NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9023 8.3393 109.7334 46.1016 0.0000 172.1519 2 S 4.4217 7.8532 111.5311 57.1941 65.0000 173.3039 3 F 4.5225 9.6253 121.1532 55.9282 40.9894 177.1366 4 L 4.4421 8.3922 125.7991 52.9401 40.9593 175.8072 5 P 4.4110 0.0000 0.0000 65.2347 31.8466 178.6093 6 N 4.3983 8.2190 116.3474 56.2028 38.5343 175.9560 7 S 4.3782 7.4822 110.0540 58.7747 63.2492 174.0716 8 E 4.1516 7.5752 121.8158 56.6679 29.9307 176.1931 9 Q 4.4217 8.2143 123.0875 54.6723 32.6318 173.9060 10 Q 4.2605 8.7089 124.7720 54.9430 29.7934 174.5337 11 K 4.7072 8.3770 125.9327 54.9034 34.7638 175.1400 12 S 4.6770 8.1401 118.5459 57.5804 66.8009 173.8788 13 V 4.5757 8.0488 116.1323 60.1047 35.7416 173.8918 14 D 5.0186 8.4297 120.0467 52.6888 43.0360 176.0562 15 I 4.2329 8.2026 123.3966 59.7420 38.6218 175.6511 16 V 4.2468 8.0536 124.4656 61.4918 32.2388 175.4448 17 F 4.5609 8.5838 129.3792 55.6369 37.5493 177.3184 18 S 4.5195 7.8442 118.3489 57.9467 60.7090 175.0045 19 S 4.5257 8.1112 123.3718 61.6569 63.2133 174.1171 20 P 4.4153 0.0000 0.0000 63.2308 31.5427 175.0851 21 Q 4.5528 8.9262 120.6230 56.0805 32.9676 173.1918 22 D 4.4009 7.9807 121.3458 53.7883 40.8721 173.6242 23 L 4.3313 7.6414 117.9595 56.2124 42.2411 172.8672 24 T 4.6694 8.1833 108.4789 59.8111 71.5761 173.4621 25 V 4.3279 7.5757 120.4466 61.5589 34.7251 174.1362 26 S 4.6917 8.0431 119.1467 58.1593 66.9914 174.8121 27 L 5.1057 8.3536 123.2719 53.3202 44.9952 175.2577 28 I 4.5978 8.2378 125.1202 58.7873 40.7928 172.9367 29 P 4.5166 0.0000 0.0000 62.7875 32.0144 176.0066 30 V 4.3205 7.7817 123.5020 61.5527 32.6388 176.1335 31 S 4.4071 8.7131 122.6649 58.2081 65.0408 173.0472 32 G 3.6598 8.5409 105.6685 46.4850 0.0000 173.5207 33 L 4.8514 7.5116 116.1658 52.7436 45.3687 176.9572 34 K 4.6118 8.3167 120.4462 54.2209 35.5508 176.0545 35 A 4.2526 8.3259 124.6730 52.4574 19.8296 178.1193 36 G 3.8196 9.2073 105.3068 44.3513 0.0000 174.2631 37 K 4.4517 8.2247 120.2693 56.0720 30.9974 177.6862 38 N 4.7470 8.2521 123.4538 52.1901 39.6502 174.5633 39 A 4.2485 8.3548 121.7400 51.0048 19.3514 175.8955 40 P 4.0927 0.0000 0.0000 64.4886 31.8546 176.6014 41 S 3.6044 8.5539 116.1084 59.4104 60.2355 172.3472 42 A 4.2402 7.7933 123.1111 51.1422 18.8122 177.8242 43 K 4.4589 8.6249 123.8790 56.6089 32.8127 176.9032 44 I 4.6116 8.3219 115.8810 60.6542 40.0687 174.5970 45 A 4.8080 7.7237 123.2993 50.8323 23.5826 175.0078 46 K 4.6303 8.3754 119.5172 54.9005 34.8130 174.9639 47 L 4.0603 8.8901 131.5405 54.9895 43.0291 175.6904 48 V 4.2134 8.4439 127.9376 61.8158 32.6258 175.6187 49 V 4.2816 9.1781 128.2143 61.1094 33.5715 173.5856 50 N 5.3638 8.1455 123.7425 51.9025 40.6870 174.5957 51 S 4.4774 7.8971 111.5242 58.9307 66.2861 176.0362 52 T 4.2024 8.1410 105.1359 63.6491 66.2157 173.9136 53 T 4.2414 7.6644 104.9155 61.5496 68.4166 173.3314 54 L 4.2505 7.1506 119.5400 56.2216 42.1072 176.1727 55 K 4.1945 9.1546 119.7979 56.5390 31.8898 176.9133 56 E 5.2104 8.3449 122.5923 55.3449 32.7004 175.2024 57 F 5.2486 9.5671 116.3579 55.4142 42.1279 173.5454 58 G 4.8133 9.9078 107.8924 44.7669 0.0000 172.7797 59 V 5.5891 9.2389 121.0676 60.4471 34.5531 173.7495 60 R 4.6510 8.6698 119.7178 54.1635 34.7782 174.8100 61 G 2.4096 8.0840 109.4105 44.5590 0.0000 173.7023 62 I 4.2207 6.8188 123.2028 59.6885 39.4462 174.5458 63 S 4.5942 7.9602 119.0946 57.7598 65.2232 174.3230 64 N 4.4239 8.9962 117.0520 55.9108 38.4902 174.9855 65 N 4.8025 7.7420 117.4944 51.4636 38.6303 171.9820 66 V 4.5495 7.8937 122.0440 61.6437 33.0517 176.3975 67 V 4.6277 8.0299 120.6887 59.9508 32.3855 175.1593 68 D 4.6354 7.5907 115.6768 52.4468 41.9570 176.0035 69 S 4.2172 8.8344 116.8967 61.7899 63.5232 175.5927 70 T 3.8324 7.9650 110.4346 64.5799 68.4354 173.9306 71 G 3.9721 8.9402 107.0040 45.0404 0.0000 172.4416 72 T 3.5197 8.9890 106.2621 62.0382 66.6839 172.2551 73 A 4.8987 8.3741 124.0726 51.8067 22.8899 176.4227 74 W 5.5237 8.5517 118.6556 55.6675 32.3484 173.8515 75 R 5.0597 8.7944 118.5123 54.5003 33.1358 175.9496 76 V 4.6658 8.1905 113.1937 59.7690 35.8439 174.4796 77 A 4.9427 8.7676 126.4763 50.3374 20.7431 177.2689 78 G 3.7020 8.5580 110.5429 45.0574 0.0000 174.0462 79 K 4.1711 8.2264 117.5628 58.9588 32.6776 178.7614 80 N 4.4407 8.1277 114.7361 56.0999 38.6016 176.3474 81 T 4.2600 7.6190 104.8146 60.9778 70.3326 175.3408 82 G 3.8761 8.2142 108.5003 45.7818 0.0000 173.4417 83 K 4.3186 7.9421 118.1079 56.1767 33.3458 176.2284 84 E 5.0696 8.6721 122.1266 55.6538 31.1364 175.7971 85 I 4.5941 8.0508 115.1875 58.8183 41.4193 174.9108 86 G 3.6910 8.6017 112.1730 46.5546 0.0000 172.8287 87 V 4.5206 7.9196 115.1181 59.0650 36.7882 174.4042 88 G 3.6993 7.2060 108.5223 45.6655 0.0000 172.7615 89 L 4.7761 8.6847 120.2103 54.1813 42.5886 177.8163 90 S 4.3785 8.4910 115.6791 58.1269 63.8044 175.7506 91 S 4.2133 8.5839 117.4180 61.6522 62.3761 176.8337 92 D 4.4620 8.0670 121.3818 57.5260 40.6389 178.6175 93 S 4.2822 8.1884 115.6211 61.7968 62.6252 176.8515 94 L 4.1820 7.9098 120.5890 57.8817 41.3786 179.5140 95 R 4.1091 7.5737 116.0544 59.1587 30.1058 178.8712 96 R 4.0658 8.3642 117.8331 58.0070 30.4035 177.5183 97 S 3.3435 7.4843 112.4625 58.7177 63.3793 173.8060 98 D 4.5416 8.5663 122.7485 56.2144 41.7931 176.1717 99 S 4.3034 8.1335 110.9486 57.9487 66.6118 172.7012 100 T 4.7536 8.2952 117.2457 61.8339 68.2041 173.8659 101 E 4.3383 9.4346 125.8234 54.1491 32.0314 175.8689 102 K 4.9276 7.8210 118.5454 53.3143 32.3484 175.5929 103 W 4.7107 8.6256 129.2807 58.1342 30.8164 175.2683 104 N 4.3809 10.2708 125.5630 54.1722 35.8399 174.9649 105 G 4.0650 8.9900 107.9672 45.3573 0.0000 174.5495 106 V 3.7887 8.4835 120.9577 62.4296 32.1407 175.6543 107 N 4.8187 8.8018 125.8358 53.7024 39.3958 174.6570 108 W 5.0783 9.8772 122.0246 55.3081 33.9473 174.1876 109 M 4.8878 8.6579 122.4190 54.8622 33.1727 175.4451 110 T 5.0788 8.9626 113.9801 60.1074 72.1596 173.2456 111 F 4.8858 8.8925 121.0902 55.3230 43.7009 173.7072 112 N 4.7131 9.8947 121.0709 53.3675 38.7883 176.8006 113 S 4.7993 9.3230 123.8926 57.4334 60.2499 176.2287 114 N 5.3395 7.6010 117.7062 52.0033 40.4199 173.8461 115 D 4.6286 9.5317 122.1659 53.1444 44.1584 176.4661 116 T 4.9560 8.3559 109.0117 59.5203 69.0496 171.7744 117 L 4.2559 8.6235 129.1651 55.3955 43.0047 175.6979 118 D 5.1467 8.7864 124.1417 53.7295 42.7484 175.5525 119 I 4.7490 8.5929 123.1007 60.3735 39.3621 175.2762 120 V 4.7493 8.5589 117.7084 58.4922 36.6480 175.0585 121 L 4.5950 8.6504 122.6063 53.8992 41.3015 176.8026 122 T 4.0665 8.2573 114.9721 59.7324 69.9837 175.8159 123 G 3.7594 8.4042 110.9897 45.0185 0.0000 169.8282 124 P 4.1968 0.0000 0.0000 62.3898 31.9530 175.7403 125 A 4.2629 8.1929 122.4453 52.2817 18.8318 176.9429 126 Q 4.4170 8.1756 117.2908 54.2605 32.5440 174.9984 127 N 5.0117 8.7506 123.8391 52.6846 37.5001 174.2572 128 V 3.9820 8.3667 123.5569 62.4666 33.3884 174.5704 129 T 4.8639 7.9246 120.9345 61.7446 70.7011 175.5698 130 A 4.2216 8.5724 127.0234 52.5472 16.8636 176.1386 131 D 4.5359 7.7982 118.4995 53.9096 44.1766 174.8135 132 T 4.1515 8.0098 118.9033 63.8296 70.1929 174.0083 133 Y 4.8904 8.1972 122.0514 56.1257 40.7093 173.3109 134 P 4.6226 0.0000 0.0000 62.4595 32.4545 175.7769 135 I 4.9557 8.0173 118.5271 60.0481 40.8382 175.2647 136 T 4.7625 8.3044 117.8713 61.9652 72.3506 173.6549 137 L 4.6478 8.1941 123.5736 53.0845 44.9722 175.6653 138 D 4.8970 8.1569 124.2574 53.5827 42.4990 175.7194 139 V 5.0521 8.4706 122.1443 61.1372 34.5875 174.8805 140 V 4.2885 9.3291 126.4991 59.2975 34.7704 175.9568 141 G 4.1399 8.3422 110.9385 45.6820 0.0000 171.7718 142 Y 4.1231 7.8937 121.1988 58.7540 39.6787 176.0608 143 Q 3.9997 7.4878 125.6136 53.7333 30.1681 173.9877 144 P 4.3131 0.0000 0.0000 63.0348 31.3315 176.0945 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 8.34 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 2 S 7.85 4.42 0.00 4.08 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 3 F 9.63 4.52 0.00 3.01 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 4 L 8.39 4.44 0.00 1.78 1.65 0.91 1.02 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 5 P 0.00 4.41 0.00 2.23 2.33 0.00 3.73 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.01 0.00 6 N 8.22 4.40 0.00 2.75 2.93 0.00 0.00 6.95 7.57 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 7 S 7.48 4.38 0.00 4.00 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 8 E 7.58 4.15 0.00 2.01 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 2.33 2.30 0.00 9 Q 8.21 4.42 0.00 2.03 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.66 0.00 0.00 0.00 0.00 0.00 2.27 2.53 0.00 10 Q 8.71 4.26 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 11 K 8.38 4.71 0.00 1.71 1.65 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.32 1.48 7.81 12 S 8.14 4.68 0.00 3.85 3.69 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 13 V 8.05 4.58 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 0.73 0.00 0.00 0.93 0.00 0.00 14 D 8.43 5.02 0.00 2.63 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 15 I 8.20 4.23 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.88 0.93 0.00 0.00 16 V 8.05 4.25 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 0.82 0.00 0.00 0.91 0.00 0.00 17 F 8.58 4.56 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 18 S 7.84 4.52 0.00 3.95 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 19 S 8.11 4.53 0.00 3.82 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 20 P 0.00 4.42 0.00 1.99 1.95 0.00 3.73 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 2.00 2.04 0.00 21 Q 8.93 4.55 0.00 1.94 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 22 D 7.98 4.40 0.00 2.70 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 23 L 7.64 4.33 0.00 1.67 1.69 0.93 0.39 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 24 T 8.18 4.67 4.18 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 0.00 0.00 0.00 1.18 0.00 0.00 25 V 7.58 4.33 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 0.78 0.00 0.00 0.85 0.00 0.00 26 S 8.04 4.69 0.00 3.72 3.65 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 0.00 0.00 0.00 0.00 27 L 8.35 5.11 0.00 1.57 1.48 0.99 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 28 I 8.24 4.60 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 1.35 0.82 0.92 0.00 0.00 29 P 0.00 4.52 0.00 1.95 2.01 0.00 3.68 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 2.05 2.12 0.00 30 V 7.78 4.32 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 0.78 0.00 0.00 0.94 0.00 0.00 31 S 8.71 4.41 0.00 4.02 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 32 G 8.54 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 33 L 7.51 4.85 0.00 1.62 1.56 0.98 0.91 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 34 K 8.32 4.61 0.00 1.69 1.67 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.34 7.81 35 A 8.33 4.25 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 36 G 9.21 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 K 8.22 4.45 0.00 1.77 1.76 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.73 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.46 7.81 38 N 8.25 4.75 0.00 2.55 2.73 0.00 0.00 6.91 7.23 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 39 A 8.35 4.25 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 40 P 0.00 4.09 0.00 2.03 2.00 0.00 3.82 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 2.02 2.11 0.00 41 S 8.55 3.60 0.00 3.99 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 42 A 7.79 4.24 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 43 K 8.62 4.46 0.00 1.76 1.77 0.00 1.70 0.00 0.00 1.92 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.42 7.81 44 I 8.32 4.61 1.88 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 1.13 0.96 0.89 0.00 0.00 45 A 7.72 4.81 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 46 K 8.38 4.63 0.00 1.64 1.66 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.52 7.81 47 L 8.89 4.06 0.00 1.84 1.69 0.86 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.44 4.21 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 0.75 0.00 0.00 0.92 0.00 0.00 49 V 9.18 4.28 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.24 0.00 0.00 50 N 8.15 5.36 0.00 2.64 2.71 0.00 0.00 6.75 7.52 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 51 S 7.90 4.48 0.00 3.76 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.14 4.20 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 53 T 7.66 4.24 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 54 L 7.15 4.25 0.00 1.50 1.78 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 55 K 9.15 4.19 0.00 1.64 1.66 0.00 1.67 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.61 1.55 7.81 56 E 8.34 5.21 0.00 2.08 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 2.28 2.35 0.00 57 F 9.57 5.25 0.00 3.10 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 58 G 9.91 4.81 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 59 V 9.24 5.59 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 0.73 0.00 0.00 0.99 0.00 0.00 60 R 8.67 4.65 0.00 1.35 1.42 0.00 2.21 0.00 0.00 2.50 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.65 0.00 61 G 8.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 I 6.82 4.22 1.84 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.07 0.85 0.00 0.00 63 S 7.96 4.59 0.00 4.07 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 64 N 9.00 4.42 0.00 2.77 2.94 0.00 0.00 6.53 8.00 0.00 0.00 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 N 7.74 4.80 0.00 2.82 2.71 0.00 0.00 6.82 7.59 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 66 V 7.89 4.55 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 0.91 0.00 0.00 0.93 0.00 0.00 67 V 8.03 4.63 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 0.84 0.00 0.00 1.02 0.00 0.00 68 D 7.59 4.64 0.00 2.74 2.61 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 69 S 8.83 4.22 0.00 3.98 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 70 T 7.97 3.83 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 71 G 8.94 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 T 8.99 3.52 4.51 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 1.39 0.00 0.00 73 A 8.37 4.90 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 74 W 8.55 5.52 0.00 3.37 3.16 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 75 R 8.79 5.06 0.00 1.71 1.81 0.00 3.08 0.00 0.00 3.36 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 76 V 8.19 4.67 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 1.08 0.00 0.00 0.98 0.00 0.00 77 A 8.77 4.94 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 78 G 8.56 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.23 4.17 0.00 1.67 1.82 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.40 7.81 80 N 8.13 4.44 0.00 2.75 2.82 0.00 0.00 7.00 7.22 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 81 T 7.62 4.26 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 82 G 8.21 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 83 K 7.94 4.32 0.00 1.88 1.80 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.57 1.53 7.81 84 E 8.67 5.07 0.00 1.85 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 2.31 2.33 0.00 85 I 8.05 4.59 1.67 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.66 0.44 0.00 0.00 86 G 8.60 3.69 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 0.00 0.00 0.00 87 V 7.92 4.52 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 0.54 0.00 0.00 -0.10 0.00 0.00 88 G 7.21 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.68 4.78 0.00 1.67 1.69 0.84 0.91 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 90 S 8.49 4.38 0.00 4.02 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 91 S 8.58 4.21 0.00 3.90 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 8.07 4.46 0.00 2.72 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 93 S 8.19 4.28 0.00 4.19 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 94 L 7.91 4.18 0.00 1.69 1.79 0.97 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 95 R 7.57 4.11 0.00 2.00 2.00 0.00 3.18 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 96 R 8.36 4.07 0.00 2.06 2.12 0.00 3.27 0.00 0.00 3.38 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 97 S 7.48 3.34 0.00 2.75 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 98 D 8.57 4.54 0.00 2.31 2.66 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 99 S 8.13 4.30 0.00 3.70 3.48 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 0.00 100 T 8.30 4.75 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 1.19 0.00 0.00 101 E 9.43 4.34 0.00 1.16 1.18 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 0.00 1.77 1.47 0.00 102 K 7.82 4.93 0.00 1.84 1.78 0.00 2.01 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.61 1.48 7.81 103 W 8.63 4.71 0.00 3.50 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 0.00 104 N 10.27 4.38 0.00 2.90 2.90 0.00 0.00 7.38 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 0.00 105 G 8.99 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 0.00 106 V 8.48 3.79 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.86 0.00 0.00 107 N 8.80 4.82 0.00 2.79 2.77 0.00 0.00 6.93 7.68 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 0.00 108 W 9.88 5.08 0.00 3.18 3.16 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 0.00 109 M 8.66 4.89 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.50 0.00 110 T 8.96 5.08 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 0.89 0.00 0.00 111 F 8.89 4.89 0.00 1.51 2.65 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 0.00 0.00 0.00 0.00 112 N 9.89 4.71 0.00 2.65 2.91 0.00 0.00 7.01 5.12 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 0.00 113 S 9.32 4.80 0.00 3.84 4.18 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 0.00 0.00 0.00 0.00 114 N 7.60 5.34 0.00 2.70 2.79 0.00 0.00 6.53 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 0.00 115 D 9.53 4.63 0.00 2.75 2.89 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 0.00 116 T 8.36 4.96 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 1.22 0.00 0.00 117 L 8.62 4.26 0.00 1.62 1.62 0.30 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 118 D 8.79 5.15 0.00 2.62 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 I 8.59 4.75 1.91 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.47 1.00 0.00 0.00 120 V 8.56 4.75 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 1.08 0.00 0.00 0.93 0.00 0.00 121 L 8.65 4.59 0.00 1.44 1.55 0.82 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 122 T 8.26 4.07 4.17 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 1.16 0.00 0.00 123 G 8.40 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.20 0.00 2.02 2.01 0.00 3.65 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 2.02 2.10 0.00 125 A 8.19 4.26 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 Q 8.18 4.42 0.00 1.88 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.04 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 127 N 8.75 5.01 0.00 2.72 2.73 0.00 0.00 7.12 7.71 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 0.00 128 V 8.37 3.98 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 0.79 0.00 0.00 0.79 0.00 0.00 129 T 7.92 4.86 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 1.24 0.00 0.00 130 A 8.57 4.22 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 0.00 131 D 7.80 4.54 0.00 2.53 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 0.00 0.00 0.00 132 T 8.01 4.15 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 1.18 0.00 0.00 133 Y 8.20 4.89 0.00 2.80 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 0.00 134 P 0.00 4.62 0.00 2.23 2.09 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.03 0.00 135 I 8.02 4.96 2.00 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 1.59 0.80 1.23 0.00 0.00 136 T 8.30 4.76 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 1.19 0.00 0.00 137 L 8.19 4.65 0.00 1.55 1.49 0.98 0.86 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 0.00 138 D 8.16 4.90 0.00 3.17 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 0.00 139 V 8.47 5.05 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 0.89 0.00 0.00 0.96 0.00 0.00 140 V 9.33 4.29 1.66 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 -0.10 0.00 0.00 0.49 0.00 0.00 141 G 8.34 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 0.00 0.00 0.00 0.00 142 Y 7.89 4.12 0.00 2.86 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 0.00 143 Q 7.49 4.00 0.00 1.63 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.84 0.00 0.00 0.00 0.00 0.00 1.98 2.04 0.00 144 P 0.00 4.31 0.00 2.20 2.31 0.00 3.66 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 1.99 1.92 0.00