NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 Y 4.7628 8.0027 118.3585 58.0968 40.2557 176.9770 30 K 3.8836 8.1301 120.0393 58.9499 32.0638 177.2786 31 Q 4.0266 8.2583 118.3576 59.0274 29.3085 177.4440 32 E 4.0002 8.2537 119.8421 59.3936 29.6072 178.0885 33 Y 4.0813 8.5160 119.8167 60.9814 38.9170 177.7398 34 D 4.4124 8.5107 119.8053 57.4635 40.8784 178.7695 35 M 4.0567 8.3331 119.2732 58.1208 31.9036 178.5250 36 A 3.9152 8.0495 120.7191 55.1471 18.5195 179.4710 37 A 3.7051 8.0591 119.6000 55.2134 18.3768 179.3182 38 D 4.1799 8.3813 116.8588 57.4388 41.2366 178.4912 39 L 3.9269 7.9326 119.4180 57.8780 41.6170 179.6443 40 V 3.5275 7.9356 118.3362 65.8062 31.3370 178.0219 41 R 3.7850 8.0826 118.5231 59.6678 29.8329 178.3576 42 M 3.9941 7.9266 118.3493 58.5495 31.9541 178.8772 43 L 3.9602 8.2193 119.4239 57.6673 41.8605 179.5750 44 R 3.9444 8.2591 119.0345 59.2975 29.7947 178.7727 45 G 3.6509 7.8652 104.6899 47.6408 0.0000 175.1110 46 L 4.2343 7.3874 119.7116 55.3837 41.8922 177.9054 47 G 3.8909 7.5348 105.8663 44.5292 0.0000 173.6505 48 V 3.4364 7.5457 120.7487 62.3162 31.8816 175.9320 49 F 4.6738 8.1649 127.4663 58.3092 39.5241 174.7596 50 M 5.1004 8.5621 122.0945 54.1291 36.1348 173.8369 51 H 5.4535 8.8981 119.3096 54.4883 33.2582 172.4747 52 A 4.6098 8.7463 121.0384 50.6944 23.2357 175.3884 53 K 4.5696 8.5535 121.5230 56.0425 33.0977 176.2421 54 C 4.3257 9.2403 129.5793 58.8859 31.8676 172.8401 55 P 4.2779 0.0000 0.0000 65.1062 31.4481 177.4893 56 R 4.2179 8.0424 117.1724 58.5362 30.7028 176.9155 57 C 4.2022 8.1756 113.5412 60.8461 28.6340 175.0139 58 G 3.9436 8.4793 106.7564 44.7870 0.0000 173.2812 59 A 4.4510 7.5686 121.2226 50.9986 20.2902 176.5293 60 E 4.5424 8.7857 121.4118 56.7523 30.8362 175.8719 61 G 4.1272 8.7399 111.4633 45.4981 0.0000 171.5943 62 S 4.8718 8.7879 115.2404 57.5331 63.7239 173.2503 63 V 4.2370 8.3489 128.0488 62.8906 32.0698 174.9164 64 S 4.7733 8.9699 122.0716 56.9412 66.5159 171.8728 65 I 4.9010 8.1526 112.6609 58.9668 40.3698 174.9963 66 V 4.2791 8.1413 123.0607 60.9029 34.9831 173.6060 67 E 5.1635 8.4087 126.8114 54.2667 31.7075 175.8557 68 T 4.3390 8.8381 117.2118 61.1296 69.6443 175.5092 69 K 4.0253 8.6435 121.1569 59.2047 32.0587 177.7896 70 N 4.6430 8.0978 114.1068 53.1164 38.6995 175.8393 71 G 3.9786 8.2647 107.2804 44.9498 0.0000 172.7326 72 Y 4.5353 7.9110 121.9223 56.7944 40.1928 174.0365 73 K 4.8887 8.0379 126.6654 55.3293 33.3892 175.5179 74 Y 5.0225 8.2367 122.7220 55.0803 41.8264 174.4265 75 L 4.9524 8.8019 119.7311 53.9343 43.7708 176.4574 76 V 5.0845 8.6808 114.6477 59.9206 36.9466 174.2359 77 I 4.7988 8.6286 123.0592 59.8061 39.5764 175.2015 78 R 4.7492 8.7118 127.4928 55.2121 31.4102 175.4526 79 H 4.8621 9.4844 123.2442 54.2518 29.7868 175.3152 80 P 4.3585 0.0000 0.0000 64.8472 31.4811 176.3739 81 D 4.7235 8.1404 116.4772 52.9190 39.5481 176.6531 82 G 4.0229 8.7866 110.5016 45.5504 0.0000 174.9503 83 G 3.8439 7.8197 107.5799 46.5912 0.0000 172.8171 84 T 5.1891 8.4558 114.8999 60.1007 71.3941 172.9204 85 H 5.1675 9.1115 122.7007 53.9184 32.1495 173.4927 86 T 4.5348 8.7401 119.5964 63.7904 69.2718 173.9068 87 V 4.2333 8.7633 126.6480 60.9883 32.5517 174.2859 88 P 4.4087 0.0000 0.0000 62.4207 31.8636 177.7211 89 K 3.8053 8.2721 120.6396 58.9865 32.0951 178.0373 90 T 3.9861 7.5239 106.9624 61.4472 69.3791 175.0203 91 D 4.7826 7.8808 120.7129 53.4071 41.5917 174.5696 92 I 4.5446 7.6476 111.5347 60.3424 38.8855 178.3454 93 S 4.1179 8.3159 118.5249 62.2865 62.6384 176.2522 94 A 4.0037 7.9834 123.8316 54.5268 18.0812 179.6028 95 I 3.6923 7.7015 118.1718 64.4736 37.2295 178.3475 96 L 3.9633 8.2578 120.2483 57.5792 41.4755 179.3523 97 K 3.8606 8.3004 119.8024 59.6794 32.0402 178.4483 98 E 3.9608 8.1271 119.1944 59.2351 29.4799 178.6420 99 L 3.9520 8.2604 119.4306 57.7761 41.6246 179.0166 100 C 4.0670 8.3256 118.8379 62.5511 31.5153 175.5783 101 E 3.9496 8.0246 120.0070 59.3611 28.9885 179.3397 102 V 3.5806 8.0301 118.5710 65.9013 31.4780 177.7746 103 K 3.8538 8.2339 119.3388 59.6649 32.0427 178.7288 104 K 3.9848 8.0799 118.5239 59.6439 31.9715 179.0546 105 D 4.4338 8.2856 119.0785 57.4657 40.6953 178.9155 106 L 4.0759 8.2812 119.7197 57.6157 41.5332 179.2340 107 E 3.9411 8.6008 119.1194 59.6341 29.4362 178.8154 108 Y 4.0073 8.1960 119.3935 60.6708 38.8883 178.2391 109 V 3.4293 7.9513 119.1379 66.0604 31.6079 178.0734 110 L 4.0424 8.1701 118.8379 57.4248 41.2940 179.3439 111 K 3.8389 8.1232 119.9714 59.5134 32.0039 179.1527 112 R 3.3395 7.5772 118.3370 59.0020 29.7677 178.4663 113 Y 3.8070 7.8888 116.6413 60.9053 37.7975 178.7653 114 K 3.9855 8.2338 120.4810 59.4934 32.2310 178.6333 115 E 3.9709 8.2787 119.0423 59.8824 29.4246 179.1223 116 Y 4.4546 8.2753 116.9816 60.9650 37.7234 178.4556 117 E 4.7356 8.7456 121.1818 59.1563 29.5248 179.2259 118 E 4.0047 8.4662 117.4726 59.3731 29.7729 178.6164 119 E 4.4371 8.4742 117.0231 57.8478 30.1751 178.1224 120 G 3.9311 8.2208 103.2536 44.2726 0.0000 174.6647 121 G 3.8649 7.7354 108.6751 45.5070 0.0000 173.5974 122 V 3.5607 7.7462 120.8825 61.9736 31.8186 175.5116 123 K 4.4942 7.9678 127.5474 54.8208 30.9922 176.0445 124 F 4.2068 8.4347 122.5330 59.8804 39.2632 175.6788 125 C 4.4331 7.9487 118.6370 57.5005 27.0421 172.1154 126 A 4.0096 8.3303 126.9821 52.5502 18.4023 177.2275 127 E 4.3867 8.5526 122.9699 57.1082 29.5676 175.0864 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 29 Y 8.00 4.76 0.00 3.14 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 30 K 8.13 3.88 0.00 1.95 1.88 0.00 1.71 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.81 1.74 7.81 31 Q 8.26 4.03 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.72 0.00 0.00 0.00 0.00 0.00 2.48 2.38 0.00 32 E 8.25 4.00 0.00 2.08 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 0.00 2.47 2.42 0.00 33 Y 8.52 4.08 0.00 3.37 3.24 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 34 D 8.51 4.41 0.00 2.98 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 35 M 8.33 4.06 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.56 0.00 36 A 8.05 3.92 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 8.06 3.71 1.11 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 0.00 0.00 38 D 8.38 4.18 0.00 2.83 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 39 L 7.93 3.93 0.00 1.84 1.66 0.90 0.64 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 40 V 7.94 3.53 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 1.00 0.00 0.00 0.90 0.00 0.00 41 R 8.08 3.79 0.00 1.82 2.10 0.00 3.11 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 42 M 7.93 3.99 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.55 0.00 43 L 8.22 3.96 0.00 1.61 1.66 0.89 0.66 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 44 R 8.26 3.94 0.00 1.97 2.00 0.00 3.13 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 1.58 1.66 0.00 45 G 7.87 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 46 L 7.39 4.23 0.00 1.65 1.67 0.87 1.10 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 47 G 7.53 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 48 V 7.55 3.44 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 0.81 0.00 0.00 0.83 0.00 0.00 49 F 8.16 4.67 0.00 3.03 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 50 M 8.56 5.10 0.00 1.86 1.87 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.70 0.00 51 H 8.90 5.45 0.00 2.92 3.29 0.00 5.89 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.75 4.61 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 K 8.55 4.57 0.00 1.81 1.76 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.69 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.53 7.81 54 C 9.24 4.33 0.00 3.12 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 55 P 0.00 4.28 0.00 2.11 2.35 0.00 3.77 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 56 R 8.04 4.22 0.00 1.75 1.90 0.00 3.24 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.60 0.00 57 C 8.18 4.20 0.00 3.08 2.95 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 58 G 8.48 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 59 A 7.57 4.45 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.79 4.54 0.00 2.02 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 0.00 2.32 2.34 0.00 61 G 8.74 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.79 4.87 0.00 3.91 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 63 V 8.35 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 0.79 0.00 0.00 0.91 0.00 0.00 64 S 8.97 4.77 0.00 3.83 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 65 I 8.15 4.90 1.65 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.72 0.80 0.00 0.00 66 V 8.14 4.28 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 0.00 0.00 0.82 0.00 0.00 0.77 0.00 0.00 67 E 8.41 5.16 0.00 1.91 1.76 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 2.20 2.24 0.00 68 T 8.84 4.34 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 1.60 0.00 0.00 69 K 8.64 4.03 0.00 1.80 1.96 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.49 1.52 7.81 70 N 8.10 4.64 0.00 2.81 2.90 0.00 0.00 7.27 7.37 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 71 G 8.26 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 72 Y 7.91 4.54 0.00 3.15 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 73 K 8.04 4.89 0.00 1.41 1.50 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.27 1.31 7.81 74 Y 8.24 5.02 0.00 3.42 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 75 L 8.80 4.95 0.00 1.55 1.54 0.27 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.68 5.08 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 0.82 0.00 0.00 0.90 0.00 0.00 77 I 8.63 4.80 1.82 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 1.25 1.10 0.72 0.00 0.00 78 R 8.71 4.75 0.00 1.73 1.85 0.00 3.09 0.00 0.00 3.15 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 79 H 9.48 4.86 0.00 3.14 3.19 0.00 5.65 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 P 0.00 4.36 0.00 2.04 2.14 0.00 3.71 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 81 D 8.14 4.72 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 82 G 8.79 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 0.00 0.00 0.00 0.00 83 G 7.82 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 0.00 0.00 0.00 84 T 8.46 5.19 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 85 H 9.11 5.17 0.00 3.13 3.25 0.00 5.64 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 T 8.74 4.53 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 1.27 0.00 0.00 87 V 8.76 4.23 2.38 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 0.89 0.00 0.00 1.03 0.00 0.00 88 P 0.00 4.41 0.00 2.19 1.90 0.00 3.72 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 89 K 8.27 3.81 0.00 1.43 1.63 0.00 1.49 0.00 0.00 1.41 0.00 0.00 2.78 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 0.81 7.81 90 T 7.52 3.99 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 0.45 0.00 0.00 91 D 7.88 4.78 0.00 2.60 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 92 I 7.65 4.54 1.93 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 1.64 1.18 1.17 0.00 0.00 93 S 8.32 4.12 0.00 4.10 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.98 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 95 I 7.70 3.69 2.03 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.70 0.86 0.00 0.00 96 L 8.26 3.96 0.00 1.84 1.73 1.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.30 3.86 0.00 1.82 1.99 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.47 7.81 98 E 8.13 3.96 0.00 2.17 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 2.38 2.40 0.00 99 L 8.26 3.95 0.00 1.85 1.69 0.89 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 100 C 8.33 4.07 0.00 3.06 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 E 8.02 3.95 0.00 2.19 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 2.55 2.47 0.00 102 V 8.03 3.58 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.99 0.00 0.00 103 K 8.23 3.85 0.00 1.96 2.00 0.00 1.69 0.00 0.00 1.65 0.00 0.00 3.15 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.49 7.81 104 K 8.08 3.98 0.00 2.02 1.86 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.64 7.81 105 D 8.29 4.43 0.00 2.87 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 0.00 106 L 8.28 4.08 0.00 1.68 1.70 0.89 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.60 3.94 0.00 2.22 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 2.33 2.47 0.00 108 Y 8.20 4.01 0.00 3.11 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 0.00 109 V 7.95 3.43 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 1.07 0.00 0.00 1.08 0.00 0.00 110 L 8.17 4.04 0.00 1.67 1.62 0.83 0.53 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 0.00 111 K 8.12 3.84 0.00 1.79 1.79 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.40 7.81 112 R 7.58 3.34 0.00 1.51 1.08 0.00 2.75 0.00 0.00 2.93 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 1.09 0.00 113 Y 7.89 3.81 0.00 3.03 2.81 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 0.00 114 K 8.23 3.99 0.00 1.89 1.94 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.50 7.81 115 E 8.28 3.97 0.00 1.93 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 2.45 2.47 0.00 116 Y 8.28 4.45 0.00 3.31 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 0.00 117 E 8.75 4.74 0.00 2.17 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 0.00 2.88 2.99 0.00 118 E 8.47 4.00 0.00 2.04 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 2.38 2.54 0.00 119 E 8.47 4.44 0.00 2.13 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 0.00 2.32 2.34 0.00 120 G 8.22 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 0.00 121 G 7.74 3.86 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 0.00 0.00 0.00 122 V 7.75 3.56 1.55 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 -0.01 0.00 0.00 0.79 0.00 0.00 123 K 7.97 4.49 0.00 1.70 1.73 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.37 7.81 124 F 8.43 4.21 0.00 3.24 3.28 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 0.00 125 C 7.95 4.43 0.00 3.02 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 A 8.33 4.01 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 0.00 127 E 8.55 4.39 0.00 1.87 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 0.00 2.13 2.30 0.00