NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 R 4.3916 8.1127 119.6631 56.0718 32.6166 173.9311 4 R 4.6403 9.3614 124.6744 55.4906 31.1597 173.5024 5 I 4.8372 8.5806 128.5197 59.4696 40.1045 174.3618 6 L 4.6535 8.8788 131.0003 54.2045 43.2174 175.7614 7 V 4.3440 9.0251 128.7031 61.7640 32.7544 175.0155 8 V 4.6244 8.4690 130.4779 61.8014 33.1565 174.0066 9 E 5.0429 8.6335 126.3728 55.3996 33.0092 176.4007 10 A 4.2609 9.3743 130.2339 54.3365 18.8644 178.2061 11 E 4.2958 8.8338 117.1483 55.1518 30.2942 176.8503 12 A 4.0143 8.7480 127.1287 55.0529 18.4480 177.4632 13 P 4.1785 0.0000 0.0000 65.8959 31.1750 178.7175 14 I 3.6708 7.6616 119.0972 64.4008 37.2249 178.0798 15 R 3.9652 8.1961 119.0926 59.7201 29.8320 179.0086 16 E 4.1582 8.5638 118.3738 59.4207 29.4243 179.0627 17 M 4.0760 8.1733 118.4731 58.5054 32.2390 178.4448 18 V 3.7397 8.2219 118.6716 66.3848 31.7938 177.8100 19 C 4.1599 8.6891 116.8158 62.6393 27.8938 175.7519 20 F 4.2404 8.6172 122.5517 61.4781 38.8711 177.2374 21 V 3.5869 8.0299 117.6965 66.0750 31.3139 177.9980 22 L 4.1101 8.2207 119.0150 57.8071 41.5008 179.3638 23 E 4.2893 8.6741 119.2997 59.0694 29.3149 179.1564 24 Q 3.9043 7.8925 118.1567 57.9877 28.6715 177.4928 25 N 4.8432 7.6129 115.3571 52.6498 38.9495 175.9439 26 G 3.7636 7.9508 108.6818 45.2182 0.0000 173.8997 27 F 4.4796 8.1725 118.9062 56.8932 41.4106 175.0708 28 Q 4.9357 9.2930 120.2992 53.5660 28.5404 173.1740 29 P 4.9984 0.0000 0.0000 62.6373 32.9631 176.3880 30 V 4.6663 8.9612 114.3099 59.8665 36.3521 174.0921 31 E 5.2421 8.7943 120.6105 54.6851 32.5067 175.5218 32 A 4.8594 9.0856 123.9471 49.1916 21.7864 176.6995 33 E 4.3652 9.2265 118.8849 56.3944 30.8749 175.1373 34 D 4.4514 7.3519 118.7471 51.5942 43.0828 175.2693 35 Y 3.8792 8.6155 119.8401 61.2126 38.6369 177.8867 36 D 4.5028 8.2794 119.2513 57.3883 40.7205 178.5261 37 S 4.1143 8.8394 113.8778 61.1860 62.3757 176.1586 38 A 4.0547 7.9966 123.4755 55.1844 18.1900 179.7122 39 V 3.5854 8.1384 117.0284 66.2868 31.4295 177.7722 40 N 4.5361 8.5333 114.6922 55.0912 38.3661 176.1335 41 Q 4.4828 7.6218 117.9856 54.9578 30.7093 176.5009 42 L 4.3612 7.4836 122.8751 51.9659 40.0931 174.4306 43 N 3.1400 6.3181 116.0951 50.8894 39.9126 174.6266 44 E 3.5276 7.7842 119.6996 55.5452 29.8838 174.0673 45 P 4.4985 0.0000 0.0000 61.3893 32.2739 176.0681 46 W 4.3315 8.6435 123.5577 55.8491 29.6620 174.4031 47 P 4.5321 0.0000 0.0000 63.0660 31.3954 176.0802 48 D 4.7959 8.9940 120.9545 55.7441 41.9280 176.5131 49 L 4.7327 7.6701 118.5539 53.8683 45.8553 173.7521 50 I 4.8897 8.6883 125.1568 59.4167 40.5911 174.0951 51 L 4.7985 8.9665 129.8952 53.4506 43.8281 174.7192 52 L 4.8113 8.6489 129.5939 52.7659 44.5993 175.0894 53 E 4.4720 9.0535 129.2946 56.1285 30.0651 177.3161 54 W 4.4032 9.3937 135.0000 61.1263 30.8821 176.6499 55 M 4.1738 8.0085 114.8551 55.0622 31.3183 175.9085 56 L 4.0517 7.3439 120.9774 54.8467 42.7262 175.4721 57 P 4.2558 0.0000 0.0000 63.9713 31.8152 177.2280 58 G 4.0242 9.0130 108.9677 44.6400 0.0000 173.9574 59 G 3.2955 6.7214 104.4623 44.9619 0.0000 171.7204 60 S 4.6496 7.7303 113.3963 56.5185 64.9305 176.2475 61 G 3.7341 8.1791 115.1979 47.6948 0.0000 176.0356 62 I 3.9476 7.8875 121.9154 64.7551 37.2291 178.5229 63 Q 4.1514 8.2340 118.3970 58.6595 28.4326 178.3728 64 F 3.8707 8.7887 122.1723 61.3178 39.2169 177.2877 65 I 3.7855 7.7375 117.8814 64.4573 37.1791 178.1702 66 K 4.0628 8.2211 119.3021 59.7656 31.8315 178.7214 67 H 4.0435 8.3588 118.4375 59.3448 29.4532 177.2832 68 L 3.9306 7.5303 120.6973 57.5614 41.2112 179.0705 69 K 4.0013 7.5037 115.8799 57.8706 32.2093 178.9490 70 R 4.1035 7.6409 118.3897 56.9790 30.4617 176.3947 71 E 4.6396 7.2573 118.0679 54.1067 32.6350 176.5818 72 S 4.0237 8.9765 120.0095 62.1115 63.2413 175.5013 73 M 3.7822 8.0571 118.5180 58.4952 31.9854 177.0000 74 T 4.2419 7.4566 106.1912 61.7709 69.9681 176.1824 75 R 3.9065 7.6110 122.7451 59.0114 30.0042 176.5389 76 D 4.8253 7.7335 113.7473 53.7160 41.6239 175.7403 77 I 4.0712 7.4835 121.8572 60.3059 37.5090 174.4731 78 P 4.6488 0.0000 0.0000 62.8671 32.8907 175.2699 79 V 4.7879 9.0358 121.7194 61.2099 34.5048 174.0901 80 V 4.4846 8.6079 128.4901 61.3201 33.4448 174.1385 81 M 4.6454 8.5041 128.9240 55.0526 33.6781 174.3170 82 L 5.1451 9.0465 129.2063 53.9323 44.0441 175.3221 83 T 5.0956 8.8701 115.7224 59.9777 72.4307 173.5090 84 A 4.7147 9.3090 125.8841 49.8782 17.3435 178.0251 85 R 4.3518 8.7928 116.3135 55.8051 30.6690 178.0676 86 G 3.6560 8.5085 105.4829 47.8131 0.0000 175.6721 87 E 3.8854 8.1276 121.0683 59.2432 29.6994 178.3760 88 E 3.9039 8.1321 118.8183 59.0818 29.7509 178.0343 89 E 3.8087 8.1141 119.3170 59.4560 29.6998 178.4727 90 D 4.2215 8.3925 119.0814 57.4796 40.6667 179.1054 91 R 3.8185 7.5742 117.1250 59.3498 30.3706 179.0760 92 V 3.2434 7.8833 118.3195 65.6483 30.8570 178.1094 93 R 3.6621 8.1878 118.5219 59.1826 29.6201 179.1493 94 G 3.6217 7.6546 104.1265 46.9340 0.0000 174.8889 95 L 4.2405 7.5384 119.1202 53.9513 43.2990 176.1807 96 E 3.8102 7.5007 117.3184 57.7191 26.9704 174.9466 97 T 4.1098 7.6880 106.2867 62.4743 70.0158 176.7072 98 G 3.8993 8.3485 109.9029 45.2374 0.0000 173.5437 99 A 4.1093 7.3460 122.1989 52.1057 18.8705 177.8554 100 D 4.5325 8.6267 121.0493 57.1560 41.8694 175.6234 101 D 4.6372 7.2596 115.8367 53.8806 44.9043 173.2334 102 Y 5.1905 9.0300 116.4795 56.5335 42.3273 175.1082 103 I 4.6820 8.9599 122.2866 59.7247 41.7788 173.5997 104 T 5.1927 8.6636 122.9987 60.4284 69.5587 173.4511 105 K 4.8154 9.0638 127.3372 54.7345 33.3312 175.2069 106 P 4.2621 0.0000 0.0000 62.1949 32.3156 175.4322 107 F 5.0658 7.0220 114.3723 54.5162 40.9649 175.5743 108 S 4.5310 8.4610 116.7732 57.5143 65.3333 173.4080 109 P 4.4022 0.0000 0.0000 65.7057 31.0117 178.9642 110 K 3.9430 8.0374 117.9731 59.5319 32.1725 178.3766 111 E 3.9430 8.4848 119.8068 59.0053 29.6093 178.3532 112 L 3.6926 7.9883 120.4379 58.2776 42.0701 179.2878 113 V 3.5302 7.8100 117.8516 65.6919 31.4633 177.7883 114 A 3.9982 8.3765 121.0164 55.2549 18.2680 179.8828 115 R 3.8479 8.1851 116.7245 59.4037 30.1796 179.3635 116 I 3.5799 7.5145 119.3767 64.2881 37.0370 178.4918 117 K 3.9894 8.3636 119.3758 59.5731 31.7814 179.1882 118 A 3.9928 8.1011 120.7808 55.3816 18.3418 180.1826 119 V 3.6257 7.7906 110.8884 64.7075 31.3748 178.7996 120 M 4.1547 7.9922 117.8513 58.0991 31.8450 178.4534 121 R 4.0554 8.1140 118.8281 58.9283 30.4228 178.0073 122 R 4.1800 7.7331 113.2896 55.7797 30.1064 176.4309 123 I 3.6191 7.5186 125.5022 62.0053 37.9124 173.3055 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 3 R 8.11 4.39 0.00 2.15 2.14 0.00 3.29 0.00 0.00 3.41 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 4 R 9.36 4.64 0.00 1.95 2.04 0.00 3.27 0.00 0.00 3.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 5 I 8.58 4.84 1.82 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 1.33 0.61 0.80 0.00 0.00 6 L 8.88 4.65 0.00 1.79 1.58 0.97 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 7 V 9.03 4.34 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 0.94 0.00 0.00 0.91 0.00 0.00 8 V 8.47 4.62 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 0.76 0.00 0.00 9 E 8.63 5.04 0.00 2.11 1.72 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 2.21 2.28 0.00 10 A 9.37 4.26 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 11 E 8.83 4.30 0.00 2.12 1.90 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 2.31 2.46 0.00 12 A 8.75 4.01 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 13 P 0.00 4.18 0.00 2.25 2.30 0.00 3.61 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 2.06 2.04 0.00 14 I 7.66 3.67 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 1.61 0.66 1.00 0.00 0.00 15 R 8.20 3.97 0.00 2.01 2.10 0.00 3.13 0.00 0.00 3.47 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.91 0.00 16 E 8.56 4.16 0.00 2.19 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 2.36 2.49 0.00 17 M 8.17 4.08 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.53 0.00 18 V 8.22 3.74 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 1.04 0.00 0.00 1.28 0.00 0.00 19 C 8.69 4.16 0.00 3.16 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 20 F 8.62 4.24 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 21 V 8.03 3.59 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 1.09 0.00 0.00 1.20 0.00 0.00 22 L 8.22 4.11 0.00 1.86 1.73 0.79 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 23 E 8.67 4.29 0.00 2.11 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 0.00 2.49 2.05 0.00 24 Q 7.89 3.90 0.00 1.91 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.12 0.00 0.00 0.00 0.00 0.00 1.44 1.35 0.00 25 N 7.61 4.84 0.00 3.08 3.05 0.00 0.00 7.16 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 26 G 7.95 3.76 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 0.00 0.00 0.00 27 F 8.17 4.48 0.00 3.09 3.09 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 0.00 0.00 0.00 0.00 28 Q 9.29 4.94 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.99 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 29 P 0.00 5.00 0.00 2.10 2.06 0.00 3.76 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 2.02 2.21 0.00 30 V 8.96 4.67 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 0.71 0.00 0.00 0.99 0.00 0.00 31 E 8.79 5.24 0.00 1.82 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 2.22 2.29 0.00 32 A 9.09 4.86 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 33 E 9.23 4.37 0.00 2.15 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 0.00 2.32 2.24 0.00 34 D 7.35 4.45 0.00 3.11 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 35 Y 8.62 3.88 0.00 3.24 2.92 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 36 D 8.28 4.50 0.00 2.79 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 37 S 8.84 4.11 0.00 3.88 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 38 A 8.00 4.05 1.34 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 39 V 8.14 3.59 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 1.02 0.00 0.00 0.90 0.00 0.00 40 N 8.53 4.54 0.00 2.90 2.85 0.00 0.00 6.97 7.27 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 41 Q 7.62 4.48 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 7.47 0.00 0.00 0.00 0.00 0.00 2.27 2.55 0.00 42 L 7.48 4.36 0.00 1.79 1.82 0.82 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 43 N 6.32 3.14 0.00 2.29 2.35 0.00 0.00 6.29 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 44 E 7.78 3.53 0.00 1.87 1.77 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 2.29 2.31 0.00 45 P 0.00 4.50 0.00 2.23 2.05 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 46 W 8.64 4.33 0.00 3.31 3.23 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 0.00 47 P 0.00 4.53 0.00 2.14 2.05 0.00 3.95 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.17 0.00 48 D 8.99 4.80 0.00 2.69 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 49 L 7.67 4.73 0.00 1.69 1.43 0.87 0.85 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 50 I 8.69 4.89 1.95 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.78 0.94 0.00 0.00 51 L 8.97 4.80 0.00 1.56 1.46 0.84 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.65 4.81 0.00 1.64 1.45 0.19 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 53 E 9.05 4.47 0.00 2.19 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 2.45 2.39 0.00 54 W 9.39 4.40 0.00 3.33 3.16 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 55 M 8.01 4.17 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.74 0.00 56 L 7.34 4.05 0.00 1.72 1.52 0.99 0.81 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 57 P 0.00 4.26 0.00 2.21 1.93 0.00 3.59 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 2.06 0.00 58 G 9.01 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 59 G 6.72 3.30 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 60 S 7.73 4.65 0.00 3.83 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 61 G 8.18 3.73 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 0.00 0.00 0.00 62 I 7.89 3.95 2.04 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.42 1.04 0.00 0.00 63 Q 8.23 4.15 0.00 2.41 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.91 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 64 F 8.79 3.87 0.00 3.00 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 65 I 7.74 3.79 1.99 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.00 0.96 0.00 0.00 66 K 8.22 4.06 0.00 1.83 1.90 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.66 7.81 67 H 8.36 4.04 0.00 3.30 3.25 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 68 L 7.53 3.93 0.00 1.75 1.82 0.98 0.82 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 69 K 7.50 4.00 0.00 1.76 1.83 0.00 1.70 0.00 0.00 1.68 0.00 0.00 3.17 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.69 1.61 7.81 70 R 7.64 4.10 0.00 1.78 1.92 0.00 3.07 0.00 0.00 3.21 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.88 0.00 71 E 7.26 4.64 0.00 1.95 1.73 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 2.17 2.16 0.00 72 S 8.98 4.02 0.00 3.77 3.88 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 73 M 8.06 3.78 0.00 1.35 1.70 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.81 0.00 74 T 7.46 4.24 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 1.33 0.00 0.00 75 R 7.61 3.91 0.00 1.95 2.07 0.00 3.18 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 76 D 7.73 4.83 0.00 2.62 2.61 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 77 I 7.48 4.07 2.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.44 0.96 0.00 0.00 78 P 0.00 4.65 0.00 2.09 2.16 0.00 3.86 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 79 V 9.04 4.79 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 1.04 0.00 0.00 1.01 0.00 0.00 80 V 8.61 4.48 1.96 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 0.84 0.00 0.00 0.83 0.00 0.00 81 M 8.50 4.65 0.00 2.06 1.74 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.62 0.00 82 L 9.05 5.15 0.00 1.75 1.70 1.03 0.70 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 83 T 8.87 5.10 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 1.27 0.00 0.00 84 A 9.31 4.71 1.35 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 85 R 8.79 4.35 0.00 2.03 2.16 0.00 3.14 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 86 G 8.51 3.66 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 0.00 87 E 8.13 3.89 0.00 2.04 1.96 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 2.38 2.36 0.00 88 E 8.13 3.90 0.00 2.12 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 2.37 2.42 0.00 89 E 8.11 3.81 0.00 2.08 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 2.12 2.30 0.00 90 D 8.39 4.22 0.00 2.73 2.63 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 91 R 7.57 3.82 0.00 1.88 1.93 0.00 3.17 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 92 V 7.88 3.24 1.72 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 0.40 0.00 0.00 -0.20 0.00 0.00 93 R 8.19 3.66 0.00 1.76 1.69 0.00 2.75 0.00 0.00 2.88 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.98 0.00 94 G 7.65 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.54 4.24 0.00 1.65 1.72 0.87 1.05 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 96 E 7.50 3.81 0.00 2.12 1.98 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 2.26 2.22 0.00 97 T 7.69 4.11 4.40 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 1.17 0.00 0.00 98 G 8.35 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 99 A 7.35 4.11 0.90 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 0.00 100 D 8.63 4.53 0.00 2.62 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 0.00 101 D 7.26 4.64 0.00 2.63 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 0.00 0.00 0.00 0.00 102 Y 9.03 5.19 0.00 2.75 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 0.00 103 I 8.96 4.68 1.76 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 1.00 1.45 0.70 0.00 0.00 104 T 8.66 5.19 4.47 0.00 0.00 0.00 0.00 0.00 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 0.00 105 K 9.06 4.82 0.00 1.75 1.72 0.00 1.83 0.00 0.00 1.93 0.00 0.00 3.11 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.82 1.74 7.81 106 P 0.00 4.26 0.00 2.03 1.90 0.00 3.70 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 1.94 1.90 0.00 107 F 7.02 5.07 0.00 3.14 3.29 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 0.00 108 S 8.46 4.53 0.00 4.13 4.08 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 0.00 109 P 0.00 4.40 0.00 2.25 2.25 0.00 3.67 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 2.19 2.26 0.00 110 K 8.04 3.94 0.00 1.86 1.84 0.00 1.75 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.52 7.81 111 E 8.48 3.94 0.00 2.12 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 2.32 2.33 0.00 112 L 7.99 3.69 0.00 1.64 1.81 0.48 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.81 3.53 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 1.17 0.00 0.00 1.06 0.00 0.00 114 A 8.38 4.00 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 0.00 115 R 8.19 3.85 0.00 1.73 1.93 0.00 3.46 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 116 I 7.51 3.58 1.70 0.00 0.00 0.51 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 0.77 0.59 0.00 0.00 117 K 8.36 3.99 0.00 2.04 1.92 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.62 1.77 7.81 118 A 8.10 3.99 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 0.00 119 V 7.79 3.63 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 0.86 0.00 0.00 0.98 0.00 0.00 120 M 7.99 4.15 0.00 2.06 2.19 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 2.88 2.57 0.00 121 R 8.11 4.06 0.00 1.93 2.10 0.00 3.26 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 122 R 7.73 4.18 0.00 1.95 2.03 0.00 3.27 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.81 0.00 123 I 7.52 3.62 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 1.19 0.60 0.91 0.00 0.00