116.6516 63.8566 69.3512 173.9522 135 Q 4.6898 8.5966 125.1162 55.7451 30.0968 175.6592 136 C 5.2277 9.1402 119.5369 55.2182 46.9255 172.3680 137 L 5.1360 9.0180 122.2643 53.6044 44.0190 174.8912 138 I 5.1763 9.0379 127.7374 58.8684 39.5814 174.9985 139 S 4.8895 8.7702 119.7734 56.3408 66.6269 173.0775 140 G 3.7480 7.2285 107.9307 46.2795 0.0000 173.0039 141 W 4.5512 8.5999 116.9067 56.2668 29.3558 176.9103 142 G 4.0857 8.3807 109.1179 44.2773 0.0000 173.4147 143 N 3.5642 8.4554 118.2381 54.3402 38.8939 174.4942 144 T 5.1172 7.9381 112.5807 60.4854 69.6064 174.2007 145 K 4.6167 7.8707 121.5039 54.8935 34.5715 176.0970 146 S 4.5780 8.5805 116.3116 59.0016 64.1434 174.1414 147 S 4.7716 8.1213 115.6959 56.5687 63.2678 173.5708 148 G 3.9533 7.2147 107.4455 47.5314 0.0000 171.3038 149 T 4.6822 8.1954 114.3873 60.7239 70.6643 175.0764 150 S 4.3997 9.1857 123.8733 58.0110 65.1742 172.3678 151 Y 4.7297 8.7335 126.0867 56.2578 38.6780 174.2499 152 P 4.6531 0.0000 0.0000 62.6454 32.7680 175.7426 153 D 4.7077 8.6838 118.4480 55.1128 41.9263 176.4690 154 V 5.0694 7.4936 117.6785 59.9781 33.8579 175.2871 155 L 3.1694 8.3127 127.6881 54.9971 42.9993 175.8107 156 K 4.8950 8.2015 125.4100 54.9115 34.9420 174.6999 157 C 5.1940 8.6683 120.7554 55.2667 43.3197 172.9065 158 L 4.8123 8.1892 121.1386 54.2129 45.7177 173.9182 159 K 5.0868 9.0140 125.9354 55.4160 33.3308 175.9579 160 A 4.8048 8.9893 126.4592 49.7124 23.0420 173.6148 161 P 5.0006 0.0000 0.0000 62.0328 33.9202 175.1392 162 I 4.4153 8.3710 122.2011 61.2486 38.1347 175.6592 163 L 4.8393 8.7613 127.3414 53.1435 43.3410 177.0360 164 S 4.2775 8.5422 115.6048 58.5152 63.7516 175.2896 165 D 4.4403 8.7401 122.2929 57.4604 40.5053 179.0654 166 S 4.1082 8.0521 113.5988 61.5036 62.5191 176.3159 167 S 4.1585 8.1345 116.9012 61.2320 62.7310 175.6747 168 C 4.2694 8.1563 122.2585 59.7545 42.4726 175.7815 169 K 3.9958 8.6097 120.4203 59.4247 31.3310 179.6875 170 S 4.1418 8.1092 114.8116 61.5441 62.8475 176.1775 171 A 3.9995 7.7955 122.2818 53.9102 19.7954 177.3887 172 Y 4.8379 7.7936 114.1318 54.8815 38.2484 172.8608 173 P 4.5373 0.0000 0.0000 63.5667 32.0050 177.4094 174 G 4.0176 9.0426 108.8492 46.3373 0.0000 173.8488 175 Q 4.5611 8.1341 117.3195 55.2164 31.1013 175.8612 176 I 4.3863 7.9177 118.8379 60.2723 38.4588 175.0206 177 T 4.6898 8.1878 114.2298 59.3562 71.2954 174.9057 178 S 4.3471 8.5760 115.0009 60.1879 63.2297 174.3957 179 N 4.8963 8.1900 118.3095 53.4963 38.6537 173.8925 180 M 5.6062 8.1191 117.5728 53.7622 36.2452 174.6577 181 F 5.1050 8.7722 114.5707 55.9621 42.0248 172.5890 182 C 5.7546 9.2875 116.9279 55.2365 41.8283 172.5085 183 A 5.0289 8.8648 122.0432 51.0799 22.2564 174.9912 184A G 4.0779 7.0864 107.3051 44.5984 0.0000 172.9288 184 Y 4.6394 8.4441 119.6810 55.9524 41.0099 176.4331 185 L 4.0590 8.6549 124.8430 57.2458 41.9551 178.5188 186 E 3.8577 8.2658 116.4958 56.4976 29.8416 177.2999 187 G 3.8720 7.9888 107.0542 44.8510 0.0000 172.1877 188A G 4.1324 9.5238 105.5882 44.7425 0.0000 173.8208 188 K 5.4788 7.2645 116.9418 53.5451 35.6911 175.4004 189 D 4.5653 8.3157 122.7736 54.1959 44.7402 174.7968 190 S 4.9329 8.7611 116.3241 57.8624 65.3356 172.9559 191 C 4.7453 9.4652 119.0534 55.3276 44.5465 172.3370 192 Q 4.3079 8.6851 119.3762 57.6488 28.4015 177.6328 193 G 4.4569 9.2216 110.9210 46.0974 0.0000 174.1054 194 D 4.7368 8.6142 118.6044 54.9969 41.6177 176.8407 195 S 4.6703 7.9203 116.4443 60.0584 63.3058 175.2827 196 G 3.5334 8.6507 112.2080 46.3783 0.0000 173.7451 197 G 3.9885 7.9264 107.4121 45.4174 0.0000 171.2392 198 P 5.0480 0.0000 0.0000 62.3428 33.7296 175.8420 199 V 4.6048 8.2421 119.9205 61.5247 34.2932 173.4622 200 V 4.7780 8.6902 128.6779 61.2577 33.7125 173.6588 201 C 5.1136 8.9287 125.3461 55.4197 43.3353 174.6470 202 S 3.3180 9.5707 121.0152 59.7852 59.9306 173.0943 203 G 3.9288 8.2817 103.2719 45.8556 0.0000 173.4162 204 K 4.7302 7.4798 117.6727 52.9960 35.3850 175.5487 *209 L 4.3388 8.2320 122.9018 55.4720 41.8395 175.7725 210 Q 4.4340 8.3638 124.7437 56.6788 30.4560 175.3803 211 G 5.3133 8.2451 104.4126 45.7642 0.0000 172.1782 212 I 5.0405 8.2112 119.3081 58.9520 41.5054 174.9863 213 V 3.7303 8.8759 127.2088 64.3076 31.8024 174.4271 214 S 4.8560 8.4892 121.5074 58.5471 64.0400 174.7068 215 W 4.9144 7.2070 114.5032 56.2851 31.7926 172.5742 216 G 3.9352 8.3969 107.7592 46.6958 0.0000 172.5934 217 S 4.6740 8.3784 115.2146 56.6883 62.6988 172.8291 *219 G 4.2432 8.0478 118.0823 45.7383 0.0000 171.0688 220 C 4.9247 8.1688 115.5593 56.5372 42.3343 173.8366 221A A 3.9780 8.9197 126.2010 53.1621 16.7987 176.4446 221 Q 4.7077 7.3468 118.2910 55.6336 30.0783 176.1322 222 K 4.2147 8.5133 121.0342 58.5820 32.9086 176.1462 223 N 4.2414 9.5085 118.0356 54.1502 36.9843 175.5054 224 K 4.3113 7.7043 116.5683 53.9467 32.4980 173.7072 225 P 4.6182 0.0000 0.0000 61.9990 33.3219 177.4241 226 G 3.5573 8.4409 106.5983 46.0267 0.0000 172.7513 227 V 4.2425 7.7350 122.8518 60.7082 33.5971 174.1687 228 Y 4.9358 8.1527 124.7509 55.9260 42.0104 175.0683 229 T 4.3689 8.5663 119.8845 63.6309 69.9341 174.4546 230 K 5.1525 9.6207 128.5105 55.4461 30.9901 177.0617 231 V 3.9606 8.8900 125.7495 65.9223 31.4375 174.7726 232 C 4.5865 8.3541 112.4583 58.3973 41.3730 174.9422 233 N 4.1922 8.0059 117.2166 54.5665 38.4977 175.5961 234 Y 4.8409 8.1644 117.5341 57.3607 38.7283 177.1881 235 V 3.6778 7.9383 121.2681 66.3880 31.4385 177.9786 236 S 4.1170 8.0997 114.0485 61.3835 62.7065 176.2769 237 W 4.4689 8.2371 131.7918 59.9827 30.4274 177.7306 238 I 2.9857 8.4260 119.9790 64.2067 36.6081 178.4612 239 K 3.7110 8.1442 119.3985 59.5161 31.5357 179.2755 240 Q 3.8274 8.1805 119.9295 59.4176 28.7680 178.3432 241 T 3.6424 7.3959 115.9272 66.5312 68.5024 176.4897 242 I 2.5512 7.1989 121.5999 63.8106 36.7361 178.3912 243 A 4.0388 7.5868 120.4085 54.1668 18.1865 178.7976 244 S 4.6785 7.2449 111.1806 58.3377 63.3128 174.0640 245 N 4.6795 7.9293 125.6243 53.6467 39.5725 174.1508 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 16 I 7.88 4.25 1.78 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 1.38 0.61 0.89 0.00 0.00 17 V 8.71 4.36 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 1.00 0.00 0.00 0.99 0.00 0.00 18 G 8.54 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 19 G 7.73 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 0.00 0.00 0.00 0.00 20 Y 8.07 4.97 0.00 2.91 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 21 T 8.61 4.26 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 22 C 8.72 4.31 0.00 2.74 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 23 G 9.08 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 24 A 8.38 4.11 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 25 N 8.66 4.18 0.00 2.84 2.89 0.00 0.00 7.15 7.54 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 26 T 7.74 4.29 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 1.26 0.00 0.00 27 V 6.97 4.04 1.72 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 0.18 0.00 0.00 0.74 0.00 0.00 28 P 0.00 4.83 0.00 2.40 2.43 0.00 3.80 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.96 0.00 29 Y 6.92 5.24 0.00 3.26 3.38 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 30 Q 7.24 4.58 0.00 1.81 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.73 0.00 0.00 0.00 0.00 0.00 1.92 2.48 0.00 31 V 8.99 4.90 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.99 0.00 0.00 32 S 8.71 5.07 0.00 3.19 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.61 4.47 0.00 0.98 0.13 0.83 0.18 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 34 N 9.15 5.79 0.00 2.45 2.50 0.00 0.00 6.78 8.14 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 *37 S 8.48 4.18 0.00 3.68 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 38 G 9.56 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 0.00 0.00 0.00 39 Y 6.46 4.52 0.00 3.08 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 40 H 8.89 4.63 0.00 2.88 3.18 0.00 5.87 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.85 5.09 0.00 3.07 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 42 C 6.86 4.77 0.00 2.14 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 43 G 9.25 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.28 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 9.10 5.43 0.00 3.79 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.16 4.78 0.00 1.87 1.67 1.06 1.06 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 47 I 8.43 4.38 1.90 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 1.63 0.90 0.96 0.00 0.00 48 N 7.84 4.41 0.00 2.98 2.99 0.00 0.00 5.97 7.21 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 49 S 8.43 4.19 0.00 4.04 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 0.00 50 Q 9.27 4.64 0.00 1.70 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 51 W 8.59 5.47 0.00 3.35 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 52 V 9.01 5.15 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 1.23 0.00 0.00 0.99 0.00 0.00 53 V 9.18 4.91 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 0.95 0.00 0.00 1.03 0.00 0.00 54 S 8.86 4.68 0.00 3.91 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 55 A 8.52 4.55 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 56 A 8.30 3.83 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.44 4.55 0.00 3.39 3.61 0.00 5.55 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 58 C 7.76 4.67 0.00 3.25 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 7.70 4.32 0.00 2.94 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 6.55 3.21 0.00 1.41 1.26 0.00 0.65 0.00 0.00 1.18 0.00 0.00 2.39 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.53 0.87 7.81 61 S 8.15 4.28 0.00 3.81 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 62 G 8.30 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 0.00 0.00 0.00 63 I 7.52 4.24 1.89 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 1.42 0.84 0.96 0.00 0.00 64 Q 8.91 4.84 0.00 2.01 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.94 0.00 0.00 0.00 0.00 0.00 2.15 2.23 0.00 65 V 8.94 4.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.92 0.00 0.00 66 R 8.80 5.21 0.00 1.76 1.78 0.00 2.77 0.00 0.00 2.78 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.26 0.00 67 L 9.22 4.74 0.00 1.63 1.64 1.04 0.73 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 *69 G 8.19 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 70 E 8.32 4.57 0.00 2.12 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 0.00 2.54 2.15 0.00 71 D 8.02 4.83 0.00 2.78 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 72 N 8.16 5.57 0.00 2.88 3.02 0.00 0.00 6.74 7.70 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 73 I 8.27 4.03 1.40 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.49 -0.55 0.00 0.00 74 N 8.74 4.86 0.00 2.81 2.85 0.00 0.00 6.60 7.26 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 75 V 7.47 4.31 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.48 4.11 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 0.82 0.00 0.00 1.02 0.00 0.00 77 E 8.92 4.33 0.00 2.03 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 2.30 2.26 0.00 78 G 8.94 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 79 N 8.20 5.01 0.00 2.67 2.80 0.00 0.00 6.91 7.66 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 80 E 8.02 4.55 0.00 1.95 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 1.93 2.09 0.00 81 Q 9.07 4.30 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 82 F 8.65 5.59 0.00 2.86 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 83 I 8.85 4.65 1.88 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 1.23 0.69 0.93 0.00 0.00 84 S 8.71 4.58 0.00 3.76 3.75 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 85 A 8.41 4.66 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 86 S 9.10 4.57 0.00 3.76 3.90 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 87 K 7.55 4.74 0.00 1.85 1.88 0.00 1.51 0.00 0.00 2.06 0.00 0.00 3.12 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.24 1.50 7.81 88 S 8.70 5.31 0.00 3.94 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 89 I 9.14 4.58 2.03 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.96 1.13 0.00 0.00 90 V 8.42 4.24 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 0.63 0.00 0.00 0.72 0.00 0.00 91 H 8.53 3.58 0.00 2.84 3.03 0.00 5.65 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.27 0.00 2.16 2.18 0.00 2.53 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.89 0.00 93 S 7.85 4.68 0.00 3.93 3.90 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 94 Y 8.04 4.30 0.00 3.05 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 95 N 8.25 4.66 0.00 2.56 2.43 0.00 0.00 6.61 6.93 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 96 S 7.75 4.13 0.00 3.99 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 97 N 8.23 4.33 0.00 2.83 2.79 0.00 0.00 6.93 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 98 T 7.74 3.96 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 99 L 8.14 3.76 0.00 1.42 1.86 0.80 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.66 4.45 0.00 2.72 2.64 0.00 0.00 7.24 6.94 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 0.00 101 N 8.73 5.04 0.00 2.95 2.65 0.00 0.00 7.24 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.01 4.75 0.00 3.12 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 0.00 103 I 7.15 4.92 1.51 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 1.56 1.31 0.02 0.00 0.00 104 M 9.29 5.46 0.00 2.04 2.26 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.70 0.00 105 L 9.35 5.39 0.00 1.64 1.83 -0.12 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.02 5.04 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 1.22 1.16 0.91 0.00 0.00 107 K 8.78 3.84 0.00 0.79 1.09 0.00 1.24 0.00 0.00 1.32 0.00 0.00 2.62 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.59 0.21 7.81 108 L 8.22 4.31 0.00 1.44 1.66 0.86 0.88 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 0.00 109 K 9.09 4.12 0.00 1.61 1.85 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.39 7.81 110 S 7.72 4.56 0.00 3.88 3.73 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 0.00 111 A 8.53 4.28 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 0.00 112 A 9.16 4.20 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 0.00 113 S 9.48 4.45 0.00 3.89 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 0.00 114 L 8.39 4.64 0.00 1.70 1.62 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.66 4.82 0.00 2.72 2.22 0.00 0.00 7.00 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.94 4.45 0.00 3.89 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 0.00 117 R 8.15 4.05 0.00 1.95 1.98 0.00 3.28 0.00 0.00 3.10 7.36 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.55 4.24 0.00 4.00 4.01 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 0.00 128 C 8.41 4.39 0.00 2.93 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 0.00 129 A 8.02 4.50 1.05 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 0.00 0.00 130 S 8.00 4.50 0.00 3.96 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 *132 A 8.19 4.25 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.07 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 0.00 134 T 7.57 3.96 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 0.00 135 Q 8.60 4.69 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 136 C 9.14 5.23 0.00 2.75 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 0.00 137 L 9.02 5.14 0.00 1.75 1.56 0.95 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.04 5.18 1.86 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 0.71 1.49 0.93 0.00 0.00 139 S 8.77 4.89 0.00 3.49 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 0.00 140 G 7.23 3.75 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 0.00 0.00 0.00 141 W 8.60 4.55 0.00 3.20 2.98 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 0.00 142 G 8.38 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 0.00 143 N 8.46 3.56 0.00 2.22 2.58 0.00 0.00 7.09 7.39 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 0.00 144 T 7.94 5.12 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 1.23 0.00 0.00 145 K 7.87 4.62 0.00 1.75 1.70 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.27 1.29 7.81 146 S 8.58 4.58 0.00 4.31 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 0.00 147 S 8.12 4.77 0.00 3.94 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 7.21 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 0.00 0.00 0.00 149 T 8.20 4.68 4.32 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 1.28 0.00 0.00 150 S 9.19 4.40 0.00 3.89 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.73 4.73 0.00 2.95 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 0.00 152 P 0.00 4.65 0.00 2.46 2.08 0.00 4.12 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 153 D 8.68 4.71 0.00 2.80 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 0.00 154 V 7.49 5.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.01 0.00 0.00 155 L 8.31 3.17 0.00 1.68 1.20 0.51 -0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.20 4.90 0.00 1.67 1.50 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.46 7.81 157 C 8.67 5.19 0.00 1.47 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 0.00 0.00 0.00 158 L 8.19 4.81 0.00 1.73 1.44 1.06 0.91 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 0.00 159 K 9.01 5.09 0.00 1.83 1.84 0.00 1.84 0.00 0.00 1.93 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.48 7.81 160 A 8.99 4.80 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.00 0.00 2.03 2.11 0.00 3.13 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.79 0.00 162 I 8.37 4.42 1.91 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.62 0.82 0.00 0.00 163 L 8.76 4.84 0.00 1.53 1.60 0.93 0.80 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 0.00 164 S 8.54 4.28 0.00 4.01 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 0.00 165 D 8.74 4.44 0.00 2.74 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.05 4.11 0.00 3.90 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 0.00 167 S 8.13 4.16 0.00 4.11 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 0.00 168 C 8.16 4.27 0.00 3.22 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 0.00 169 K 8.61 4.00 0.00 1.97 1.90 0.00 1.89 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.57 7.81 170 S 8.11 4.14 0.00 4.05 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 A 7.80 4.00 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 0.00 172 Y 7.79 4.84 0.00 3.15 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.54 0.00 2.21 2.12 0.00 3.63 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 174 G 9.04 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 0.00 175 Q 8.13 4.56 0.00 2.51 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.32 6.66 0.00 0.00 0.00 0.00 0.00 2.25 2.56 0.00 176 I 7.92 4.39 1.99 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.93 1.00 0.00 0.00 177 T 8.19 4.69 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 1.29 0.00 0.00 178 S 8.58 4.35 0.00 4.01 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 0.00 179 N 8.19 4.90 0.00 3.07 3.09 0.00 0.00 6.64 7.15 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 0.00 180 M 8.12 5.61 0.00 1.88 1.99 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.61 0.00 181 F 8.77 5.10 0.00 3.01 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 0.00 182 C 9.29 5.75 0.00 2.98 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 0.00 183 A 8.86 5.03 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 184A G 7.09 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 Y 8.44 4.64 0.00 3.08 3.34 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 0.00 185 L 8.65 4.06 0.00 1.74 1.73 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.27 3.86 0.00 1.97 2.02 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 2.35 2.42 0.00 187 G 7.99 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 0.00 0.00 0.00 188A G 9.52 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.26 5.48 0.00 1.68 1.80 0.00 1.32 0.00 0.00 1.63 0.00 0.00 2.63 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.49 1.14 7.81 189 D 8.32 4.57 0.00 2.83 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 0.00 190 S 8.76 4.93 0.00 3.99 4.01 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 0.00 191 C 9.47 4.75 0.00 2.89 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.69 4.31 0.00 2.35 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.66 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 193 G 9.22 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.61 4.74 0.00 2.95 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 0.00 195 S 7.92 4.67 0.00 4.02 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 0.00 196 G 8.65 3.53 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 0.00 0.00 0.00 197 G 7.93 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 0.00 198 P 0.00 5.05 0.00 2.34 2.36 0.00 3.92 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 199 V 8.24 4.60 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.63 0.00 0.00 200 V 8.69 4.78 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 0.86 0.00 0.00 0.60 0.00 0.00 201 C 8.93 5.11 0.00 2.78 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.57 3.32 0.00 3.95 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 0.00 203 G 8.28 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 0.00 204 K 7.48 4.73 0.00 1.90 1.63 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.25 7.81 *209 L 8.23 4.34 0.00 1.51 1.65 0.97 0.77 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 0.00 210 Q 8.36 4.43 0.00 1.96 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.49 0.00 0.00 0.00 0.00 0.00 2.49 2.20 0.00 211 G 8.25 5.31 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 0.00 212 I 8.21 5.04 1.95 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 1.32 1.08 1.00 0.00 0.00 213 V 8.88 3.73 2.40 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 0.96 0.00 0.00 1.16 0.00 0.00 214 S 8.49 4.86 0.00 3.92 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 0.00 215 W 7.21 4.91 0.00 3.39 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 0.00 216 G 8.40 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 0.00 0.00 0.00 217 S 8.38 4.67 0.00 4.30 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 *219 G 8.05 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 0.00 0.00 0.00 0.00 220 C 8.17 4.92 0.00 2.94 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A A 8.92 3.98 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 0.00 221 Q 7.35 4.71 0.00 2.32 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.90 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 222 K 8.51 4.21 0.00 1.97 1.84 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.47 7.81 223 N 9.51 4.24 0.00 2.79 2.86 0.00 0.00 6.75 5.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 K 7.70 4.31 0.00 1.87 1.75 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.45 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.47 7.81 225 P 0.00 4.62 0.00 2.12 2.10 0.00 3.64 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.00 0.00 226 G 8.44 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 0.00 227 V 7.73 4.24 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 -1.03 0.00 0.00 228 Y 8.15 4.94 0.00 1.43 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 0.00 229 T 8.57 4.37 4.32 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 1.26 0.00 0.00 230 K 9.62 5.15 0.00 2.07 1.89 0.00 1.78 0.00 0.00 1.87 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.64 7.81 231 V 8.89 3.96 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 1.01 0.00 0.00 1.10 0.00 0.00 232 C 8.35 4.59 0.00 3.15 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.01 4.19 0.00 2.24 2.34 0.00 0.00 6.82 7.48 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 0.00 234 Y 8.16 4.84 0.00 3.12 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 7.94 3.68 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 1.17 0.00 0.00 1.06 0.00 0.00 236 S 8.10 4.12 0.00 3.98 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 0.00 237 W 8.24 4.47 0.00 3.49 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 0.00 238 I 8.43 2.99 2.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.91 0.72 0.00 0.00 239 K 8.14 3.71 0.00 1.77 1.78 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.52 7.81 240 Q 8.18 3.83 0.00 2.05 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 241 T 7.40 3.64 3.28 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 0.78 0.00 0.00 242 I 7.20 2.55 1.37 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.35 0.41 0.00 0.00 243 A 7.59 4.04 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 S 7.24 4.68 0.00 3.77 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 0.00 245 N 7.93 4.68 0.00 2.93 2.98 0.00 0.00 6.73 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 * Residues marked with a * may have inaccurate shift predictions.