NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9492 8.3549 109.7361 45.5235 0.0000 172.5750 2 L 4.3644 8.0018 118.2985 51.1352 43.4293 175.6509 3 S 4.5278 9.6294 119.1306 57.8142 66.3127 175.0273 4 D 4.6600 8.6710 121.3870 57.5249 40.5312 179.2346 5 G 3.6770 8.1025 105.7823 47.8827 0.0000 175.4800 6 E 3.9626 8.1984 120.9465 58.9398 29.4332 179.4563 7 W 4.3525 8.2824 119.1096 59.7774 29.0875 178.3453 8 Q 4.0832 8.4509 119.6441 59.3451 28.4167 178.3849 9 Q 4.0586 8.1924 119.1452 58.7897 28.6921 178.7692 10 V 3.7062 8.1109 119.4326 66.2368 31.4640 178.0776 11 L 4.2678 8.1021 116.5240 56.9488 41.8810 178.6117 12 N 4.5366 8.1517 117.8263 56.5001 38.9280 177.0289 13 V 3.6211 8.2216 120.0387 65.8163 31.6885 177.7833 14 W 4.1156 8.7023 128.1444 60.1493 30.2042 178.0312 15 G 3.6834 7.7609 104.7405 47.5642 0.0000 175.5578 16 K 3.9842 7.9721 120.9089 59.2806 32.1387 179.5799 17 V 2.6967 6.8940 117.9586 65.6455 31.1167 177.6853 18 E 3.9093 7.5130 116.4931 58.5496 29.3077 178.7164 19 A 4.2013 7.3171 120.3070 53.9973 20.0759 177.6612 20 D 4.6648 7.6551 115.9280 52.1614 42.7401 175.1773 21 I 3.6241 7.8359 123.2461 63.6358 38.4404 176.6970 22 A 4.1473 7.3977 122.7126 54.3951 18.2892 179.7632 23 G 3.8290 8.4563 105.7688 47.8761 0.0000 175.7866 24 H 4.1519 8.3497 119.2724 58.2087 28.6392 178.1871 25 G 3.5666 8.2736 107.7820 47.7094 0.0000 175.4491 26 Q 3.8280 8.1271 122.3142 59.0496 29.1287 178.2879 27 E 3.8581 8.0240 119.5001 59.2431 29.3982 179.6798 28 V 3.5113 7.7629 118.2667 65.8902 31.6500 178.1355 29 L 3.3742 7.5992 118.6514 57.7016 41.3139 179.5608 30 I 3.6864 7.7046 119.9843 64.2538 36.9716 178.5229 31 R 3.7804 7.9633 119.5900 59.1183 29.9234 178.3186 32 L 3.9185 7.7593 120.0903 58.3135 41.9012 179.0483 33 F 4.5669 7.9524 116.9137 60.8299 38.9005 177.5448 34 T 4.1663 8.1580 109.0299 64.6342 68.8157 176.7213 35 G 3.6569 7.9200 107.2534 45.9391 0.0000 173.7881 36 H 4.7501 7.9382 117.7478 51.9062 29.4621 171.7696 37 P 4.3695 0.0000 0.0000 65.3897 31.0916 177.4538 38 E 4.1288 8.2112 115.9954 59.1969 29.5340 179.0991 39 T 3.7702 8.1634 111.7963 64.5710 68.9510 176.4387 40 L 3.5878 7.7952 122.7644 57.8360 41.8189 178.6809 41 E 4.1312 7.6799 116.9536 58.5469 29.4524 178.6316 42 K 4.4776 8.1015 117.3284 56.6196 32.6056 176.6073 43 F 4.6631 8.1009 119.2317 55.4893 39.3614 176.0760 44 D 4.4114 8.6812 127.1661 56.9135 40.7979 177.8947 45 K 4.2604 7.8241 115.3473 57.2324 33.0654 176.9007 46 F 5.0832 8.0363 117.0930 56.8509 40.8135 176.7057 47 K 4.0860 8.1656 119.7515 59.2682 32.5116 177.6881 48 H 4.3201 8.0247 114.0946 57.1839 28.9391 175.2293 49 L 4.1378 7.4009 120.7565 54.4888 40.7310 176.5718 50 K 4.3242 9.2006 124.8000 57.1322 33.1887 177.8062 51 T 4.7302 7.5735 108.2663 58.9731 73.1378 174.2788 52 E 3.9265 8.6910 121.9416 59.2752 29.6797 178.9441 53 A 3.9859 7.9521 120.5467 55.2905 18.2692 179.3234 54 E 3.9699 7.8552 115.9004 59.5933 29.7630 179.2587 55 M 4.1457 7.9390 118.8785 58.3572 31.8687 178.7538 56 K 3.9296 8.4768 118.3772 58.8952 32.4268 177.7092 57 A 4.5479 7.5806 118.4487 51.2592 19.1849 176.9020 58 S 4.3561 7.6101 114.0570 57.4725 62.5314 174.6933 59 E 4.0702 8.7677 128.5422 59.0472 29.2472 178.5315 60 D 4.4859 8.1582 118.0107 56.8853 41.3134 177.8060 61 L 3.9016 7.9790 120.8418 57.7763 42.0346 178.8138 62 K 3.8930 7.8666 119.8615 59.1358 32.2598 178.6017 63 K 3.9090 8.1472 119.9770 60.0625 32.1015 178.3112 64 H 4.4503 8.9245 118.8738 59.1140 29.7676 177.3655 65 G 3.6057 8.3581 107.9934 48.0892 0.0000 175.8383 66 T 3.9269 7.9448 118.0725 66.3568 68.5666 177.0224 67 V 3.7352 7.6692 119.8587 65.8050 31.5440 178.3134 68 V 3.6113 8.0356 118.2326 66.2374 31.4425 178.1859 69 L 4.3298 8.1538 118.4471 57.8027 41.4225 179.7102 70 T 4.0193 8.1078 116.0682 66.3711 68.3589 176.5476 71 A 3.9895 7.9386 122.2808 55.1637 18.4588 179.4346 72 L 3.6964 7.9998 119.0137 58.0508 42.1027 179.3207 73 G 3.0986 8.4724 106.1783 47.5512 0.0000 175.8448 74 G 3.6007 7.8300 107.0976 47.5210 0.0000 175.5650 75 I 3.8527 7.5030 122.1844 64.1335 37.1127 178.5621 76 L 3.9833 7.9519 120.2282 57.5463 41.1858 179.2498 77 K 4.0301 7.6162 116.2915 57.7925 32.2808 178.3896 78 K 4.0006 7.7966 118.6870 55.5003 33.0075 176.2150 79 K 2.0000 8.2227 118.5733 56.3111 29.7766 174.7596 80 G 4.0056 7.8524 105.6340 45.8186 0.0000 173.6598 81 H 4.5523 7.3783 118.8671 55.0124 27.3644 174.7545 82 H 5.7420 7.3042 111.3414 54.2557 29.7547 176.3418 83 E 3.9149 8.6803 122.0900 60.3455 29.0452 178.4393 84 A 3.9946 7.9216 118.5021 55.3118 18.8246 178.9736 85 E 4.1067 8.1283 116.5827 59.0021 29.6281 179.0331 86 L 4.0215 8.4952 120.8763 57.6264 42.2740 178.3299 87 K 3.8229 8.2513 120.2758 59.3428 32.0704 176.7371 88 P 4.2788 0.0000 0.0000 65.8837 31.0950 178.3556 89 L 4.0933 7.9433 118.0662 57.4599 41.7581 178.9607 90 A 4.1233 8.2157 120.8654 55.5104 18.3450 179.7794 91 Q 3.9506 8.3662 116.7590 58.7824 28.7504 178.9559 92 S 4.0344 8.2301 115.5915 61.6831 63.1720 176.2889 93 H 4.1728 8.6453 119.5912 57.9113 27.9341 177.6666 94 A 2.5800 7.6015 122.5380 54.8782 18.2070 179.7764 95 T 3.6511 7.3097 112.5946 65.5886 68.6797 176.1463 96 K 4.0507 7.4233 119.9786 58.6615 32.8101 177.0622 97 H 4.3855 7.7344 113.1828 55.6340 29.5203 175.1761 98 K 3.4853 7.3634 117.0243 56.1391 29.0350 176.2324 99 I 4.2579 7.9654 119.0398 58.9389 38.1463 175.0642 100 P 4.3940 0.0000 0.0000 62.2552 31.9702 177.5967 101 I 3.5322 8.4953 120.8375 64.0693 37.7131 178.0796 102 K 3.6730 7.9196 120.1176 59.6974 31.8965 178.1364 103 Y 4.0290 7.9204 116.8879 60.9075 37.8057 178.4195 104 L 4.1812 7.9230 120.0589 57.3477 41.6477 179.1418 105 E 3.9381 7.8417 119.1735 59.1745 29.6353 178.4394 106 F 4.4980 7.8673 117.8853 61.0028 39.0619 177.6625 107 I 3.8181 8.2118 117.8436 63.8434 37.8468 178.2002 108 S 4.2221 8.1804 116.3075 61.7776 62.6787 176.2801 109 D 4.4771 8.4437 121.3843 57.2926 40.4515 178.7174 110 A 4.0412 8.3256 121.5601 55.1758 18.3808 179.7642 111 I 3.6880 8.0143 118.3471 64.6146 37.3032 178.7494 112 I 3.8851 7.7974 120.3089 64.5595 36.9562 177.9740 113 H 4.1811 8.5347 119.2105 59.3947 29.6844 177.5160 114 V 3.5637 8.1914 120.3976 65.8805 31.3180 177.9304 115 L 3.8003 7.9146 118.7527 58.1302 41.1184 179.2897 116 H 4.3974 7.8574 114.5783 58.8116 28.6896 177.5526 117 S 4.1712 7.8745 114.3531 61.0766 62.3219 175.8217 118 K 4.1006 7.9990 119.7694 57.5179 33.2546 176.6733 119 H 4.9641 8.0621 115.9716 53.5186 29.3007 172.0330 120 P 4.4555 0.0000 0.0000 64.4082 31.7232 177.4906 121 G 3.9879 9.1660 110.6885 45.6696 0.0000 172.9291 122 D 4.9905 8.3597 117.9945 53.7381 41.6800 176.1983 123 F 5.0271 7.9485 119.4478 54.7840 39.2830 174.4603 124 G 3.8095 8.0162 112.2432 43.3712 0.0000 170.7195 125 A 3.8929 8.4184 121.6777 55.2420 18.2431 179.6405 126 D 4.2150 7.9954 116.7762 56.4950 39.4113 178.4700 127 A 3.9654 7.7652 121.7314 54.9508 18.4358 179.2502 128 Q 3.4788 7.8439 118.5811 58.8647 28.9726 178.6204 129 G 3.5031 8.0940 106.6980 47.6325 0.0000 175.6210 130 A 3.8447 8.0455 123.3879 55.1004 18.4918 179.4296 131 M 4.0598 8.3077 116.9209 58.9962 32.2795 178.5833 132 T 3.9217 8.2129 116.1661 66.6614 68.6705 176.7651 133 K 4.1633 8.2589 121.4778 58.8388 32.0134 179.3092 134 A 3.8577 7.9971 121.0717 55.0881 18.2106 179.7393 135 L 4.1284 8.1299 117.5491 57.8620 41.6085 179.5748 136 E 4.0266 8.4469 118.8516 59.0383 29.3015 179.0372 137 L 4.0534 8.1160 120.5043 58.0558 42.2766 178.5713 138 F 4.1761 8.3189 120.5623 61.5467 39.2753 177.0154 139 R 3.5482 8.4315 118.4567 59.4186 29.8838 178.0074 140 N 4.2323 8.7189 117.2100 56.7315 38.5126 176.6599 141 D 4.3915 8.3297 120.5199 57.1054 40.8218 178.8139 142 I 3.5761 7.4149 120.3041 64.0288 36.9813 178.1489 143 A 3.7195 7.8669 121.5668 55.0018 18.2538 179.5435 144 A 3.9495 7.9253 119.2813 55.3136 18.4562 180.0799 145 K 4.0608 7.7851 116.5090 59.6161 32.1094 179.2908 146 Y 4.1602 8.3395 117.3755 61.0338 37.8167 178.4507 147 K 4.0074 8.4255 120.6819 59.2655 32.0258 178.2919 148 E 3.9137 7.8674 118.4369 59.4671 29.7242 178.6112 149 L 4.2469 7.8528 116.1554 54.9793 41.7797 177.6185 150 G 3.8799 7.6917 106.7092 46.2517 0.0000 173.2577 151 F 4.5981 8.0811 121.2644 56.9056 40.3266 175.6560 152 Q 3.8166 7.2597 124.6263 55.8927 29.1873 175.3194 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 G 8.35 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 2 L 8.00 4.36 0.00 0.36 0.75 0.48 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.63 4.53 0.00 4.03 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 4 D 8.67 4.66 0.00 2.77 2.84 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 5 G 8.10 3.68 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 0.00 0.00 0.00 6 E 8.20 3.96 0.00 2.01 1.77 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 2.24 2.27 0.00 7 W 8.28 4.35 0.00 3.53 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 8 Q 8.45 4.08 0.00 2.21 2.35 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 2.41 2.46 0.00 9 Q 8.19 4.06 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 10 V 8.11 3.71 2.51 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 1.19 0.00 0.00 0.90 0.00 0.00 11 L 8.10 4.27 0.00 1.77 1.80 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.15 4.54 0.00 2.95 3.02 0.00 0.00 6.65 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.22 3.62 2.41 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 0.96 0.00 0.00 1.20 0.00 0.00 14 W 8.70 4.12 0.00 3.63 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 G 7.76 3.68 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 0.00 0.00 0.00 16 K 7.97 3.98 0.00 1.62 1.48 0.00 1.42 0.00 0.00 0.89 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.26 1.29 7.81 17 V 6.89 2.70 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 0.13 0.00 0.00 0.11 0.00 0.00 18 E 7.51 3.91 0.00 1.89 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 19 A 7.32 4.20 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 20 D 7.66 4.66 0.00 2.73 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.84 3.62 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.26 0.89 0.00 0.00 22 A 7.40 4.15 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 23 G 8.46 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 24 H 8.35 4.15 0.00 3.08 3.22 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.27 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.13 3.83 0.00 2.12 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.74 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 27 E 8.02 3.86 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 28 V 7.76 3.51 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.94 0.00 0.00 29 L 7.60 3.37 0.00 1.51 0.80 0.83 0.77 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 30 I 7.70 3.69 1.77 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.72 0.87 0.00 0.00 31 R 7.96 3.78 0.00 1.96 2.06 0.00 3.04 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 32 L 7.76 3.92 0.00 1.78 1.46 1.09 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 33 F 7.95 4.57 0.00 2.91 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 34 T 8.16 4.17 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 1.23 0.00 0.00 35 G 7.92 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 H 7.94 4.75 0.00 3.05 2.90 0.00 5.65 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.37 0.00 2.15 2.12 0.00 3.55 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 38 E 8.21 4.13 0.00 2.33 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 2.21 2.54 0.00 39 T 8.16 3.77 4.50 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 0.79 0.00 0.00 40 L 7.80 3.59 0.00 1.47 1.75 -0.08 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.68 4.13 0.00 2.24 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 42 K 8.10 4.48 0.00 1.97 1.79 0.00 1.94 0.00 0.00 1.81 0.00 0.00 3.25 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.93 2.05 7.81 43 F 8.10 4.66 0.00 3.29 2.93 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 44 D 8.68 4.41 0.00 2.64 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 7.82 4.26 0.00 1.60 1.72 0.00 1.29 0.00 0.00 1.47 0.00 0.00 2.68 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.94 0.21 7.81 46 F 8.04 5.08 0.00 2.81 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.17 4.09 0.00 1.87 2.08 0.00 1.59 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.61 1.46 7.81 48 H 8.02 4.32 0.00 3.28 3.51 0.00 5.72 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.40 4.14 0.00 1.65 1.60 0.80 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.20 4.32 0.00 1.85 1.85 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.58 1.51 7.81 51 T 7.57 4.73 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 52 E 8.69 3.93 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 2.35 2.36 0.00 53 A 7.95 3.99 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 54 E 7.86 3.97 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 55 M 7.94 4.15 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.50 0.00 56 K 8.48 3.93 0.00 1.75 1.97 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.48 7.81 57 A 7.58 4.55 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 58 S 7.61 4.36 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 59 E 8.77 4.07 0.00 2.06 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 2.42 2.32 0.00 60 D 8.16 4.49 0.00 2.90 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 7.98 3.90 0.00 1.50 1.69 0.69 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.87 3.89 0.00 1.81 1.98 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.60 7.81 63 K 8.15 3.91 0.00 2.08 2.06 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.51 7.81 64 H 8.92 4.45 0.00 3.70 3.59 0.00 5.84 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.36 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 66 T 7.94 3.93 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 1.24 0.00 0.00 67 V 7.67 3.74 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 1.06 0.00 0.00 1.00 0.00 0.00 68 V 8.04 3.61 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 1.06 0.00 0.00 0.97 0.00 0.00 69 L 8.15 4.33 0.00 1.80 1.87 0.81 0.80 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 70 T 8.11 4.02 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 1.26 0.00 0.00 71 A 7.94 3.99 1.46 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 72 L 8.00 3.70 0.00 1.60 1.63 0.06 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.47 3.10 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 0.00 0.00 0.00 0.00 74 G 7.83 3.60 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 0.00 75 I 7.50 3.85 1.87 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 1.54 0.66 0.96 0.00 0.00 76 L 7.95 3.98 0.00 1.23 1.52 0.03 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.62 4.03 0.00 1.76 1.76 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.11 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.39 1.53 7.81 78 K 7.80 4.00 0.00 1.82 1.82 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.59 1.58 7.81 79 K 8.22 2.00 0.00 1.14 0.74 0.00 1.31 0.00 0.00 1.52 0.00 0.00 2.79 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.41 0.81 7.81 80 G 7.85 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 0.00 0.00 0.00 81 H 7.38 4.55 0.00 3.14 3.24 0.00 5.80 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 82 H 7.30 5.74 0.00 3.28 3.45 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.68 3.91 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 84 A 7.92 3.99 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 85 E 8.13 4.11 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 86 L 8.50 4.02 0.00 1.71 1.69 0.71 0.52 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 87 K 8.25 3.82 0.00 2.07 1.83 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.49 7.81 88 P 0.00 4.28 0.00 2.33 2.31 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.17 0.00 89 L 7.94 4.09 0.00 1.94 1.81 1.05 0.88 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 90 A 8.22 4.12 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 91 Q 8.37 3.95 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 92 S 8.23 4.03 0.00 3.99 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 H 8.65 4.17 0.00 3.50 3.57 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.60 2.58 0.27 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 95 T 7.31 3.65 4.15 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 1.08 0.00 0.00 96 K 7.42 4.05 0.00 1.51 1.59 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.23 1.34 7.81 97 H 7.73 4.39 0.00 3.19 3.15 0.00 5.86 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.36 3.49 0.00 1.90 1.95 0.00 1.79 0.00 0.00 1.85 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.26 1.33 7.81 99 I 7.97 4.26 2.10 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 1.52 0.97 1.18 0.00 0.00 100 P 0.00 4.39 0.00 1.61 1.70 0.00 2.20 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.81 0.00 101 I 8.50 3.53 1.71 0.00 0.00 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 1.36 1.06 0.83 0.00 0.00 102 K 7.92 3.67 0.00 1.76 1.64 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.15 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 0.67 7.81 103 Y 7.92 4.03 0.00 3.21 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 0.00 104 L 7.92 4.18 0.00 1.82 1.72 0.64 0.91 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 0.00 105 E 7.84 3.94 0.00 1.95 1.98 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 2.45 2.42 0.00 106 F 7.87 4.50 0.00 3.28 2.84 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 0.00 107 I 8.21 3.82 2.03 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.40 1.13 0.00 0.00 108 S 8.18 4.22 0.00 4.21 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 0.00 109 D 8.44 4.48 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 0.00 110 A 8.33 4.04 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 0.00 111 I 8.01 3.69 2.12 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 1.58 1.08 1.00 0.00 0.00 112 I 7.80 3.89 2.15 0.00 0.00 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 1.72 1.35 1.16 0.00 0.00 113 H 8.53 4.18 0.00 3.38 3.51 0.00 5.78 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.19 3.56 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.00 0.00 0.00 115 L 7.91 3.80 0.00 1.30 0.46 0.42 0.58 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 H 7.86 4.40 0.00 3.36 3.38 0.00 5.66 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.87 4.17 0.00 3.80 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 0.00 118 K 8.00 4.10 0.00 1.38 1.45 0.00 1.39 0.00 0.00 1.19 0.00 0.00 2.46 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.25 1.43 7.81 119 H 8.06 4.96 0.00 3.20 3.18 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.46 0.00 2.19 2.09 0.00 3.87 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 2.00 1.96 0.00 121 G 9.17 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 0.00 122 D 8.36 4.99 0.00 2.63 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 F 7.95 5.03 0.00 2.76 2.84 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 0.00 124 G 8.02 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 0.00 125 A 8.42 3.89 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 0.00 126 D 8.00 4.21 0.00 3.14 2.91 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 0.00 127 A 7.77 3.97 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 7.84 3.48 0.00 1.10 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 129 G 8.09 3.50 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 0.00 0.00 0.00 130 A 8.05 3.84 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 0.00 131 M 8.31 4.06 0.00 2.41 2.33 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.83 0.00 132 T 8.21 3.92 4.41 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 1.23 0.00 0.00 133 K 8.26 4.16 0.00 1.81 1.67 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.36 7.81 134 A 8.00 3.86 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 0.00 135 L 8.13 4.13 0.00 1.92 1.83 1.01 0.69 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 0.00 136 E 8.45 4.03 0.00 2.16 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 2.35 2.59 0.00 137 L 8.12 4.05 0.00 1.89 1.96 0.98 1.00 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 0.00 138 F 8.32 4.18 0.00 3.21 3.30 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 0.00 139 R 8.43 3.55 0.00 2.08 2.05 0.00 3.17 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.50 0.00 140 N 8.72 4.23 0.00 2.93 2.78 0.00 0.00 7.26 9.14 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 0.00 141 D 8.33 4.39 0.00 2.75 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 0.00 142 I 7.41 3.58 1.49 0.00 0.00 -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 1.09 0.04 0.33 0.00 0.00 143 A 7.87 3.72 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 0.00 144 A 7.93 3.95 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 0.00 145 K 7.79 4.06 0.00 2.06 1.94 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.68 1.64 7.81 146 Y 8.34 4.16 0.00 3.16 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.43 4.01 0.00 1.86 1.99 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.46 7.81 148 E 7.87 3.91 0.00 2.19 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 149 L 7.85 4.25 0.00 1.80 1.66 0.84 0.92 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 0.00 150 G 7.69 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 0.00 0.00 0.00 151 F 8.08 4.60 0.00 2.73 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 0.00 152 Q 7.26 3.82 0.00 1.72 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.42 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00