NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.7493 8.2833 118.2182 52.2550 39.0221 174.9190 4 E 3.8084 8.5716 117.2201 59.4409 29.2195 178.3008 5 T 3.9281 8.7359 116.7249 66.5903 69.1319 176.4352 6 L 4.1208 9.1631 123.7732 58.2013 41.5911 180.3766 7 K 4.0620 8.1124 123.9534 59.5101 31.6526 182.3105 8 V 3.7982 7.9118 119.2554 66.0538 31.2592 178.1666 9 I 3.6886 7.5802 118.0296 64.4967 37.0292 178.0397 10 A 4.1503 7.8760 120.4669 54.2857 18.3318 178.6304 11 E 4.3046 8.1073 114.3108 56.2815 30.7739 176.8812 12 R 3.9849 7.5301 120.8103 56.9111 30.5350 174.7168 13 Y 4.8079 7.7195 120.9703 55.6083 41.2665 174.4885 14 S 4.5176 8.5178 116.2775 57.0402 62.8330 173.9066 15 C 4.4251 8.0972 126.8988 59.1569 31.7382 173.6744 16 R 3.9376 7.6303 126.0144 55.3714 30.8474 175.4843 17 D 4.6572 7.2324 113.0089 54.1021 43.2537 173.9624 18 F 5.2787 9.4071 124.0405 55.4859 41.1658 176.0356 19 K 4.5778 9.1356 122.0049 56.0877 32.6753 177.1327 20 N 4.7021 8.8382 118.2675 53.9737 38.6692 177.0054 21 E 4.2822 7.8048 121.3918 55.6071 30.1246 174.0714 *23 P 4.2217 0.0000 0.0000 61.9062 32.8976 176.9174 24 S 4.2707 8.4069 115.9979 58.9151 64.6292 175.2359 25 D 4.3905 8.7304 123.1058 57.8733 40.3091 179.0828 26 E 4.0131 8.1483 118.4134 59.3514 29.4923 179.3429 27 L 4.0106 7.8298 118.4760 57.7387 41.6806 179.3289 28 L 3.9589 7.9276 118.9392 58.0289 41.5982 179.5115 29 Q 3.9136 8.5870 119.5377 58.8782 28.9309 178.1576 30 A 3.9858 7.6516 121.8345 55.0454 18.4279 179.6423 31 I 3.5744 7.7908 118.1096 64.5149 37.2643 178.4690 32 A 3.9234 8.1516 121.7525 55.1915 17.9404 179.3297 33 E 3.8766 8.1053 116.6225 59.1657 30.0162 178.5596 34 A 4.6801 8.2933 122.0103 54.5439 18.4769 179.1756 35 A 3.7582 7.9636 119.5732 55.3547 18.2729 179.6064 36 I 3.9551 7.2682 107.7602 62.6882 38.1873 177.0545 37 Q 4.3471 7.9346 119.6049 55.1866 28.9768 175.2429 38 A 4.3033 7.3366 124.5280 51.3229 18.9819 176.0774 39 P 4.7567 0.0000 0.0000 62.5353 32.6191 175.6377 40 S 4.8616 8.2665 112.1802 56.7569 66.0849 174.4612 41 G 3.8301 8.8456 113.4461 45.7239 0.0000 173.6754 *43 N 4.7792 7.8818 110.5763 52.9002 40.5065 175.3654 44 R 3.7965 8.4732 116.2742 57.0259 30.2093 176.4752 45 Q 2.0000 7.3256 116.3683 56.2434 27.0570 174.7784 46 A 4.4574 6.7405 120.3535 49.9045 17.4165 176.9948 47 W 5.7539 6.8039 117.2786 56.3339 31.8054 175.3705 48 R 5.0017 8.6945 117.6435 54.6733 34.6675 174.7306 49 V 4.3569 8.5145 120.2569 61.5145 33.3381 174.8928 50 I 4.3624 8.3301 130.3209 59.4623 39.2604 175.5508 51 V 4.0744 8.4116 128.5747 62.0764 32.0398 175.5653 52 V 4.2226 8.3443 129.4402 61.6880 32.3335 175.9745 53 K 4.3663 8.6580 126.6409 56.0252 33.2280 176.0908 54 N 4.5092 7.9774 118.3422 52.5843 38.7458 174.1907 55 K 4.0676 8.8032 127.8948 59.5532 32.8227 177.5242 56 E 4.0619 8.3250 119.1856 59.2270 29.6735 178.7540 57 L 3.9409 8.6139 116.6267 55.9499 41.6471 177.3780 *59 Q 4.4117 8.1373 118.2681 55.7072 30.5744 176.7988 60 E 4.3317 8.0723 115.9373 56.9433 29.4551 178.4189 *62 E 3.4470 8.4027 120.8226 56.0466 31.4511 177.4170 63 A 3.9062 7.9540 120.2983 55.2817 18.3681 179.1599 64 E 3.9719 8.4972 118.1342 59.3009 29.5713 179.1301 65 G 3.5596 7.9121 105.1840 47.8427 0.0000 175.4170 66 L 3.9818 7.9552 121.5716 57.3864 41.6669 179.3122 67 A 3.9564 8.1708 120.8238 55.3332 18.0058 178.9442 68 Y 3.9563 7.7770 116.8463 60.9682 38.9787 178.1653 69 L 4.0104 7.5329 118.2272 57.7720 41.8176 179.0326 70 A 3.5593 8.1801 120.1459 53.9736 19.4636 179.1003 71 G 3.6184 7.4427 107.6949 44.2251 0.0000 173.4178 *73 E 4.2347 7.9303 119.2189 55.9174 32.4246 176.5224 74 D 4.6009 7.7926 118.9998 53.1901 40.1817 176.0251 75 Q 4.2329 8.4465 126.2203 57.1912 29.1806 176.7025 76 S 4.0764 8.1716 114.9358 63.5290 63.0432 176.4288 77 S 4.1899 8.0279 114.8311 61.4849 62.0834 175.9172 78 Y 4.0100 7.9112 121.1866 60.8539 38.7452 177.3024 79 N 4.3781 8.3654 118.4772 56.8134 38.7597 178.0559 80 R 4.1450 7.8454 122.0058 61.3755 29.5288 183.5285 81 I 4.1549 7.5267 121.9867 62.1105 37.4331 178.6454 *83 E 4.2946 8.2475 118.0063 56.1171 31.7757 180.2868 84 R 4.1607 8.2311 114.9379 56.7967 29.9777 177.0511 85 G 3.9653 8.4219 106.0601 44.6547 0.0000 175.5990 86 G 3.7963 8.5241 107.5505 45.8015 0.0000 173.5119 87 R 4.3841 7.1507 119.7206 53.7298 31.5101 177.0908 88 L 3.6239 8.2622 125.5388 57.2007 42.4164 177.3459 89 F 4.9796 8.1738 115.2707 56.4587 39.2849 175.2243 90 Y 3.9890 7.9044 117.1662 59.1661 35.9450 172.3912 91 G 4.1763 8.7015 103.8390 45.7864 0.0000 174.3788 92 A 3.7075 8.1521 123.2598 51.5144 18.5145 176.8159 93 P 4.5070 0.0000 0.0000 63.9406 32.4355 174.7728 94 C 4.9482 6.9924 113.3987 58.4052 33.4976 172.3564 *96 I 4.3249 8.1428 118.3054 61.5128 38.3912 175.0657 97 V 4.3149 8.6336 128.0213 61.5703 33.6374 174.8974 98 V 4.5455 8.7276 128.8877 59.6822 32.4895 172.8464 99 P 4.5295 0.0000 0.0000 62.1152 33.0103 175.1052 100 I 5.0398 8.6045 114.0557 57.8631 42.0576 173.9841 101 D 4.0713 7.6372 122.4599 52.0624 41.2341 175.0568 102 P 4.1427 0.0000 0.0000 64.8138 31.6344 178.0405 103 T 3.4655 7.4606 108.0225 62.7789 69.1052 174.9646 104 Q 4.4528 7.2636 121.3113 57.4336 31.0388 178.4420 105 Y 3.5181 7.0541 116.4276 57.5964 39.7369 175.6203 106 G 3.6573 9.4230 120.9105 48.4246 0.0000 172.9128 107 P 4.2880 0.0000 0.0000 65.0546 31.2690 178.6005 108 A 3.9926 8.0646 119.7868 54.9899 18.2082 179.7321 109 L 3.8923 7.8240 117.2406 57.8077 41.6891 179.8187 110 V 3.5714 7.9386 118.2357 66.2190 31.4936 177.8830 111 D 4.4602 8.3666 118.7025 57.2899 40.5132 178.2921 112 C 4.0714 8.4264 119.8336 62.4670 31.5954 175.9020 113 G 3.5543 7.9907 107.2194 47.7890 0.0000 175.5817 114 I 3.6719 7.6612 122.2050 64.0414 37.1502 178.3583 115 L 3.6681 7.6919 120.9647 58.3368 41.8506 178.7387 116 C 4.0057 8.1105 116.9428 62.8187 27.9773 175.9375 117 Q 3.9287 8.1220 121.1113 59.1106 28.5182 178.2725 118 T 3.8325 7.5280 116.8843 66.3886 68.4373 176.6682 119 I 3.5753 7.7551 121.4801 64.3766 37.1854 178.3494 120 A 4.0955 8.0522 121.6041 55.1283 18.1471 179.7653 121 L 3.9069 8.1016 117.2912 57.6989 41.5240 179.4110 122 A 3.9359 7.9286 119.4890 55.0617 18.6013 179.1923 123 A 4.0520 8.3612 119.4811 55.8115 18.5266 179.8326 124 T 3.8152 7.9498 114.3698 66.9318 68.3302 176.8442 125 S 4.2926 8.1726 114.5821 60.3355 63.1286 175.3742 126 L 4.5470 7.8188 120.9723 54.0846 41.8831 177.1986 127 G 3.9400 7.9812 107.6348 45.1591 0.0000 173.3831 128 I 4.2432 7.3629 120.3842 59.7962 37.8910 175.7984 129 A 4.2924 8.9672 129.9558 52.2875 19.8851 175.5840 130 N 5.7312 8.0989 115.1095 52.9078 40.7548 173.3326 131 I 3.8978 8.0239 122.6655 60.8749 45.4850 175.9092 *133 C 4.6753 8.9285 121.4923 58.8851 31.2211 173.9514 134 G 3.9413 8.3566 114.4769 47.2556 0.0000 172.5662 135 Y 4.7669 7.9939 117.8237 60.3605 38.0481 177.7967 136 T 4.2965 7.9176 116.9347 66.6726 68.5639 176.4201 137 G 2.9722 7.4090 107.1102 47.0086 0.0000 175.5714 138 L 3.8411 7.9361 121.0529 57.5485 41.3038 179.1435 139 A 3.9650 7.7072 119.5591 54.3056 18.4852 178.5664 140 F 4.5929 8.2460 114.4785 57.9701 39.5717 177.8148 141 A 3.9046 7.3924 120.4277 54.8161 17.8130 178.7056 142 S 4.2501 7.9092 110.9694 59.0720 63.6402 176.3623 143 G 4.0757 8.2996 109.2940 45.8943 0.0000 175.6013 144 L 4.1406 7.4660 118.2459 57.0005 41.9609 178.0260 145 R 4.3337 7.7028 115.2498 55.1525 31.5987 177.0638 146 A 3.9630 7.8672 122.0617 55.0918 18.2269 180.1481 147 E 3.8493 8.0683 117.3655 59.3968 29.8152 178.3076 148 E 3.7432 7.9150 118.6695 59.5144 29.5562 178.7647 149 F 4.3775 7.7167 117.5891 60.4690 38.8026 177.8097 150 S 3.0699 8.3298 115.2572 61.3868 62.4835 177.0618 151 K 4.0109 8.2307 121.1807 59.5466 31.5826 179.7741 152 R 3.9869 7.9064 117.3758 58.9793 30.0576 178.5804 153 L 4.3738 8.2364 118.0035 55.0741 41.9911 177.1526 154 G 3.8959 7.8003 106.4873 46.1131 0.0000 173.9502 155 F 4.4867 8.4430 118.0290 56.5428 39.9212 174.2278 156 P 4.3591 0.0000 0.0000 61.8369 31.8341 175.6873 157 E 4.2058 8.4197 121.7443 57.7796 30.0166 177.1803 158 G 4.1630 9.0347 113.8836 45.8285 0.0000 173.5489 159 Y 4.2736 7.7737 115.9347 57.9761 38.6175 174.4879 160 A 5.0695 8.6757 123.3976 49.5966 23.3570 175.2076 161 F 3.7498 8.8804 121.7656 58.9371 39.3070 173.8419 162 G 3.6106 7.4861 112.5687 46.7316 0.0000 173.8438 163 C 4.5800 6.4433 117.5613 57.8200 35.6814 171.8253 164 S 5.0419 8.3828 113.7153 56.9923 65.8095 173.6047 165 V 4.5545 8.3854 120.6495 61.0983 33.7820 175.1396 166 L 4.2149 9.1396 128.5946 54.4837 42.7411 176.0513 167 L 5.2198 9.2440 121.5483 52.3674 46.3488 176.6187 168 G 4.2104 7.5506 107.1066 47.1618 0.0000 170.5774 169 H 5.3372 8.2225 115.8480 54.2188 31.2079 174.6920 170 A 4.3049 8.5157 123.6377 51.8731 18.5033 177.1109 171 N 4.6204 9.2263 123.4472 56.3531 39.4732 175.2950 172 T 4.7884 7.6703 105.6388 60.2232 72.1081 173.3461 173 T 4.5358 8.3624 118.9030 61.8049 71.1448 174.0677 174 K 4.4813 7.0739 121.4743 54.3951 35.5276 174.3653 175 P 4.2458 0.0000 0.0000 61.7186 31.9320 174.2145 176 P 4.6179 0.0000 0.0000 62.1380 32.1719 175.5749 177 H 4.2466 8.5050 114.1827 55.4186 28.7839 175.2776 178 V 3.7157 8.2039 122.1342 61.8865 31.8199 174.0566 179 P 4.2715 0.0000 0.0000 62.6067 31.9895 175.9160 180 D 4.6605 8.4868 122.8326 52.5557 40.4516 176.7810 181 K 4.1215 8.3833 126.8883 58.7262 32.4238 179.1757 182 D 4.4140 8.0705 117.9241 56.7729 41.1449 177.0380 183 K 4.2120 7.8657 116.3515 57.2880 32.2711 176.5715 184 I 4.3073 7.4652 121.2043 59.8631 38.2666 175.0976 185 T 4.8596 8.0195 113.7313 60.1546 72.0029 172.3936 186 Y 4.5345 8.4560 118.4541 56.1056 41.0685 176.1015 187 V 4.2706 8.1621 122.2724 60.9295 32.4054 175.3196 188 E 4.2177 8.6867 125.2669 56.5320 29.3574 177.2227 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 3 N 8.28 4.75 0.00 2.97 3.05 0.00 0.00 6.13 6.77 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 4 E 8.57 3.81 0.00 2.11 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 2.40 2.46 0.00 5 T 8.74 3.93 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 6 L 9.16 4.12 0.00 1.64 1.72 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.11 4.06 0.00 1.78 1.81 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.31 7.81 8 V 7.91 3.80 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 0.99 0.00 0.00 0.98 0.00 0.00 9 I 7.58 3.69 2.02 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 1.45 0.77 0.91 0.00 0.00 10 A 7.88 4.15 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 11 E 8.11 4.30 0.00 2.17 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 0.00 2.55 2.36 0.00 12 R 7.53 3.98 0.00 1.91 1.90 0.00 3.18 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 13 Y 7.72 4.81 0.00 3.07 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.52 4.52 0.00 3.89 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 15 C 8.10 4.43 0.00 2.48 2.31 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 16 R 7.63 3.94 0.00 1.45 1.03 0.00 3.09 0.00 0.00 2.68 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 1.26 0.00 17 D 7.23 4.66 0.00 2.72 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 18 F 9.41 5.28 0.00 3.20 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 19 K 9.14 4.58 0.00 1.74 1.91 0.00 1.84 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.53 1.56 7.81 20 N 8.84 4.70 0.00 2.85 2.99 0.00 0.00 6.09 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 21 E 7.80 4.28 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 *23 P 0.00 4.22 0.00 2.07 2.02 0.00 3.67 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 1.88 2.03 0.00 24 S 8.41 4.27 0.00 4.21 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 25 D 8.73 4.39 0.00 2.71 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.15 4.01 0.00 2.05 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 2.40 2.47 0.00 27 L 7.83 4.01 0.00 1.85 1.70 0.95 0.66 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 28 L 7.93 3.96 0.00 1.83 1.70 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 8.59 3.91 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 30 A 7.65 3.99 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 31 I 7.79 3.57 1.96 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.74 0.85 0.00 0.00 32 A 8.15 3.92 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 33 E 8.11 3.88 0.00 2.03 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 2.32 2.36 0.00 34 A 8.29 4.68 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 35 A 7.96 3.76 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 36 I 7.27 3.96 2.05 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 1.75 0.74 0.99 0.00 0.00 37 Q 7.93 4.35 0.00 2.32 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.03 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 38 A 7.34 4.30 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.76 0.00 2.23 2.10 0.00 3.79 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 40 S 8.27 4.86 0.00 4.20 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 41 G 8.85 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 0.00 0.00 0.00 *43 N 7.88 4.78 0.00 2.68 2.82 0.00 0.00 7.29 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 44 R 8.47 3.80 0.00 1.79 1.97 0.00 3.31 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.51 0.00 45 Q 7.33 2.00 0.00 1.53 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.57 0.00 0.00 0.00 0.00 0.00 1.91 2.19 0.00 46 A 6.74 4.46 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 W 6.80 5.75 0.00 3.18 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 48 R 8.69 5.00 0.00 1.67 1.81 0.00 3.20 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.38 0.00 49 V 8.51 4.36 2.06 0.00 0.00 0.00 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0.00 129 A 8.97 4.29 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 0.00 130 N 8.10 5.73 0.00 2.86 2.89 0.00 0.00 6.15 7.85 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 0.00 131 I 8.02 3.90 2.13 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 1.33 0.73 1.25 0.00 0.00 *133 C 8.93 4.68 0.00 3.15 2.96 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 0.00 134 G 8.36 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 0.00 135 Y 7.99 4.77 0.00 3.11 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 0.00 136 T 7.92 4.30 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 1.31 0.00 0.00 137 G 7.41 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 0.00 0.00 0.00 138 L 7.94 3.84 0.00 1.75 1.68 0.38 0.88 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 0.00 139 A 7.71 3.97 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 F 8.25 4.59 0.00 3.17 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 0.00 141 A 7.39 3.90 0.44 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 0.00 142 S 7.91 4.25 0.00 4.11 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 0.00 143 G 8.30 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 0.00 144 L 7.47 4.14 0.00 1.66 1.71 0.93 0.79 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 0.00 145 R 7.70 4.33 0.00 1.61 0.98 0.00 3.03 0.00 0.00 3.40 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.44 0.00 146 A 7.87 3.96 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.07 3.85 0.00 2.04 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 0.00 2.36 2.38 0.00 148 E 7.92 3.74 0.00 1.80 1.56 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 1.91 2.18 0.00 149 F 7.72 4.38 0.00 2.48 2.59 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 0.00 150 S 8.33 3.07 0.00 4.00 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 0.00 151 K 8.23 4.01 0.00 1.99 1.84 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.46 1.35 7.81 152 R 7.91 3.99 0.00 2.00 2.05 0.00 3.11 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 153 L 8.24 4.37 0.00 1.62 2.03 1.21 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 154 G 7.80 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 0.00 0.00 0.00 155 F 8.44 4.49 0.00 2.99 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 0.00 156 P 0.00 4.36 0.00 1.24 1.57 0.00 3.17 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.69 0.00 157 E 8.42 4.21 0.00 1.95 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 2.35 2.36 0.00 158 G 9.03 4.16 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 0.00 159 Y 7.77 4.27 0.00 3.15 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 0.00 160 A 8.68 5.07 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 0.00 161 F 8.88 3.75 0.00 2.27 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 G 7.49 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 C 6.44 4.58 0.00 2.79 2.56 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 0.00 164 S 8.38 5.04 0.00 4.02 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 0.00 165 V 8.39 4.55 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 0.79 0.00 0.00 0.85 0.00 0.00 166 L 9.14 4.21 0.00 1.54 1.13 1.18 -0.03 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 0.00 167 L 9.24 5.22 0.00 1.44 1.43 0.85 0.92 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 0.00 168 G 7.55 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 H 8.22 5.34 0.00 3.18 3.25 0.00 5.62 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 0.00 170 A 8.52 4.30 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 0.00 171 N 9.23 4.62 0.00 2.86 3.25 0.00 0.00 7.02 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 T 7.67 4.79 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 1.27 0.00 0.00 173 T 8.36 4.54 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 0.88 0.00 0.00 174 K 7.07 4.48 0.00 1.72 1.63 0.00 1.53 0.00 0.00 1.89 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.47 7.81 175 P 0.00 4.25 0.00 2.15 2.01 0.00 3.68 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 1.93 1.88 0.00 176 P 0.00 4.62 0.00 2.18 2.44 0.00 3.73 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 1.97 2.07 0.00 177 H 8.50 4.25 0.00 3.29 3.35 0.00 5.53 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 V 8.20 3.72 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 0.81 0.00 0.00 0.92 0.00 0.00 179 P 0.00 4.27 0.00 2.07 1.97 0.00 3.69 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 1.99 1.98 0.00 180 D 8.49 4.66 0.00 2.76 2.59 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 0.00 181 K 8.38 4.12 0.00 1.87 1.87 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.44 7.81 182 D 8.07 4.41 0.00 2.65 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 K 7.87 4.21 0.00 1.83 1.83 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.47 1.59 7.81 184 I 7.47 4.31 2.05 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 1.31 0.52 0.84 0.00 0.00 185 T 8.02 4.86 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 1.23 0.00 0.00 186 Y 8.46 4.53 0.00 2.89 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 0.00 187 V 8.16 4.27 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 0.94 0.00 0.00 188 E 8.69 4.22 0.00 2.02 1.86 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 2.36 2.24 0.00 * Residues marked with a * may have inaccurate shift predictions.