NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1B H 4.7097 8.4449 120.3808 55.6968 31.8337 173.4926 1C H 4.1651 8.1012 116.5208 56.5672 28.9258 173.4776 1D H 4.8098 9.4890 120.4044 56.0057 30.5088 173.7378 1E H 5.0853 7.6851 115.4953 53.6398 32.6059 172.3506 1F H 4.6592 8.8793 117.0419 55.9138 28.9868 174.3910 1G F 4.8692 8.3916 119.2013 57.8895 39.9179 173.8828 2 N 4.6335 8.5761 117.0493 52.3936 39.0764 174.4750 3 L 4.8139 8.0816 123.1100 51.9588 44.2221 174.6099 4 P 4.4845 0.0000 0.0000 61.6737 32.2160 174.1394 5 P 4.4264 0.0000 0.0000 62.1084 32.5185 175.9337 6 G 3.9637 9.1406 105.0073 45.2689 0.0000 172.3668 7 N 4.3494 7.8353 114.8492 51.6943 40.1307 174.1725 8 Y 4.9285 7.9206 115.9234 58.1962 38.5025 176.9728 9 K 4.1303 8.6050 122.6365 58.7330 32.2293 177.2529 10 K 4.7395 7.6042 115.1924 53.2391 35.5943 173.7077 11 P 4.8396 0.0000 0.0000 63.2261 32.3675 174.9682 12 K 4.7776 9.1728 119.2720 56.0944 36.7091 174.3827 13 L 5.0547 9.1393 120.4158 53.2608 44.3587 176.2316 14 L 5.0324 8.6131 122.2728 53.4903 43.4071 174.6107 15 Y 4.8434 9.2478 127.1975 56.5535 40.3934 173.7234 16 C 4.0727 8.5630 128.6754 58.1567 32.4888 174.1067 17 S 3.8850 8.0237 120.8715 59.9086 62.8212 175.2595 18 N 4.1677 8.0027 119.4979 56.1531 38.8551 175.5187 19 G 3.8509 7.8086 103.9256 44.7752 0.0000 173.5206 20 G 3.4052 7.7013 107.7105 43.9884 0.0000 173.0296 21 H 4.8533 7.4666 115.2892 53.9380 31.5571 174.1753 22 F 5.1855 8.9448 120.5367 56.3623 40.3548 175.2113 23 L 4.6274 9.1605 126.3090 55.3655 43.2966 175.6038 24 R 4.9209 9.3376 126.2291 54.6167 33.6313 174.0153 25 I 4.4248 8.2894 126.8156 59.3860 38.7301 175.6874 26 L 4.0864 8.8007 127.9755 53.4058 42.3096 176.8219 27 P 4.2360 0.0000 0.0000 65.9017 31.2406 177.2666 28 D 4.4884 7.9583 114.2983 53.6832 39.7907 177.0113 29 G 4.0596 8.6840 110.3302 45.1886 0.0000 173.7901 30 T 4.3590 8.3381 110.8167 61.1520 69.6534 173.7656 31 V 4.8337 8.0221 122.6581 61.2803 34.5738 174.4803 32 D 4.5806 8.4311 125.4146 52.9916 42.6095 174.0947 33 G 4.5754 8.6008 104.5491 45.4329 0.0000 172.2686 34 T 4.9963 8.8354 114.8448 60.4797 71.0177 174.7068 35 R 4.3129 8.8688 124.4556 56.7587 31.0033 176.4634 36 D 4.5599 8.3441 118.9952 53.6475 39.9781 176.5015 37 R 3.7131 8.5981 127.3603 57.9652 30.2820 177.0980 38 S 4.4322 8.3063 110.9702 58.5254 63.7071 174.0433 39 D 4.3655 7.7833 121.5833 55.2206 41.2111 176.0592 40 Q 4.3256 8.5095 123.1487 56.9076 29.3877 175.8914 41 H 4.8817 9.1441 116.0038 55.4570 29.0303 175.4770 42 I 4.5298 7.0251 110.4055 59.9839 38.5385 175.4543 43 Q 4.2239 7.8563 121.9013 55.7786 29.6404 174.6661 44 L 5.1702 8.8718 124.7716 52.7996 45.1838 175.4203 45 Q 4.8135 9.2498 124.9225 54.5505 30.5969 174.6971 46 L 5.1021 8.5639 126.6579 54.2016 43.5610 176.1853 47 S 4.5801 8.4670 114.1542 57.0470 66.6087 173.1719 48 A 4.6988 8.4910 123.3133 52.4758 20.0552 176.2685 49 E 4.1975 8.8343 120.1420 56.5371 29.6484 179.1138 50 S 4.5580 5.8100 115.0647 56.8882 64.6761 173.4616 51 V 3.8267 8.2069 121.4421 64.8561 31.5235 176.2325 52 G 3.9287 9.2188 114.4892 45.2996 0.0000 171.8514 53 E 5.1601 8.2611 119.6834 54.5840 32.2740 175.6120 54 V 4.8535 8.8764 116.1798 59.9411 36.6684 173.9593 55 Y 5.1873 8.8292 120.2007 56.5171 41.2175 175.1884 56 I 4.5765 8.5818 122.2851 59.6272 40.4069 174.0621 57 K 4.6279 8.6821 129.1892 54.0377 34.9916 175.1322 58 S 4.4495 8.8472 123.2046 58.5266 62.6244 174.9373 59 T 3.8923 8.6196 118.5393 64.5503 68.8228 175.9895 60 E 4.0460 8.3610 122.6757 58.6047 29.8596 177.1118 61 T 4.2842 8.0068 106.2116 60.7935 70.0570 175.6169 62 G 3.8111 8.1001 109.7797 45.3511 0.0000 173.7115 63 Q 4.4159 7.5129 119.0419 55.9481 30.3159 174.5877 64 Y 4.6844 8.7962 119.7626 56.0522 40.5486 175.1345 65 L 4.3793 9.0469 125.8945 55.3351 43.3872 175.6299 66 A 5.0789 8.7725 126.1201 50.5928 23.2407 174.3219 67 M 5.3258 8.7542 119.2721 53.9245 34.8840 175.6394 68 D 5.2570 9.5378 126.1840 51.8993 41.3506 176.7514 69 T 4.3266 8.4909 107.7082 63.4786 68.8996 174.5691 70 D 4.6276 8.4200 121.0083 54.2799 41.7058 177.1187 71 G 3.1193 8.5086 108.7868 44.8200 0.0000 172.9004 72 L 4.7009 7.9450 120.1453 53.1457 42.9225 176.2021 73 L 4.9973 8.3299 122.9464 55.3386 42.7011 175.5501 74 Y 4.9421 8.9455 119.3724 56.2095 42.0311 173.3115 75 G 4.3022 8.8597 108.3142 45.1118 0.0000 173.2553 76 S 5.0823 9.0321 120.7301 56.7527 64.0747 175.3073 77 Q 4.1872 9.0395 124.9723 58.1032 28.9391 176.3677 78 T 4.7222 7.6509 106.4503 59.0596 71.6258 172.6583 79 P 3.9382 0.0000 0.0000 60.9782 30.0816 174.6914 80 N 5.0793 7.6384 125.5788 51.4440 40.1918 175.6385 81 E 3.8796 8.7486 114.8318 59.6957 29.2145 177.5314 82 E 4.1624 8.9992 118.1670 57.6006 29.7479 176.9905 83 C 5.1313 7.9221 115.7209 58.6756 29.4614 173.6220 84 L 4.2665 7.3614 120.4846 53.6146 42.8982 175.6574 85 F 5.1449 8.9149 121.6455 55.5526 43.4681 174.2493 86 L 4.8221 9.1929 122.5674 53.8097 42.7761 175.3294 87 E 4.5773 8.8520 126.6414 55.0097 30.4782 175.5451 88 R 4.8166 8.5591 125.3150 54.0201 34.7667 174.5795 89 L 4.7132 8.6984 124.0578 55.2461 43.1537 175.8319 90 E 4.7043 9.1344 125.0453 55.2516 33.6458 174.8248 91 E 4.0021 9.7826 123.3795 57.6244 27.3178 174.2803 92 N 4.3128 8.4890 110.7744 54.1540 36.4836 173.8986 93 H 4.7838 8.3224 117.4056 57.5100 37.7854 173.5783 94 Y 4.6979 7.7291 116.1801 57.5427 40.0094 173.6054 95 N 5.5449 9.8155 118.4774 51.9418 41.1655 174.6043 96 T 5.2586 8.8876 113.0161 60.1845 72.7949 172.8449 97 Y 4.9730 8.5788 118.8624 56.6582 41.6390 174.1442 98 I 4.5724 8.5662 126.1092 59.1874 39.4756 175.5745 99 S 3.9141 8.8230 122.1804 58.6897 62.3884 174.1436 100 K 3.9720 8.7013 129.1535 59.3270 32.3239 178.6756 101 K 3.7747 7.9177 118.3871 59.1285 32.2591 176.8380 102 H 4.8074 8.2116 114.4865 54.2976 29.4690 176.5583 103 A 3.9991 7.7425 125.5229 55.1333 18.6321 180.8330 104 E 3.8111 7.9654 113.3263 58.6948 29.8278 178.3245 105 K 4.0953 7.4833 117.1286 55.7953 32.6311 175.9624 106 N 3.9786 7.5498 115.7614 53.9390 36.5904 174.5267 107 W 5.0400 7.7425 117.3388 55.8470 30.9810 177.0787 108 F 5.4070 9.0751 123.6573 55.3414 41.2238 175.6503 109 V 3.8876 9.0104 122.2169 63.1417 32.3522 175.2416 110 G 4.3947 8.6101 112.9669 45.2583 0.0000 171.4533 111 L 5.3386 8.2546 121.3936 52.5644 44.9486 176.7697 112 N 4.6066 9.2273 120.9924 52.3484 39.4593 176.3895 113 K 3.8690 8.5119 118.9623 59.6642 32.0603 177.9863 114 N 4.5813 8.0345 113.1779 52.8645 37.6815 175.8304 115 G 3.5806 8.2192 109.5568 45.0724 0.0000 173.8824 116 S 4.6444 8.0220 114.8264 57.6252 64.7116 173.4693 117 C 4.5310 8.6010 122.1474 59.8623 32.1486 172.8582 118 K 4.4228 8.7520 126.2923 54.6263 32.6252 176.9117 119 R 3.9526 8.7074 124.7054 56.2415 31.0238 177.7538 120 G 3.3803 8.6116 111.8076 48.2877 0.0000 174.2176 121 P 4.4106 0.0000 0.0000 64.4814 31.3707 177.3225 122 R 4.3610 7.8047 115.7320 56.3154 30.5812 176.4102 123 T 5.0263 7.5376 108.1696 60.1225 70.5970 173.5257 124 H 4.7659 7.9456 115.2329 54.8965 30.6088 173.0020 125 Y 4.0219 8.7610 118.3859 60.0544 38.0977 177.2695 126 G 4.0411 9.0262 111.3461 45.4462 0.0000 173.9585 127 Q 4.1985 7.4148 118.7024 55.3766 29.7979 176.9983 128 K 3.8773 8.2352 118.3484 58.2871 32.9176 179.3924 129 A 3.9153 7.7357 121.7177 54.4056 18.3717 178.4998 130 I 4.4183 7.1658 106.2523 60.5875 38.5639 175.3471 131 L 4.3676 7.2628 123.0863 53.9275 42.5733 175.7729 132 F 5.4539 9.4564 122.7380 55.4829 43.2971 174.0330 133 L 5.2564 9.1918 123.2454 52.6027 44.8867 173.8968 134 P 5.1002 0.0000 0.0000 62.9817 32.3999 175.6515 135 L 5.0905 9.1808 122.3285 51.9827 46.0413 174.4090 136 P 4.6223 0.0000 0.0000 62.8277 32.2838 176.7242 137 V 3.7386 8.1611 113.0891 61.8392 31.5782 176.3147 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 1B H 8.44 4.71 0.00 3.04 3.34 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 1C H 8.10 4.17 0.00 3.20 3.37 0.00 5.74 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 9.49 4.81 0.00 3.05 3.18 0.00 5.64 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.69 5.09 0.00 3.15 3.31 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.88 4.66 0.00 3.34 3.42 0.00 5.66 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.39 4.87 0.00 2.92 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 2 N 8.58 4.63 0.00 2.96 2.79 0.00 0.00 6.85 6.74 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 3 L 8.08 4.81 0.00 1.47 1.40 0.60 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.48 0.00 2.17 2.15 0.00 3.69 0.00 0.00 3.61 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 5 P 0.00 4.43 0.00 2.17 2.08 0.00 3.70 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 1.94 1.93 0.00 6 G 9.14 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 0.00 0.00 0.00 7 N 7.84 4.35 0.00 2.55 2.60 0.00 0.00 5.91 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Y 7.92 4.93 0.00 3.05 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.61 4.13 0.00 1.82 1.90 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.57 7.81 10 K 7.60 4.74 0.00 1.71 1.69 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.39 7.81 11 P 0.00 4.84 0.00 2.06 2.05 0.00 3.77 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 12 K 9.17 4.78 0.00 1.96 1.96 0.00 1.42 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.38 1.48 7.81 13 L 9.14 5.05 0.00 1.72 1.71 0.40 0.62 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 14 L 8.61 5.03 0.00 1.55 1.60 0.38 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.25 4.84 0.00 3.24 3.15 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 16 C 8.56 4.07 0.00 2.49 2.43 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 17 S 8.02 3.88 0.00 3.80 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 18 N 8.00 4.17 0.00 2.56 2.73 0.00 0.00 6.83 7.98 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 19 G 7.81 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 0.00 0.00 0.00 20 G 7.70 3.41 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 21 H 7.47 4.85 0.00 3.04 3.19 0.00 5.81 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.94 5.19 0.00 3.05 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 L 9.16 4.63 0.00 1.84 1.53 0.96 0.57 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 24 R 9.34 4.92 0.00 1.92 2.04 0.00 3.29 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.79 0.00 25 I 8.29 4.42 1.83 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.73 0.88 0.00 0.00 26 L 8.80 4.09 0.00 1.77 1.52 0.92 1.21 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 27 P 0.00 4.24 0.00 1.99 2.11 0.00 3.52 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.89 0.00 28 D 7.96 4.49 0.00 2.79 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 29 G 8.68 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 0.00 0.00 0.00 30 T 8.34 4.36 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 1.34 0.00 0.00 31 V 8.02 4.83 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 0.93 0.00 0.00 32 D 8.43 4.58 0.00 2.88 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 33 G 8.60 4.58 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 0.00 0.00 0.00 34 T 8.84 5.00 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 1.37 0.00 0.00 35 R 8.87 4.31 0.00 1.89 1.99 0.00 3.22 0.00 0.00 3.07 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.56 0.00 36 D 8.34 4.56 0.00 2.75 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.60 3.71 0.00 1.90 1.91 0.00 3.25 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.12 0.00 38 S 8.31 4.43 0.00 3.98 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 39 D 7.78 4.37 0.00 2.81 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 40 Q 8.51 4.33 0.00 1.88 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.14 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 41 H 9.14 4.88 0.00 3.31 3.46 0.00 5.78 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.03 4.53 1.90 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.91 1.05 0.00 0.00 43 Q 7.86 4.22 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 44 L 8.87 5.17 0.00 1.59 1.44 0.81 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 9.25 4.81 0.00 2.09 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 46 L 8.56 5.10 0.00 1.65 1.24 0.90 1.04 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 47 S 8.47 4.58 0.00 3.92 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 48 A 8.49 4.70 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.83 4.20 0.00 1.71 1.50 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 2.16 2.33 0.00 50 S 5.81 4.56 0.00 4.30 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 51 V 8.21 3.83 2.33 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 0.95 0.00 0.00 1.04 0.00 0.00 52 G 9.22 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 53 E 8.26 5.16 0.00 2.08 1.70 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 2.21 2.29 0.00 54 V 8.88 4.85 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 1.15 0.00 0.00 55 Y 8.83 5.19 0.00 2.99 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.58 4.58 1.72 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 0.94 0.55 0.68 0.00 0.00 57 K 8.68 4.63 0.00 1.38 1.51 0.00 1.25 0.00 0.00 1.18 0.00 0.00 2.68 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.92 0.33 7.81 58 S 8.85 4.45 0.00 3.82 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.62 3.89 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 1.17 0.00 0.00 60 E 8.36 4.05 0.00 1.98 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 2.14 2.36 0.00 61 T 8.01 4.28 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 1.24 0.00 0.00 62 G 8.10 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 63 Q 7.51 4.42 0.00 1.92 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.73 0.00 0.00 0.00 0.00 0.00 2.53 2.32 0.00 64 Y 8.80 4.68 0.00 2.94 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 65 L 9.05 4.38 0.00 1.60 1.49 0.79 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.77 5.08 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.75 5.33 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.67 0.00 68 D 9.54 5.26 0.00 2.98 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 69 T 8.49 4.33 4.37 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 1.34 0.00 0.00 70 D 8.42 4.63 0.00 2.81 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.51 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 0.00 0.00 0.00 72 L 7.94 4.70 0.00 2.04 1.62 0.88 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.33 5.00 0.00 1.56 1.61 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 8.95 4.94 0.00 2.99 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 75 G 8.86 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 0.00 0.00 0.00 0.00 76 S 9.03 5.08 0.00 3.70 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 Q 9.04 4.19 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 78 T 7.65 4.72 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 1.22 0.00 0.00 79 P 0.00 3.94 0.00 0.70 0.49 0.00 3.47 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.29 0.00 80 N 7.64 5.08 0.00 2.94 2.98 0.00 0.00 5.86 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 81 E 8.75 3.88 0.00 2.04 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 0.00 2.28 2.33 0.00 82 E 9.00 4.16 0.00 2.18 2.28 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 2.38 2.46 0.00 83 C 7.92 5.13 0.00 3.10 3.25 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 84 L 7.36 4.27 0.00 1.32 1.29 0.78 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.91 5.14 0.00 3.11 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 86 L 9.19 4.82 0.00 1.51 1.58 0.87 0.99 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 E 8.85 4.58 0.00 2.12 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 2.16 1.88 0.00 88 R 8.56 4.82 0.00 1.76 1.79 0.00 3.15 0.00 0.00 2.87 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.61 0.00 89 L 8.70 4.71 0.00 1.60 1.69 1.02 0.98 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 90 E 9.13 4.70 0.00 2.22 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 2.30 2.44 0.00 91 E 9.78 4.00 0.00 2.43 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 0.00 2.30 2.41 0.00 92 N 8.49 4.31 0.00 2.85 2.89 0.00 0.00 6.87 8.16 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 93 H 8.32 4.78 0.00 2.86 2.90 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.73 4.70 0.00 3.01 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 95 N 9.82 5.54 0.00 3.00 2.49 0.00 0.00 6.97 7.49 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 96 T 8.89 5.26 4.56 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 1.37 0.00 0.00 97 Y 8.58 4.97 0.00 2.77 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 98 I 8.57 4.57 1.65 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.45 0.63 0.00 0.00 99 S 8.82 3.91 0.00 4.06 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 0.00 100 K 8.70 3.97 0.00 1.68 1.65 0.00 1.70 0.00 0.00 1.46 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.30 7.81 101 K 7.92 3.77 0.00 1.74 1.62 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.95 1.29 7.81 102 H 8.21 4.81 0.00 3.21 2.50 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.74 4.00 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 0.00 104 E 7.97 3.81 0.00 1.84 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 2.15 2.11 0.00 105 K 7.48 4.10 0.00 0.79 1.08 0.00 0.61 0.00 0.00 0.62 0.00 0.00 2.46 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.02 0.85 7.81 106 N 7.55 3.98 0.00 3.00 3.04 0.00 0.00 6.90 7.63 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 0.00 107 W 7.74 5.04 0.00 3.26 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 0.00 108 F 9.08 5.41 0.00 2.87 3.02 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 0.00 109 V 9.01 3.89 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 0.62 0.00 0.00 0.45 0.00 0.00 110 G 8.61 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 0.00 111 L 8.25 5.34 0.00 1.40 1.46 0.99 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 112 N 9.23 4.61 0.00 2.86 2.70 0.00 0.00 6.79 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 0.00 113 K 8.51 3.87 0.00 1.71 1.85 0.00 1.70 0.00 0.00 1.91 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.34 7.81 114 N 8.03 4.58 0.00 2.79 2.90 0.00 0.00 6.23 7.00 0.00 0.00 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 G 8.22 3.58 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 0.00 0.00 0.00 116 S 8.02 4.64 0.00 3.90 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 C 8.60 4.53 0.00 3.01 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 0.00 118 K 8.75 4.42 0.00 1.73 1.70 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.56 1.28 7.81 119 R 8.71 3.95 0.00 1.71 1.62 0.00 3.05 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 1.63 1.57 0.00 120 G 8.61 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 0.00 0.00 0.00 121 P 0.00 4.41 0.00 1.94 2.20 0.00 3.05 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 122 R 7.80 4.36 0.00 1.84 1.93 0.00 3.30 0.00 0.00 3.27 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 123 T 7.54 5.03 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 1.41 0.00 0.00 124 H 7.95 4.77 0.00 3.44 3.52 0.00 5.67 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.76 4.02 0.00 3.16 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 0.00 126 G 9.03 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 0.00 127 Q 7.41 4.20 0.00 1.80 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.69 0.00 0.00 0.00 0.00 0.00 2.17 2.05 0.00 128 K 8.24 3.88 0.00 1.74 1.63 0.00 1.50 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.26 7.81 129 A 7.74 3.92 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 7.17 4.42 1.61 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 1.24 1.01 0.49 0.00 0.00 131 L 7.26 4.37 0.00 1.00 0.64 0.38 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.46 5.45 0.00 3.38 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 0.00 133 L 9.19 5.26 0.00 2.07 1.81 0.83 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.10 0.00 2.22 2.19 0.00 3.88 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 135 L 9.18 5.09 0.00 1.68 1.60 0.97 0.84 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 0.00 136 P 0.00 4.62 0.00 2.06 2.06 0.00 3.78 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 2.01 0.00 137 V 8.16 3.74 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 0.64 0.00 0.00 0.91 0.00 0.00