NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4178 8.3349 115.4138 57.8507 64.3399 172.8264 2 L 4.2798 8.2597 121.9788 52.4565 42.3032 176.4793 3 S 4.5835 9.6731 120.7845 57.3631 66.7587 174.6755 4 D 4.3360 8.5037 121.0729 57.3243 40.4337 178.9925 5 K 3.9497 7.9854 119.7004 59.5220 32.2088 178.4759 6 D 4.5615 8.0351 120.4601 56.8852 40.7143 178.8691 7 K 3.8936 8.2810 118.8563 59.4024 31.9525 179.2901 8 A 3.9402 8.1869 120.7927 55.0359 18.2413 179.5590 9 A 3.9027 8.0546 119.3293 55.2374 18.3906 180.1043 10 V 3.4149 7.9394 116.8803 66.1533 31.5503 178.4369 11 R 3.9131 8.1450 117.7894 59.2047 29.8837 178.9649 12 A 3.9599 8.2421 120.7111 54.9315 18.3176 179.4343 13 L 3.8400 8.1093 118.9902 58.1642 42.1867 178.9677 14 W 4.1076 8.5219 128.6916 60.4779 30.3017 177.6384 15 S 3.9685 8.0421 112.3974 61.3670 61.8159 176.1267 16 K 4.0052 7.5167 119.9195 58.5382 32.2124 178.5176 17 I 3.3536 7.3636 111.5874 60.7479 38.1174 177.6880 18 G 2.2397 7.2789 108.8876 47.1887 0.0000 175.6075 19 K 3.9515 7.6508 119.5201 59.2353 32.5116 178.1598 20 S 4.7195 7.8204 114.9409 58.1814 63.3299 175.6396 21 A 4.1142 7.7673 127.1084 55.6571 18.0551 180.3172 22 D 4.3152 8.1404 116.3436 57.5606 41.0172 178.7894 23 A 4.0146 7.9688 120.6607 55.1842 18.3856 179.4413 24 I 3.8159 8.1707 118.6852 64.5106 37.1466 178.9359 25 G 3.6080 8.3558 106.5042 47.8299 0.0000 175.1405 26 N 4.2825 8.1698 119.9946 56.4379 38.9001 176.4350 27 D 4.2989 8.2496 119.0834 57.2401 41.3499 178.0714 28 A 4.0222 8.3929 121.7119 55.2263 18.4123 179.6689 29 L 3.9785 8.1896 117.6638 57.9514 41.5449 179.8958 30 S 4.1528 8.2084 115.1317 61.7120 62.8046 177.0682 31 R 3.9779 8.2283 120.7788 59.3155 29.7584 178.5848 32 M 4.3144 8.2715 118.0724 59.1071 32.1459 178.4162 33 I 3.8254 7.9021 119.7801 64.1517 36.9695 178.7235 34 V 3.7098 7.4160 118.5288 66.0457 31.6205 178.0729 35 V 3.7145 8.2439 116.7520 64.2113 32.7904 175.5488 36 Y 4.7116 8.0917 116.5266 54.4023 37.9508 173.8998 37 P 4.5111 0.0000 0.0000 64.7270 31.5676 177.6227 38 Q 4.1434 8.1848 115.0636 58.7737 28.6525 177.7925 39 T 4.4514 8.4113 111.5960 63.3641 69.1372 176.5867 40 K 4.1387 8.1161 123.4214 59.7964 32.0325 178.1576 41 T 3.6401 7.9001 113.0144 65.4831 66.7986 175.0935 42 Y 3.9270 7.0687 117.0846 59.4492 38.0600 176.9772 43 F 3.9080 7.6656 117.7769 56.5934 39.5498 177.1820 44 S 4.1794 7.4335 115.2885 61.1888 62.7317 175.1008 45 H 4.3940 7.8982 116.6578 57.1294 28.6383 175.7105 46 W 4.5866 7.7966 121.7582 55.7023 29.4214 175.4223 47 P 4.1693 0.0000 0.0000 64.5480 31.1276 176.0226 48 D 4.5435 7.7195 118.9471 53.7244 42.9436 174.5136 49 V 4.6191 8.5066 118.9536 61.2379 32.8088 176.1132 50 T 4.3245 8.1434 111.3048 59.8974 69.7165 172.3523 51 P 4.3314 0.0000 0.0000 64.8569 31.5407 177.0164 52 G 3.9368 9.0107 111.1075 45.0755 0.0000 173.9679 53 S 4.2830 8.0427 114.9910 58.2451 63.9002 173.2523 54 P 4.2371 0.0000 0.0000 66.0306 31.0534 178.5814 55 H 3.6711 7.8189 115.9249 58.4664 28.5331 177.5339 56 I 3.6823 7.4657 121.2309 64.0784 36.6901 178.4105 57 K 4.3276 7.9254 120.5458 58.9480 32.0271 178.4481 58 A 4.0553 7.8554 121.0471 55.4487 18.2096 179.1455 59 H 4.2608 8.4303 117.2570 59.2171 29.9953 177.5295 60 G 3.7218 8.5299 108.1148 47.8387 0.0000 175.7387 61 K 4.0390 7.8023 120.1980 59.2619 32.0960 179.6065 62 K 3.9944 7.8593 118.2539 59.3322 32.0762 179.2932 63 V 3.6205 7.9198 118.6965 66.5309 31.4433 178.0199 64 M 4.3826 8.1801 117.6071 57.6732 31.6928 178.9520 65 G 3.7713 8.1322 106.6187 47.4969 0.0000 176.1674 66 G 3.5900 8.1554 108.0801 47.6692 0.0000 175.9491 67 I 3.5697 7.7109 122.0287 63.9828 37.0924 178.3567 68 A 3.3320 8.1085 121.9933 54.7839 18.2119 179.4397 69 L 3.8649 8.2219 118.9323 58.2756 41.9700 179.0354 70 A 3.9942 7.8810 119.8204 55.1476 18.5350 179.4602 71 V 3.5445 7.9523 117.1743 66.0988 31.3394 178.4995 72 S 4.2678 8.0605 112.8227 60.3675 62.9744 175.5541 73 K 4.5151 7.7753 120.9502 56.0277 32.1972 177.8039 74 I 3.7871 7.4598 122.2989 64.2785 37.8903 176.8606 75 D 4.5614 8.0290 118.1460 56.3816 41.2693 176.4890 76 D 4.6978 8.0899 118.2661 52.1800 42.8909 175.2292 77 L 4.0043 8.1453 124.7287 56.7785 41.7082 178.3470 78 K 3.8460 7.9011 118.4403 59.9419 32.2414 178.5581 79 T 4.1186 8.1075 115.7350 66.6193 68.1791 177.1273 80 G 3.6549 8.0292 106.4527 46.9022 0.0000 174.7447 81 L 4.5825 8.0038 119.3105 54.4934 42.0033 177.8232 82 M 3.9870 7.6342 121.2748 59.0176 32.0664 178.2660 83 E 3.9922 8.0946 118.0303 59.4148 29.7386 179.1691 84 L 4.0668 7.8791 118.6135 57.5767 41.6276 179.3369 85 S 4.2186 8.4145 113.5967 61.4626 62.3471 175.7425 86 E 4.0447 8.2997 122.0041 59.3967 29.2378 178.5918 87 Q 3.9797 8.3215 119.5348 59.6560 29.1109 178.0043 88 H 4.1923 8.5454 117.0562 58.5500 28.7855 177.8073 89 A 2.9326 8.3350 123.0277 54.5934 17.9319 178.7332 90 Y 4.0519 7.8774 113.3024 59.9655 38.8904 177.7525 91 K 4.1601 7.9930 117.1700 59.2483 32.4138 178.2590 92 L 4.2346 8.1079 116.6528 54.3995 42.6461 176.7382 93 R 3.8863 7.7827 115.6801 55.7466 27.4861 176.7527 94 V 3.2437 7.8880 116.6420 61.7490 32.5539 174.9946 95 D 4.3571 8.6446 127.7824 53.6577 41.5340 175.3305 96 P 3.2637 0.0000 0.0000 65.0045 30.8290 178.1915 97 A 3.9370 7.6886 119.9380 54.5980 18.4821 178.6225 98 N 4.2925 7.6145 114.6373 55.1816 38.6462 177.3949 99 F 4.3646 7.0328 119.9871 60.4658 39.0193 177.6386 100 K 4.0653 8.0026 117.7760 59.7104 32.3978 179.3152 101 I 3.3853 7.3567 120.7763 64.1400 37.0529 177.8730 102 L 3.9704 7.7943 121.1729 58.0376 41.8825 178.6429 103 N 4.3118 8.2590 116.5250 56.6390 38.4671 176.7249 104 H 4.2054 8.3124 119.4241 59.6358 29.9303 177.0301 105 C 4.1464 8.2584 118.4330 62.8152 27.8255 176.2225 106 I 3.7190 8.2035 121.8405 64.3527 36.7182 178.4081 107 L 3.7276 7.9651 119.7879 57.6377 41.4363 179.7242 108 V 3.5532 7.8887 118.2728 65.9928 31.4801 178.2591 109 V 3.5667 7.8826 117.9115 66.1258 31.3636 177.9796 110 I 3.7868 7.9319 119.9173 64.4159 36.6207 178.3454 111 S 4.2475 7.7014 113.2465 61.6529 62.3280 176.0892 112 T 4.0090 7.9254 111.4819 64.6678 68.5723 175.8116 113 M 4.0050 7.8635 120.1363 55.7898 33.8675 176.5067 114 F 4.9191 8.4377 117.1071 55.1750 39.7222 173.8497 115 P 4.3842 0.0000 0.0000 65.8451 31.8734 178.8346 116 K 4.2099 8.1588 117.3707 59.2852 32.2802 178.1346 117 E 4.1561 8.3044 116.9470 59.0034 30.1428 177.5450 118 F 4.7018 8.2957 122.9438 57.2549 37.8618 174.8535 119 T 4.2233 7.3039 115.7771 60.3136 71.5991 173.6769 120 P 4.0679 0.0000 0.0000 65.7818 30.6982 178.8775 121 E 3.9280 8.0610 116.7395 59.1662 29.4292 179.0533 122 A 4.0287 7.9354 121.0269 55.2689 18.3487 179.1780 123 H 4.0016 8.1041 117.3378 59.1640 29.8913 177.8439 124 V 3.6028 7.8297 121.0251 65.1516 31.0409 178.6196 125 S 4.3006 7.7817 115.1663 61.0105 62.6682 176.4520 126 L 4.1434 8.2660 123.2273 58.0518 41.8227 178.5495 127 D 4.4460 8.6866 118.5147 57.3622 41.2282 178.3423 128 K 3.9975 8.2468 119.0446 59.3392 31.9366 179.1052 129 F 4.1813 8.5810 121.0508 61.4626 39.3023 177.2748 130 L 3.6798 8.5838 118.9439 57.7367 41.3527 179.7036 131 S 4.1833 8.3633 115.4941 61.4451 62.7023 176.9723 132 G 3.4800 7.8834 108.5708 47.5200 0.0000 176.0310 133 V 3.2404 7.5696 120.6580 65.5570 31.4876 177.9307 134 A 3.6510 8.0024 120.8523 55.0459 17.9831 179.3798 135 L 3.8315 7.6998 117.4362 58.1667 42.4382 178.7747 136 A 4.0678 8.0033 120.8244 55.0947 18.1108 179.6484 137 L 3.8209 7.8796 116.5236 57.1492 41.8048 178.6951 138 A 4.4206 7.7079 119.4410 52.6421 18.3660 178.4740 139 E 3.9254 7.7627 118.4124 59.2011 29.7408 177.8178 140 R 4.5094 8.0466 114.3537 56.5415 30.4134 177.0798 141 Y 4.0193 8.2123 118.2129 60.6217 38.2236 175.9397 142 R 4.2204 7.8266 119.6438 56.6627 29.0402 174.4524 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 S 8.33 4.42 0.00 4.00 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 2 L 8.26 4.28 0.00 1.78 1.70 1.10 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.67 4.58 0.00 4.06 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 4 D 8.50 4.34 0.00 2.74 2.76 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 5 K 7.99 3.95 0.00 1.82 1.80 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.53 7.81 6 D 8.04 4.56 0.00 3.03 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.28 3.89 0.00 1.92 1.85 0.00 1.68 0.00 0.00 1.80 0.00 0.00 2.98 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.48 1.66 7.81 8 A 8.19 3.94 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 9 A 8.05 3.90 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.94 3.41 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 0.20 0.00 0.00 0.82 0.00 0.00 11 R 8.15 3.91 0.00 2.05 1.97 0.00 3.16 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 12 A 8.24 3.96 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 13 L 8.11 3.84 0.00 1.88 1.86 0.99 1.19 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 14 W 8.52 4.11 0.00 3.35 2.98 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 15 S 8.04 3.97 0.00 3.96 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 16 K 7.52 4.01 0.00 1.73 1.68 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.49 7.81 17 I 7.36 3.35 0.57 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 1.27 0.08 -0.08 0.00 0.00 18 G 7.28 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.65 3.95 0.00 1.86 1.87 0.00 1.56 0.00 0.00 1.67 0.00 0.00 3.27 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.28 1.54 7.81 20 S 7.82 4.72 0.00 4.23 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 21 A 7.77 4.11 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.14 4.32 0.00 2.75 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 23 A 7.97 4.01 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 24 I 8.17 3.82 2.14 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.94 1.01 0.00 0.00 25 G 8.36 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.17 4.28 0.00 2.86 2.98 0.00 0.00 6.91 8.45 0.00 0.00 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 D 8.25 4.30 0.00 3.01 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.39 4.02 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 29 L 8.19 3.98 0.00 1.78 1.66 1.05 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 30 S 8.21 4.15 0.00 4.07 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 31 R 8.23 3.98 0.00 2.07 2.06 0.00 3.17 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 32 M 8.27 4.31 0.00 2.30 2.22 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 2.62 2.74 0.00 33 I 7.90 3.83 1.91 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.03 0.98 0.00 0.00 34 V 7.42 3.71 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.98 0.00 0.00 35 V 8.24 3.71 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 0.23 0.00 0.00 0.93 0.00 0.00 36 Y 8.09 4.71 0.00 3.26 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.51 0.00 2.17 2.15 0.00 3.91 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 2.12 2.20 0.00 38 Q 8.18 4.14 0.00 2.22 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.05 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 39 T 8.41 4.45 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 40 K 8.12 4.14 0.00 2.00 1.93 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.54 7.81 41 T 7.90 3.64 4.02 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 0.57 0.00 0.00 42 Y 7.07 3.93 0.00 2.02 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 F 7.67 3.91 0.00 2.76 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 0.00 0.00 0.00 0.00 44 S 7.43 4.18 0.00 3.93 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 45 H 7.90 4.39 0.00 3.33 3.44 0.00 5.52 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 46 W 7.80 4.59 0.00 3.46 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 47 P 0.00 4.17 0.00 2.20 2.20 0.00 3.60 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.94 0.00 48 D 7.72 4.54 0.00 2.50 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 49 V 8.51 4.62 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 1.03 0.00 0.00 1.00 0.00 0.00 50 T 8.14 4.32 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 1.25 0.00 0.00 51 P 0.00 4.33 0.00 2.07 2.09 0.00 3.69 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 2.05 2.14 0.00 52 G 9.01 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 0.00 0.00 0.00 53 S 8.04 4.28 0.00 4.23 3.87 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 54 P 0.00 4.24 0.00 2.12 2.20 0.00 3.90 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 1.90 1.99 0.00 55 H 7.82 3.67 0.00 2.87 1.88 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 7.47 3.68 2.03 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.90 0.93 0.00 0.00 57 K 7.93 4.33 0.00 1.81 1.92 0.00 1.62 0.00 0.00 1.52 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.29 7.81 58 A 7.86 4.06 1.24 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 0.00 0.00 0.00 59 H 8.43 4.26 0.00 3.27 3.46 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.53 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 K 7.80 4.04 0.00 1.95 1.89 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.67 7.81 62 K 7.86 3.99 0.00 1.89 1.89 0.00 1.85 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.57 1.53 7.81 63 V 7.92 3.62 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 1.09 0.00 0.00 1.02 0.00 0.00 64 M 8.18 4.38 0.00 2.39 2.30 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.81 0.00 65 G 8.13 3.77 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 0.00 0.00 0.00 66 G 8.16 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 67 I 7.71 3.57 1.76 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 1.57 0.80 0.48 0.00 0.00 68 A 8.11 3.33 1.56 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 0.00 0.00 69 L 8.22 3.86 0.00 1.82 1.85 0.92 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.88 3.99 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 V 7.95 3.54 1.82 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 0.89 0.00 0.00 0.16 0.00 0.00 72 S 8.06 4.27 0.00 4.09 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 73 K 7.78 4.52 0.00 1.78 1.82 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.58 1.54 7.81 74 I 7.46 3.79 2.08 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 1.39 1.04 0.94 0.00 0.00 75 D 8.03 4.56 0.00 2.72 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.09 4.70 0.00 2.68 2.48 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 77 L 8.15 4.00 0.00 1.66 1.59 0.77 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.90 3.85 0.00 1.72 1.96 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.41 1.53 7.81 79 T 8.11 4.12 4.29 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 1.20 0.00 0.00 80 G 8.03 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 81 L 8.00 4.58 0.00 1.63 1.57 0.73 0.56 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 82 M 7.63 3.99 0.00 2.11 2.19 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.63 0.00 83 E 8.09 3.99 0.00 2.06 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 0.00 2.39 2.39 0.00 84 L 7.88 4.07 0.00 1.82 1.73 0.91 0.90 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 85 S 8.41 4.22 0.00 4.00 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 86 E 8.30 4.04 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 87 Q 8.32 3.98 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 88 H 8.55 4.19 0.00 3.54 3.73 0.00 5.86 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 8.34 2.93 0.35 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 90 Y 7.88 4.05 0.00 3.04 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 91 K 7.99 4.16 0.00 1.92 1.87 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.54 7.81 92 L 8.11 4.23 0.00 1.55 1.64 0.77 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 93 R 7.78 3.89 0.00 1.93 1.96 0.00 3.21 0.00 0.00 3.77 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 94 V 7.89 3.24 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.57 0.00 0.00 95 D 8.64 4.36 0.00 2.79 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 96 P 0.00 3.26 0.00 1.90 1.02 0.00 3.57 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.64 0.00 97 A 7.69 3.94 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 98 N 7.61 4.29 0.00 2.45 2.64 0.00 0.00 6.83 8.26 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 99 F 7.03 4.36 0.00 2.94 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 0.00 100 K 8.00 4.07 0.00 1.96 2.06 0.00 1.48 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.61 1.46 7.81 101 I 7.36 3.39 1.74 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.53 -0.13 0.00 0.00 102 L 7.79 3.97 0.00 1.81 1.71 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.26 4.31 0.00 2.99 2.88 0.00 0.00 6.62 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 H 8.31 4.21 0.00 3.27 3.48 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 C 8.26 4.15 0.00 3.20 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 0.00 106 I 8.20 3.72 2.05 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 1.57 0.87 0.95 0.00 0.00 107 L 7.97 3.73 0.00 1.86 1.76 1.13 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.89 3.55 2.19 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 1.00 0.00 0.00 0.88 0.00 0.00 109 V 7.88 3.57 2.21 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 1.09 0.00 0.00 1.04 0.00 0.00 110 I 7.93 3.79 1.26 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 1.42 0.56 0.48 0.00 0.00 111 S 7.70 4.25 0.00 4.09 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 0.00 112 T 7.93 4.01 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 113 M 7.86 4.00 0.00 1.35 2.04 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 2.62 2.40 0.00 114 F 8.44 4.92 0.00 3.23 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 P 0.00 4.38 0.00 2.22 2.24 0.00 3.82 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 2.01 2.00 0.00 116 K 8.16 4.21 0.00 1.85 1.96 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.49 1.44 7.81 117 E 8.30 4.16 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 118 F 8.30 4.70 0.00 3.06 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 T 7.30 4.22 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 0.00 120 P 0.00 4.07 0.00 2.12 2.07 0.00 3.55 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 2.08 2.13 0.00 121 E 8.06 3.93 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 122 A 7.94 4.03 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 0.00 123 H 8.10 4.00 0.00 2.27 3.17 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.83 3.60 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 0.80 0.00 0.00 0.92 0.00 0.00 125 S 7.78 4.30 0.00 3.95 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.27 4.14 0.00 2.10 1.96 1.00 1.21 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 0.00 127 D 8.69 4.45 0.00 3.11 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 0.00 128 K 8.25 4.00 0.00 2.08 1.90 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.66 7.81 129 F 8.58 4.18 0.00 3.12 3.33 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 0.00 130 L 8.58 3.68 0.00 1.72 1.80 1.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.36 4.18 0.00 4.00 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 0.00 132 G 7.88 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 0.00 0.00 0.00 133 V 7.57 3.24 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 0.70 0.00 0.00 0.05 0.00 0.00 134 A 8.00 3.65 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 0.00 135 L 7.70 3.83 0.00 1.65 1.78 0.90 0.93 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 0.00 136 A 8.00 4.07 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 0.00 137 L 7.88 3.82 0.00 0.64 0.60 0.23 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.71 4.42 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 0.00 139 E 7.76 3.93 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 2.34 2.45 0.00 140 R 8.05 4.51 0.00 1.86 2.15 0.00 3.42 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 141 Y 8.21 4.02 0.00 3.20 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 0.00 142 R 7.83 4.22 0.00 1.91 1.90 0.00 3.09 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00