NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3517 0.0000 0.0000 61.7172 32.6793 175.8402 3 K 3.9849 8.6737 123.3352 55.3866 32.6497 175.2304 4 K 3.9339 9.1103 127.2057 57.1434 33.6117 175.0933 5 V 4.9586 8.4116 126.4573 61.1854 33.4864 174.3494 6 L 4.8905 9.0265 126.2658 53.2130 46.2807 175.3391 7 T 4.7894 8.1745 116.3559 62.2846 71.7748 173.8719 8 G 4.0740 8.5020 111.3757 45.8162 0.0000 171.6304 9 V 4.8720 7.7896 118.1410 60.8762 35.2507 176.2553 10 V 4.1690 8.5121 126.5077 62.7273 31.5468 176.4891 11 V 4.2373 8.6549 121.8070 61.6710 32.5250 176.5452 12 S 4.5184 7.6126 115.7729 56.8380 65.7475 173.6613 13 D 5.0282 8.6092 125.5932 54.0626 41.6009 176.2751 14 K 4.2232 7.8623 115.9786 57.1977 32.1804 176.5349 15 M 4.7236 7.6012 117.7774 53.1415 34.8222 174.9256 16 Q 4.3527 8.4313 118.9693 56.6679 29.6282 176.4721 17 K 4.6930 9.2377 119.1102 56.3512 30.1786 174.1751 18 T 5.1455 7.5856 112.9999 62.1271 72.5132 173.7484 19 V 4.6959 8.9768 116.6422 60.1596 36.9300 174.8005 20 T 4.8740 8.6499 119.9761 62.3378 69.9847 173.7996 21 V 4.4859 8.8919 128.1525 61.4695 33.1682 174.7583 22 L 4.7855 9.1330 131.9008 53.5329 42.2804 173.8914 23 V 4.2772 8.5558 125.4143 62.2144 32.4829 174.5698 24 E 4.8103 8.7455 128.9753 55.6420 31.1205 174.9341 25 R 4.8571 8.6824 123.0705 55.1975 34.1109 173.5761 26 Q 4.9351 8.8028 121.7801 53.8595 33.2775 174.0488 27 F 4.8208 7.5646 116.0329 56.2226 41.5135 170.8571 28 P 4.9665 0.0000 0.0000 61.9743 32.5291 175.5718 29 H 4.2720 9.1400 124.5549 55.6965 30.2304 174.0616 30 P 4.3026 0.0000 0.0000 65.0295 31.1161 176.5353 31 L 4.3471 7.9900 118.3479 55.8826 43.9551 176.1439 32 Y 4.6391 7.7102 113.5116 56.8841 38.3239 178.1092 33 G 4.2965 8.2740 110.3340 46.8582 0.0000 174.8244 34 K 4.0247 8.1795 118.6841 57.1380 33.8002 176.8468 35 V 4.2353 8.3276 122.4403 62.8325 31.9213 175.4346 36 I 4.2620 8.1397 122.4071 59.3787 40.6292 174.8092 37 K 4.6482 8.0581 122.5502 54.3942 34.5033 175.1372 38 R 4.7729 8.4323 128.8925 55.4430 33.1098 174.2385 39 S 5.0895 8.1536 112.2415 57.3930 65.5439 174.0769 40 K 4.6128 8.8750 122.0378 54.7464 35.9730 174.7180 41 K 4.9526 8.3867 124.5852 55.0575 33.9528 175.2658 42 Y 4.6790 9.2641 122.4045 56.0929 41.2369 174.7340 43 L 5.0441 8.7294 123.0718 53.7212 42.8103 175.7536 44 A 5.1296 9.1242 126.5114 50.1757 22.1935 174.8450 45 H 4.7768 9.2052 121.6590 56.1794 31.1177 173.9973 46 D 5.0153 9.6646 127.0498 51.4732 40.5208 173.9476 47 P 4.1755 0.0000 0.0000 65.3697 32.0041 178.5054 48 E 4.0525 8.1777 115.4534 57.0259 29.4581 177.5690 49 E 4.0376 7.8436 116.4050 57.0305 27.2286 175.7780 50 K 3.7036 7.1702 119.1323 59.4759 32.5424 176.4531 51 Y 4.0577 7.3587 115.4518 58.3347 38.6897 176.4310 52 K 4.7392 9.1576 123.6232 53.7463 35.0382 175.1412 53 L 4.1850 8.4153 122.3044 58.4723 40.4652 176.4617 54 G 4.0032 8.5147 114.0968 45.5796 0.0000 172.9443 55 D 4.7025 8.3891 121.0126 54.3093 42.3547 175.4204 56 V 4.6991 8.5713 122.3949 61.7281 33.4032 175.2039 57 V 4.9614 8.7120 120.0030 59.7060 36.7143 173.9638 58 E 5.0290 9.0758 121.7196 55.0900 31.4913 175.6570 59 I 4.6745 9.3284 126.2617 59.9983 39.8018 174.6604 60 I 5.0541 8.4745 124.7188 58.8202 41.4053 174.0639 61 E 3.6156 9.3900 131.0645 57.0768 29.9408 175.9398 62 S 4.7431 7.9106 122.0246 56.5823 67.3053 173.3385 63 R 4.0820 8.4196 120.2430 55.1595 30.5153 174.2755 64 P 4.3599 0.0000 0.0000 63.5592 31.8519 175.9166 65 I 4.2565 8.0826 122.1559 62.3461 39.0881 175.3407 66 S 4.4979 7.3450 111.7360 56.9517 65.3565 173.3056 67 K 3.9593 8.4307 121.6716 57.3700 32.8398 176.2909 68 R 3.6685 8.4188 124.7291 55.1248 27.7117 176.5796 69 K 5.2565 6.6425 124.1203 56.7416 34.2804 173.6986 70 R 4.5400 7.7268 128.0399 55.2455 32.0784 174.5894 71 F 5.3473 8.2621 115.5463 56.0889 43.9568 173.8729 72 R 4.9203 8.7530 120.6188 54.0787 33.7654 175.4532 73 V 3.6142 7.9836 122.8882 63.0380 30.7236 175.6581 74 L 4.2398 9.0447 131.2412 57.0820 42.3392 176.7762 75 R 4.6039 7.4547 112.2133 55.6176 32.6159 172.1038 76 L 4.8929 8.6771 121.5915 54.3412 42.5525 175.8997 77 V 4.2333 8.7557 126.7541 64.6414 33.0882 176.2027 78 E 4.6630 7.6211 115.9809 55.5399 32.3870 175.8645 79 S 5.3078 8.6897 118.8466 57.2766 63.5870 174.7239 80 G 3.5907 8.1136 106.5101 45.7994 0.0000 175.1357 81 R 5.3238 7.0664 131.2183 55.9832 30.9086 174.7363 82 M 4.2228 7.4475 124.7926 57.9538 31.9831 177.0084 83 D 4.6202 8.2270 119.6967 56.3753 39.0307 178.6737 84 L 3.9544 7.6439 119.8964 57.4093 41.9827 178.9515 85 V 3.6727 7.8620 117.6346 66.2301 31.1727 177.3407 86 E 3.9330 8.7611 118.3689 59.6690 29.2920 179.0925 87 K 3.9417 7.5524 117.6163 60.0401 32.2339 178.2182 88 Y 4.1292 7.8860 118.7531 61.0019 38.5922 178.6570 89 L 3.5877 8.3283 119.8164 57.8356 41.6413 179.4628 90 I 3.5991 8.4267 120.4953 64.4598 36.7566 178.5110 91 R 3.8294 7.9052 119.0147 59.2264 29.7218 178.2591 92 R 3.1433 7.3323 118.5952 58.9201 30.0518 178.2979 93 Q 3.9369 8.0320 119.8575 59.1499 28.7986 177.9448 94 N 4.4593 7.8201 116.7697 56.3533 38.5871 176.5343 95 Y 4.3049 8.0385 117.8867 60.8999 37.6213 178.5047 96 Q 4.3167 7.4668 117.4454 56.4523 30.4834 175.4571 97 S 4.2248 10.6424 120.1781 57.4821 69.4476 177.5255 98 L 3.6313 8.2921 115.3782 57.0324 38.3738 174.1101 99 S 4.5009 7.5213 116.2126 59.9277 65.1802 175.0021 100 K 4.5935 7.8603 118.2800 54.3557 34.5534 176.4684 101 R 4.2478 9.2699 115.1927 53.6105 32.3961 174.8534 102 G 3.9821 8.2808 109.5347 44.2252 0.0000 172.8305 103 G 4.3613 8.3403 113.8540 44.9022 0.0000 172.9246 104 K 4.4117 7.8085 118.4156 55.0930 31.9649 176.3054 105 A 4.0990 8.6690 130.5648 54.0434 18.9923 176.3573 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 2 P 0.00 4.35 0.00 2.06 2.06 0.00 3.65 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 1.92 2.11 0.00 3 K 8.67 3.98 0.00 1.71 1.88 0.00 1.75 0.00 0.00 1.91 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.48 7.81 4 K 9.11 3.93 0.00 1.98 1.83 0.00 1.47 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.51 1.47 7.81 5 V 8.41 4.96 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 0.87 0.00 0.00 1.00 0.00 0.00 6 L 9.03 4.89 0.00 1.09 1.19 -0.14 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.17 4.79 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 8 G 8.50 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 9 V 7.79 4.87 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 0.96 0.00 0.00 0.91 0.00 0.00 10 V 8.51 4.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.99 0.00 0.00 11 V 8.65 4.24 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.31 0.00 0.00 12 S 7.61 4.52 0.00 3.89 3.64 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 13 D 8.61 5.03 0.00 2.65 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 7.86 4.22 0.00 1.78 1.86 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.43 7.81 15 M 7.60 4.72 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 16 Q 8.43 4.35 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.21 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 17 K 9.24 4.69 0.00 2.01 1.89 0.00 1.95 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.60 1.43 7.81 18 T 7.59 5.15 4.28 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 0.00 0.00 1.32 0.00 0.00 19 V 8.98 4.70 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 0.77 0.00 0.00 0.92 0.00 0.00 20 T 8.65 4.87 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 1.12 0.00 0.00 21 V 8.89 4.49 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 0.83 0.00 0.00 0.85 0.00 0.00 22 L 9.13 4.79 0.00 1.45 1.49 0.87 -0.46 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 23 V 8.56 4.28 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 0.85 0.00 0.00 0.78 0.00 0.00 24 E 8.75 4.81 0.00 2.02 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 2.27 2.32 0.00 25 R 8.68 4.86 0.00 1.98 1.79 0.00 3.13 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.73 0.00 26 Q 8.80 4.94 0.00 1.95 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.85 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 27 F 7.56 4.82 0.00 3.17 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.97 0.00 2.18 2.16 0.00 4.06 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.04 0.00 29 H 9.14 4.27 0.00 3.32 3.40 0.00 5.61 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 30 P 0.00 4.30 0.00 2.15 2.16 0.00 3.63 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 1.81 1.90 0.00 31 L 7.99 4.35 0.00 1.33 1.11 0.81 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.71 4.64 0.00 2.92 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 33 G 8.27 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 34 K 8.18 4.02 0.00 1.79 1.99 0.00 1.28 0.00 0.00 1.54 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.41 7.81 35 V 8.33 4.24 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 0.74 0.00 0.00 0.93 0.00 0.00 36 I 8.14 4.26 1.71 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 0.05 -0.19 0.88 0.00 0.00 37 K 8.06 4.65 0.00 1.66 1.65 0.00 1.58 0.00 0.00 0.61 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.32 7.81 38 R 8.43 4.77 0.00 2.19 1.94 0.00 3.51 0.00 0.00 3.48 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 39 S 8.15 5.09 0.00 3.90 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 40 K 8.88 4.61 0.00 1.75 1.58 0.00 1.49 0.00 0.00 1.52 0.00 0.00 2.22 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.30 1.04 7.81 41 K 8.39 4.95 0.00 1.56 1.61 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.18 1.38 7.81 42 Y 9.26 4.68 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 43 L 8.73 5.04 0.00 1.60 1.67 1.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 44 A 9.12 5.13 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 45 H 9.21 4.78 0.00 3.26 3.24 0.00 5.72 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 9.66 5.02 0.00 2.73 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.18 0.00 2.20 2.07 0.00 3.64 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.69 0.00 48 E 8.18 4.05 0.00 1.99 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 2.39 2.34 0.00 49 E 7.84 4.04 0.00 2.12 2.02 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 2.40 2.38 0.00 50 K 7.17 3.70 0.00 1.63 1.33 0.00 1.73 0.00 0.00 1.28 0.00 0.00 2.77 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.55 1.08 7.81 51 Y 7.36 4.06 0.00 3.09 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 9.16 4.74 0.00 1.77 1.69 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.48 7.81 53 L 8.42 4.18 0.00 1.60 1.64 1.06 1.11 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 54 G 8.51 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 55 D 8.39 4.70 0.00 2.84 2.70 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 56 V 8.57 4.70 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 1.01 0.00 0.00 0.93 0.00 0.00 57 V 8.71 4.96 1.88 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 0.63 0.00 0.00 0.77 0.00 0.00 58 E 9.08 5.03 0.00 1.81 1.80 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 2.19 2.23 0.00 59 I 9.33 4.67 1.48 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.68 0.51 0.00 0.00 60 I 8.47 5.05 1.89 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 1.13 1.76 0.93 0.00 0.00 61 E 9.39 3.62 0.00 2.08 1.85 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 2.13 1.94 0.00 62 S 7.91 4.74 0.00 3.65 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 63 R 8.42 4.08 0.00 1.73 1.77 0.00 3.24 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 64 P 0.00 4.36 0.00 2.04 1.97 0.00 3.64 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 65 I 8.08 4.26 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.73 0.70 0.00 0.00 66 S 7.34 4.50 0.00 3.93 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 67 K 8.43 3.96 0.00 1.74 1.75 0.00 1.93 0.00 0.00 1.64 0.00 0.00 2.74 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.43 7.81 68 R 8.42 3.67 0.00 1.98 1.93 0.00 3.41 0.00 0.00 3.16 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 69 K 6.64 5.26 0.00 1.90 1.86 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.28 1.50 7.81 70 R 7.73 4.54 0.00 1.61 1.41 0.00 3.18 0.00 0.00 3.34 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 71 F 8.26 5.35 0.00 2.94 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 8.75 4.92 0.00 1.76 1.81 0.00 3.17 0.00 0.00 3.12 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 73 V 7.98 3.61 1.65 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 -0.74 0.00 0.00 0.67 0.00 0.00 74 L 9.04 4.24 0.00 1.66 1.72 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 75 R 7.45 4.60 0.00 1.93 2.02 0.00 3.02 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 76 L 8.68 4.89 0.00 1.97 1.71 1.03 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.76 4.23 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 0.83 0.00 0.00 0.92 0.00 0.00 78 E 7.62 4.66 0.00 2.04 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 2.24 2.28 0.00 79 S 8.69 5.31 0.00 3.86 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 80 G 8.11 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 81 R 7.07 5.32 0.00 2.34 2.11 0.00 3.03 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.36 0.00 82 M 7.45 4.22 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 83 D 8.23 4.62 0.00 2.87 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.64 3.95 0.00 1.71 1.75 0.92 0.70 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 85 V 7.86 3.67 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 1.17 0.00 0.00 0.95 0.00 0.00 86 E 8.76 3.93 0.00 2.19 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 2.60 2.52 0.00 87 K 7.55 3.94 0.00 1.83 1.92 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.65 7.81 88 Y 7.89 4.13 0.00 3.02 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 89 L 8.33 3.59 0.00 1.79 1.61 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.43 3.60 2.05 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.34 0.89 0.00 0.00 91 R 7.91 3.83 0.00 1.86 1.78 0.00 3.26 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 92 R 7.33 3.14 0.00 1.34 1.69 0.00 2.99 0.00 0.00 2.98 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.31 0.00 93 Q 8.03 3.94 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 94 N 7.82 4.46 0.00 2.86 2.96 0.00 0.00 7.07 8.03 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 95 Y 8.04 4.30 0.00 3.21 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 96 Q 7.47 4.32 0.00 2.08 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.67 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 97 S 10.64 4.22 0.00 4.07 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 98 L 8.29 3.63 0.00 1.79 2.16 0.85 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 99 S 7.52 4.50 0.00 3.92 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 0.00 100 K 7.86 4.59 0.00 1.70 1.81 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.32 1.42 7.81 101 R 9.27 4.25 0.00 1.76 1.71 0.00 3.42 0.00 0.00 3.23 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 102 G 8.28 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 103 G 8.34 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 0.00 0.00 0.00 0.00 104 K 7.81 4.41 0.00 1.76 1.34 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.44 7.81 105 A 8.67 4.10 1.28 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 0.00 0.00 0.00 0.00 0.00