NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4158 8.2649 123.5883 51.5729 20.9221 175.9270 2 K 4.2992 7.4955 113.8840 54.2941 34.7801 174.3881 3 K 4.0671 8.5703 124.4759 56.8112 32.2245 177.5601 4 V 3.8019 8.3457 126.9117 61.8383 31.4986 175.5521 5 Q 4.4926 8.6004 124.8730 53.2268 31.9064 174.1314 6 A 4.1357 8.2997 121.5695 52.7153 18.8777 176.0699 7 Y 5.0458 7.7682 118.2455 56.7592 41.4311 174.4962 8 V 4.6763 9.0679 113.6383 59.3290 35.1014 174.9362 9 K 5.1751 8.3539 123.0570 55.2627 35.0751 175.1164 10 L 4.4879 8.4120 120.6080 55.0368 44.1916 173.6260 11 Q 4.8742 8.7428 119.4296 55.0552 29.8131 174.9455 12 V 4.5245 8.0553 117.0788 58.7336 34.8711 175.7398 13 A 4.2942 8.7774 125.8364 52.0889 18.3745 176.7534 14 A 3.9301 8.2288 121.1727 53.6212 18.7173 179.2113 15 G 3.9479 7.6163 107.6916 41.0000 0.0000 171.7738 16 M 4.1720 7.7394 119.5516 55.7666 35.1041 173.8081 17 A 4.2393 8.5110 126.9706 52.2341 21.8668 175.0430 18 N 4.6316 9.0468 116.9712 52.8136 38.1589 172.9024 19 P 4.3550 0.0000 0.0000 62.7458 31.9629 176.6046 20 S 4.0062 8.7476 116.9641 61.3053 62.5316 173.4792 21 P 4.3590 0.0000 0.0000 65.3833 31.0474 175.9923 22 P 4.4341 0.0000 0.0000 65.1226 33.0412 178.0906 23 V 4.2381 7.8141 107.0608 60.0379 32.9833 181.9594 24 G 3.8900 9.5388 121.9319 46.5347 0.0000 173.1999 25 P 4.1182 0.0000 0.0000 66.0587 31.1982 175.9011 26 A 3.9282 7.8919 118.3573 55.1970 18.5434 178.8100 27 L 4.2498 7.5593 115.7303 56.6922 41.3802 179.0049 28 G 3.6292 8.5244 107.7584 47.9217 0.0000 175.6881 29 Q 4.0170 7.5699 119.7104 58.9945 28.8014 178.6114 30 Q 4.1590 7.6649 117.4699 57.2438 28.6427 177.3381 31 G 4.0028 7.6744 108.1229 45.3651 0.0000 173.9367 32 V 3.8742 7.4235 117.9024 62.5063 32.3065 176.7529 33 N 4.8349 8.8614 123.1587 51.3292 37.1382 175.6886 34 I 3.7140 8.0429 125.8471 64.6945 37.1526 176.6835 35 M 4.0110 8.2253 118.0158 58.8653 31.8685 177.7265 36 E 4.0332 8.2874 118.5809 59.2408 29.7040 178.2917 37 F 4.3651 8.7565 120.9535 61.4593 39.3729 176.4543 38 C 4.0154 8.4640 114.6217 61.6226 28.9214 175.9934 39 K 3.9776 7.8615 121.4995 58.6227 31.6622 178.7632 40 A 4.1123 8.3451 121.6880 55.3147 18.3702 179.0004 41 F 4.1829 8.8906 120.2724 61.3882 39.4693 176.8220 42 N 3.9935 8.2140 115.7803 56.3302 38.1588 176.9061 43 A 4.0107 7.3667 121.2798 55.3490 18.7999 179.2477 44 K 4.0382 7.7244 116.4948 59.0263 32.3257 179.2757 45 T 3.6531 7.6311 116.3867 66.3640 67.9193 176.1995 46 D 4.2791 7.5245 119.7524 57.2914 40.9149 178.5476 47 S 4.1807 7.8015 111.7707 61.4495 62.6330 175.5055 48 I 3.8063 7.5185 121.2644 61.1659 37.2669 176.0694 49 E 5.0832 7.3247 115.9980 55.9926 32.3695 176.1817 50 K 4.4788 8.8071 122.2512 55.7484 34.3719 176.7757 51 G 3.9656 9.0144 109.7509 45.0283 0.0000 173.2442 52 L 4.6240 7.3737 119.0826 51.8587 43.5226 174.1884 53 P 4.3851 0.0000 0.0000 63.1960 31.8244 175.7462 54 I 4.6703 8.2225 125.9013 58.6204 39.1556 173.8422 55 P 4.7961 0.0000 0.0000 62.5870 32.7001 175.5947 56 V 4.8454 9.0913 123.9016 59.8352 35.1446 175.0188 57 V 4.1702 8.0960 121.9436 61.3828 32.7369 174.2877 58 I 4.4172 8.4537 130.2084 61.0920 38.4732 175.3386 59 T 4.7371 9.3459 125.2403 61.8579 70.1486 173.7238 60 V 4.4178 7.7911 126.3722 62.1893 31.9998 175.0354 61 Y 4.8452 8.5287 124.1298 55.8867 40.6488 176.6171 62 A 4.2516 8.6170 122.2742 55.7038 18.7540 178.6394 63 D 4.4806 7.9722 112.2337 54.2064 40.4762 176.7473 64 R 3.7648 7.8726 112.4342 57.0054 29.2989 175.9580 65 S 4.7371 7.9730 113.9913 58.6974 64.6691 172.0975 66 F 5.5579 7.6738 113.4242 57.7228 40.0587 172.4890 67 T 5.2817 8.2145 113.3574 61.0534 71.5458 171.8518 68 F 5.9084 8.3565 116.5514 56.6203 40.3644 173.4284 69 V 4.2641 8.4861 121.5272 61.5613 33.7042 174.2973 70 T 4.5646 8.6092 125.1727 62.9296 69.0254 174.5457 71 K 4.5377 7.9284 128.6885 55.0975 34.3127 176.5606 72 T 4.3777 8.6237 109.8032 60.5266 69.8729 172.5761 73 P 4.3593 0.0000 0.0000 61.9190 32.2944 174.9884 74 P 4.3523 0.0000 0.0000 63.1419 33.3583 177.5388 75 A 4.0682 8.5399 120.9945 54.9771 18.3758 180.2180 76 A 3.9435 7.8945 119.2057 55.4774 18.5855 180.1423 77 V 3.6155 7.7076 110.5031 64.5409 31.7294 178.7103 78 L 4.0654 7.9038 118.3977 57.6536 41.3663 179.5163 79 L 4.1020 7.9537 118.9598 57.3294 41.5649 179.5901 80 K 3.9991 7.9852 118.9680 59.2666 32.1529 179.5354 81 K 4.0039 8.0935 118.9631 59.9402 32.3707 179.1017 82 A 3.9903 7.9100 120.9154 54.7215 18.3916 179.0395 83 A 4.1908 8.3762 118.3336 52.8444 18.6917 178.7512 84 G 3.8251 7.7019 104.5886 45.6055 0.0000 173.3983 85 I 4.3700 7.4338 112.6594 59.2572 39.6512 175.7139 86 K 4.2447 8.5127 119.4295 57.7810 32.7795 176.6369 87 S 4.8154 7.6067 111.5396 56.0515 66.8027 173.7174 88 G 3.8995 8.2065 109.2373 45.6945 0.0000 172.7928 89 S 4.2212 7.9890 112.2620 58.7898 62.8848 175.2005 90 G 4.3536 8.9442 108.8353 45.0108 0.0000 173.7350 91 K 4.6141 7.2442 116.4604 54.0268 32.4823 173.5982 92 P 4.2612 0.0000 0.0000 64.5061 32.6423 177.8671 93 N 4.3760 8.9883 122.2367 54.6709 37.7906 176.2831 94 K 4.0842 8.8126 116.9874 58.7821 32.2539 176.6794 95 D 4.7640 7.7474 115.9437 52.0731 43.5150 174.8357 96 K 4.4627 8.6395 126.2964 55.9247 32.8009 176.7821 97 V 3.9215 8.1489 124.8914 65.1757 32.4929 175.3530 98 G 4.3406 7.6369 105.8121 45.3631 0.0000 171.7156 99 K 5.1662 8.3870 117.5903 55.4104 36.1257 175.8909 100 I 4.7989 8.9467 121.6348 59.4298 41.6240 175.4556 101 S 4.6752 8.5582 120.4405 57.8452 63.9458 175.3853 102 R 3.9173 8.5801 122.3002 59.3652 29.5963 179.0133 103 A 3.9841 7.9187 120.3273 55.3224 18.4929 179.4144 104 Q 4.5082 7.8615 117.4943 58.5760 28.7478 178.7871 105 L 3.9909 7.9947 119.5717 57.9671 41.5657 179.2937 106 Q 3.9390 7.9537 118.6749 59.1605 29.1445 177.8277 107 E 4.7786 7.9034 120.8853 59.2462 29.6246 179.5328 108 I 3.7255 8.2482 119.6185 64.4471 36.9026 178.4346 109 A 4.0614 7.9028 120.8280 54.9905 18.4932 179.5267 110 Q 4.0806 8.2510 117.0196 59.3545 28.6129 178.7902 111 T 3.8775 7.7783 115.4812 66.6018 68.8433 176.2183 112 K 4.3026 8.3850 119.0468 56.0934 32.0808 178.4510 113 A 3.9389 7.5445 121.3385 55.4356 18.2035 179.3073 114 A 4.0795 7.9117 117.6873 55.4112 18.6704 178.9332 115 D 4.5096 7.9443 114.6534 55.3465 41.6581 177.0666 116 M 4.3500 7.5292 119.4365 55.2430 32.5996 176.3928 117 T 4.3024 8.3237 110.5137 61.3538 69.9332 175.3099 118 G 3.7954 8.1231 110.9395 46.3994 0.0000 173.4581 119 A 4.1093 8.7050 127.0639 54.3033 19.0998 177.1711 120 D 5.0468 7.6008 113.4826 51.6718 46.1306 176.8461 121 I 3.7376 8.1441 120.6564 64.6706 37.0458 178.5128 122 E 3.9386 8.2164 118.7247 59.4252 29.3671 178.7571 123 A 3.9746 8.0480 120.3676 55.5765 18.4900 179.1620 124 M 3.9951 8.0356 114.5154 58.9823 31.0686 178.8945 125 T 3.8648 7.9490 116.4911 66.5513 68.4321 176.7582 126 R 4.8051 7.7069 119.9833 58.9487 30.1972 179.0434 127 S 4.2812 7.9845 114.8605 61.6847 62.9070 176.7740 128 I 3.7490 7.8400 122.4734 64.3043 36.6937 178.2932 129 E 4.0953 8.2705 119.7848 59.3873 29.0556 179.5544 130 G 3.6521 7.6387 105.1081 47.9031 0.0000 175.5473 131 T 4.0443 7.7705 111.3715 64.5151 68.9118 176.5152 132 A 3.9861 7.8539 123.2115 55.0627 18.2663 179.7954 133 R 3.8662 7.9819 115.2623 59.4442 30.1700 178.9487 134 S 4.4406 7.6480 113.1064 59.8805 62.7419 175.2654 135 M 4.6027 7.6726 118.4414 54.2570 31.2838 176.1381 136 G 3.5896 8.0464 107.0473 46.9281 0.0000 173.0404 137 L 5.1632 7.8749 120.2142 51.7124 43.2402 177.0119 138 V 3.9966 8.3287 124.2163 62.5983 33.2929 174.8022 139 V 5.4651 8.1560 117.3812 58.8632 34.3954 174.7082 140 E 4.4171 8.7044 126.1746 54.7994 31.0503 175.5891 141 D 4.5235 8.6079 126.0788 54.5788 41.1152 176.4767 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 A 8.26 4.42 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 2 K 7.50 4.30 0.00 1.81 1.72 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.50 7.81 3 K 8.57 4.07 0.00 1.75 1.81 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.46 7.81 4 V 8.35 3.80 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.89 0.00 0.00 5 Q 8.60 4.49 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.12 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 6 A 8.30 4.14 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 7.77 5.05 0.00 3.02 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 9.07 4.68 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.73 0.00 0.00 9 K 8.35 5.18 0.00 1.77 1.91 0.00 1.66 0.00 0.00 1.87 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.42 7.81 10 L 8.41 4.49 0.00 1.70 1.68 0.79 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.74 4.87 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.81 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 12 V 8.06 4.52 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 0.74 0.00 0.00 0.21 0.00 0.00 13 A 8.78 4.29 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 14 A 8.23 3.93 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 15 G 7.62 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 16 M 7.74 4.17 0.00 2.00 1.95 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 17 A 8.51 4.24 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 18 N 9.05 4.63 0.00 2.73 3.31 0.00 0.00 6.93 7.69 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 19 P 0.00 4.35 0.00 2.25 2.16 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.95 0.00 20 S 8.75 4.01 0.00 3.84 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 21 P 0.00 4.36 0.00 2.07 2.10 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 22 P 0.00 4.43 0.00 2.02 2.07 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 2.02 2.10 0.00 23 V 7.81 4.24 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 0.73 0.00 0.00 0.99 0.00 0.00 24 G 9.54 3.89 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 0.00 0.00 0.00 25 P 0.00 4.12 0.00 2.14 2.12 0.00 3.99 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 26 A 7.89 3.93 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 27 L 7.56 4.25 0.00 1.59 1.67 0.26 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.52 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 7.57 4.02 0.00 1.94 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.94 0.00 0.00 0.00 0.00 0.00 2.70 2.51 0.00 30 Q 7.66 4.16 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.99 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 31 G 7.67 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 7.42 3.87 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 -0.00 0.00 0.00 0.69 0.00 0.00 33 N 8.86 4.83 0.00 3.21 2.93 0.00 0.00 6.90 7.43 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 34 I 8.04 3.71 1.90 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.89 0.98 0.00 0.00 35 M 8.23 4.01 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 36 E 8.29 4.03 0.00 2.18 2.36 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 2.51 2.43 0.00 37 F 8.76 4.37 0.00 2.94 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 38 C 8.46 4.02 0.00 3.13 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 39 K 7.86 3.98 0.00 1.88 1.88 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.46 7.81 40 A 8.35 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.89 4.18 0.00 1.51 2.46 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 42 N 8.21 3.99 0.00 2.69 2.83 0.00 0.00 7.03 8.75 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 43 A 7.37 4.01 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 K 7.72 4.04 0.00 1.93 1.76 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.42 7.81 45 T 7.63 3.65 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 46 D 7.52 4.28 0.00 2.60 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 47 S 7.80 4.18 0.00 3.82 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 48 I 7.52 3.81 1.94 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 1.54 0.84 0.90 0.00 0.00 49 E 7.32 5.08 0.00 2.03 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 2.04 2.06 0.00 50 K 8.81 4.48 0.00 1.73 1.74 0.00 1.85 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.38 1.55 7.81 51 G 9.01 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 52 L 7.37 4.62 0.00 1.61 1.61 0.96 1.12 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 53 P 0.00 4.39 0.00 1.96 2.05 0.00 3.65 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 2.05 2.15 0.00 54 I 8.22 4.67 2.13 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.95 1.08 0.00 0.00 55 P 0.00 4.80 0.00 2.15 2.21 0.00 3.76 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 2.12 2.00 0.00 56 V 9.09 4.85 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 0.67 0.00 0.00 1.39 0.00 0.00 57 V 8.10 4.17 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 0.32 0.00 0.00 0.86 0.00 0.00 58 I 8.45 4.42 1.60 0.00 0.00 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 -0.24 -0.36 0.33 0.00 0.00 59 T 9.35 4.74 4.12 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 1.11 0.00 0.00 60 V 7.79 4.42 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 0.82 0.00 0.00 0.84 0.00 0.00 61 Y 8.53 4.85 0.00 3.08 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 62 A 8.62 4.25 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 63 D 7.97 4.48 0.00 2.79 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 R 7.87 3.76 0.00 2.27 2.09 0.00 3.18 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 65 S 7.97 4.74 0.00 4.03 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 66 F 7.67 5.56 0.00 2.96 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 67 T 8.21 5.28 4.48 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 1.34 0.00 0.00 68 F 8.36 5.91 0.00 3.26 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 69 V 8.49 4.26 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 0.99 0.00 0.00 0.90 0.00 0.00 70 T 8.61 4.56 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 71 K 7.93 4.54 0.00 1.83 2.15 0.00 1.71 0.00 0.00 1.91 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.39 7.81 72 T 8.62 4.38 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 1.26 0.00 0.00 73 P 0.00 4.36 0.00 2.22 2.20 0.00 3.82 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 74 P 0.00 4.35 0.00 2.19 2.05 0.00 3.62 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 75 A 8.54 4.07 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 76 A 7.89 3.94 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 77 V 7.71 3.62 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 1.00 0.00 0.00 78 L 7.90 4.07 0.00 1.74 1.72 0.97 0.40 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 79 L 7.95 4.10 0.00 1.90 1.71 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 80 K 7.99 4.00 0.00 2.01 2.02 0.00 1.87 0.00 0.00 1.70 0.00 0.00 3.18 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.78 7.81 81 K 8.09 4.00 0.00 2.01 2.07 0.00 1.32 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.60 1.60 7.81 82 A 7.91 3.99 1.42 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 0.00 0.00 83 A 8.38 4.19 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 84 G 7.70 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 85 I 7.43 4.37 1.87 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 1.41 0.71 0.91 0.00 0.00 86 K 8.51 4.24 0.00 1.76 1.89 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.44 7.81 87 S 7.61 4.82 0.00 3.80 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.21 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 89 S 7.99 4.22 0.00 3.98 3.89 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 90 G 8.94 4.35 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 0.00 91 K 7.24 4.61 0.00 1.88 1.90 0.00 1.55 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.43 7.81 92 P 0.00 4.26 0.00 2.19 2.25 0.00 3.71 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 2.16 2.14 0.00 93 N 8.99 4.38 0.00 2.88 2.98 0.00 0.00 7.01 7.61 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 94 K 8.81 4.08 0.00 1.94 1.87 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.53 7.81 95 D 7.75 4.76 0.00 2.59 2.50 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 96 K 8.64 4.46 0.00 1.76 1.74 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.48 7.81 97 V 8.15 3.92 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 0.72 0.00 0.00 1.01 0.00 0.00 98 G 7.64 4.34 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 0.00 99 K 8.39 5.17 0.00 1.77 1.73 0.00 1.52 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.29 1.46 7.81 100 I 8.95 4.80 1.87 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 1.29 1.04 0.98 0.00 0.00 101 S 8.56 4.68 0.00 4.08 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 0.00 102 R 8.58 3.92 0.00 2.13 1.98 0.00 3.10 0.00 0.00 3.35 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 103 A 7.92 3.98 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 0.00 104 Q 7.86 4.51 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.69 0.00 0.00 0.00 0.00 0.00 2.55 2.26 0.00 105 L 7.99 3.99 0.00 1.87 1.74 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.95 3.94 0.00 2.15 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 107 E 7.90 4.78 0.00 2.22 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 2.34 2.42 0.00 108 I 8.25 3.73 2.00 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 1.46 1.12 0.92 0.00 0.00 109 A 7.90 4.06 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 0.00 110 Q 8.25 4.08 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.70 0.00 111 T 7.78 3.88 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 1.22 0.00 0.00 112 K 8.38 4.30 0.00 1.82 1.84 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.41 7.81 113 A 7.54 3.94 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 0.00 114 A 7.91 4.08 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 0.00 115 D 7.94 4.51 0.00 2.67 2.74 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 0.00 0.00 0.00 0.00 116 M 7.53 4.35 0.00 2.00 1.99 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 2.48 0.00 117 T 8.32 4.30 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 0.00 118 G 8.12 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 8.70 4.11 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 0.00 120 D 7.60 5.05 0.00 2.64 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 0.00 121 I 8.14 3.74 1.87 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 1.64 0.54 0.91 0.00 0.00 122 E 8.22 3.94 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 2.45 0.00 123 A 8.05 3.97 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 0.00 124 M 8.04 4.00 0.00 2.30 2.36 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.79 0.00 125 T 7.95 3.86 4.42 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 1.21 0.00 0.00 126 R 7.71 4.81 0.00 1.91 2.00 0.00 3.13 0.00 0.00 3.08 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 127 S 7.98 4.28 0.00 4.09 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 0.00 128 I 7.84 3.75 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 1.85 1.20 0.92 0.00 0.00 129 E 8.27 4.10 0.00 2.26 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 2.33 2.64 0.00 130 G 7.64 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 0.00 0.00 0.00 131 T 7.77 4.04 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 1.25 0.00 0.00 132 A 7.85 3.99 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 0.00 133 R 7.98 3.87 0.00 1.93 2.02 0.00 3.16 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.83 0.00 134 S 7.65 4.44 0.00 4.00 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 0.00 135 M 7.67 4.60 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.78 0.00 136 G 8.05 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 7.87 5.16 0.00 1.51 1.61 0.95 0.84 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 0.00 138 V 8.33 4.00 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 0.88 0.00 0.00 0.93 0.00 0.00 139 V 8.16 5.47 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 0.88 0.00 0.00 0.93 0.00 0.00 140 E 8.70 4.42 0.00 2.09 1.83 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 2.30 2.38 0.00 141 D 8.61 4.52 0.00 2.70 2.55 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 0.00 0.00 0.00 0.00