NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4388 8.3349 116.7936 58.0161 64.3031 173.1911 2 L 4.1398 8.2363 123.5244 52.8126 42.3044 176.4171 3 S 4.5480 9.5703 119.9890 57.5650 66.5117 175.3745 4 S 4.0790 8.4487 117.8120 61.5100 62.4842 176.9074 5 K 3.9024 7.9521 121.9404 59.5005 31.7282 178.4939 6 D 4.5656 7.9287 120.4503 56.8080 40.6974 178.8681 7 K 3.9206 8.1559 119.0091 59.4878 31.9657 178.9276 8 D 4.3063 8.3166 119.1381 57.5190 40.7807 178.9124 9 A 3.9833 7.9978 120.9825 55.0810 18.3616 179.9424 10 V 3.4112 7.8366 116.6928 66.0157 31.5982 178.3680 11 K 3.8604 8.1082 118.2227 59.5167 31.7639 179.1847 12 A 4.0185 8.3130 121.2684 54.9134 18.3458 179.5159 13 L 3.7849 7.9791 119.0181 58.0241 41.9546 179.0120 14 W 3.9699 8.1250 127.3442 60.0872 30.3572 177.6983 15 G 3.8604 8.1701 105.8115 48.0830 0.0000 175.8412 16 K 3.9871 7.4809 120.2834 58.2438 32.2679 178.5659 17 I 3.7224 7.1562 110.8626 60.6060 37.7395 177.1429 18 A 3.7762 7.2604 123.2741 56.1102 17.9454 179.5866 19 D 4.3705 8.0866 114.8926 56.6249 41.1425 178.1143 20 K 4.4388 8.0339 116.5444 55.8188 32.6375 177.8074 21 A 3.8169 7.6173 122.8413 55.4791 18.1795 179.8190 22 E 3.9283 8.0754 116.2864 59.6740 29.5511 179.3918 23 E 4.0862 8.1031 118.1213 59.1406 29.5555 179.2682 24 I 3.8059 8.1194 120.4242 64.3262 37.2080 178.6308 25 G 3.6433 8.2094 106.2570 47.7643 0.0000 175.5776 26 A 3.9660 7.8764 123.0557 54.9992 18.3391 179.5088 27 D 4.2708 8.3077 117.2847 57.4265 40.8566 178.9092 28 A 3.9877 8.1866 121.3814 54.9405 18.4634 179.4987 29 L 4.0268 8.0775 119.1154 58.2630 42.0843 179.3613 30 G 3.6956 8.2070 105.7816 47.8237 0.0000 175.8978 31 R 3.9610 8.2618 120.5914 59.1996 30.1150 178.4660 32 M 4.2057 8.1773 117.9835 59.0101 31.9004 178.1751 33 L 4.0757 7.9280 118.2539 57.8559 41.6037 179.5012 34 A 4.0547 7.6232 119.5021 54.9771 18.6353 179.4378 35 V 3.7333 8.0997 115.9452 64.1949 33.1451 175.7998 36 Y 4.6440 8.2800 117.0549 54.6500 38.0029 174.1256 37 P 4.7533 0.0000 0.0000 64.1194 31.5962 178.1382 38 Q 4.1181 8.2233 117.1897 59.2032 28.5305 177.8950 39 T 4.4489 8.1736 111.1745 63.6276 69.1030 176.8172 40 K 4.1552 8.1116 122.1181 59.6613 31.7575 178.6295 41 T 3.6576 7.8471 112.3654 65.4679 67.1501 174.9458 42 Y 3.9999 7.1437 116.3113 59.3425 37.8891 176.2729 43 F 4.2877 7.9279 119.0920 56.7868 40.3466 176.4063 44 S 4.2974 8.1765 114.2697 60.1132 62.6351 173.9457 45 H 4.7187 7.7871 115.8391 55.2832 28.7088 174.4405 46 W 4.9859 7.9047 121.2496 55.2132 29.9495 176.4404 47 K 4.1034 8.9150 123.7816 58.1653 31.8686 176.4248 48 D 4.7608 8.0251 117.0238 52.6399 42.1972 174.6832 49 L 4.6612 8.4814 125.8263 54.4216 42.4153 177.4124 50 S 4.3487 8.0504 115.0996 57.3286 63.4844 173.3970 51 P 4.4018 0.0000 0.0000 64.2743 31.0269 176.8337 52 G 3.9533 7.2907 107.2740 45.4007 0.0000 174.9077 53 S 4.2360 7.9665 116.1660 57.6992 65.0006 174.8653 54 A 3.8806 8.4215 125.7912 55.2042 18.1204 178.5606 55 P 3.7977 0.0000 0.0000 65.2017 31.2189 179.1638 56 V 2.8065 6.9217 117.0871 65.5591 31.4074 177.5273 57 N 4.1721 7.8328 116.2547 56.6756 37.9575 177.5682 58 K 3.9943 7.9994 119.4756 59.6310 32.1352 179.0390 59 H 4.4808 8.4815 119.0244 58.8860 29.7643 177.4529 60 G 3.6986 8.5298 108.3166 47.6696 0.0000 175.7268 61 K 4.2400 7.8019 121.6192 59.0767 32.0047 179.5191 62 T 3.9076 7.5121 114.7905 66.6245 68.3091 176.7290 63 I 3.7647 7.7943 121.5841 64.8902 37.1424 178.4768 64 M 4.4345 8.2337 119.5580 58.3635 31.7522 179.0775 65 G 3.8036 8.7063 106.5677 47.7921 0.0000 176.0326 66 G 3.7024 8.4554 108.3676 47.6003 0.0000 175.8853 67 L 4.0514 8.4031 121.5541 57.4293 41.6078 179.7160 68 V 3.5531 8.3364 118.6056 65.8965 31.4321 177.5010 69 D 4.2904 8.2644 117.5764 57.3178 40.8483 178.0200 70 A 3.9160 7.7216 119.8920 55.2038 18.5164 179.3617 71 V 3.3892 7.7811 116.4996 66.0948 31.2799 178.0488 72 A 4.0173 7.8572 119.1340 54.6189 18.3227 178.8136 73 S 4.6246 7.8391 111.8007 58.3995 63.1111 176.0382 74 I 3.6690 7.3260 124.6837 64.0427 37.7377 176.9214 75 D 4.5221 7.9840 118.4248 56.6319 41.2509 176.4663 76 D 4.6950 8.1073 117.7929 52.0678 43.0964 175.2205 77 L 3.9722 8.1250 124.3954 57.0942 41.6529 178.0638 78 N 4.2086 8.1726 115.7999 56.5355 38.3280 177.1346 79 A 4.1082 7.8837 120.1369 55.0665 18.5527 179.6463 80 G 3.7012 8.1166 103.4271 47.0482 0.0000 174.9967 81 L 4.6042 8.1514 119.6686 54.2405 41.9367 178.0488 82 L 3.9067 7.8742 122.9253 58.3833 41.9600 178.7848 83 A 4.0052 7.9785 119.9564 55.2936 18.3804 179.4177 84 L 4.0242 7.9130 116.9784 57.8011 41.6318 179.4533 85 S 4.2350 8.6016 113.4613 61.6829 62.4018 176.0154 86 E 4.0984 8.4495 121.3518 59.3261 29.1614 179.1271 87 L 3.9408 8.1255 120.2481 58.7966 42.2317 178.9130 88 H 4.3308 8.4117 115.4923 58.1340 28.6576 177.8663 89 A 2.7212 7.9985 123.1478 54.4307 17.8599 179.0723 90 F 4.5738 8.1518 113.8927 58.9182 40.3953 177.8979 91 T 4.1158 7.8685 114.1295 66.2751 68.5956 175.5809 92 L 4.2038 7.6616 118.8450 54.7689 42.6817 177.2525 93 R 4.0899 7.5114 111.8609 56.5925 27.5522 173.4208 94 V 3.7560 8.7184 120.7072 60.4748 32.8361 174.8726 95 D 4.2562 8.7600 127.3041 54.0553 40.8771 174.9665 96 P 3.5464 0.0000 0.0000 63.8935 30.9950 177.3828 97 A 4.1101 8.1161 120.7739 54.2637 18.4949 178.5857 98 N 4.3704 8.0318 115.0904 54.8411 38.7155 177.3048 99 F 4.3938 7.1620 118.9838 60.5036 38.9382 177.6353 100 K 4.0864 8.0516 117.8373 59.7214 32.4101 179.0630 101 I 3.2707 7.5688 120.6478 64.1280 36.9743 177.7829 102 L 3.9229 7.5921 120.7857 58.2562 41.8817 179.0034 103 S 3.7457 8.0302 115.0469 61.8881 62.7690 176.1400 104 H 4.1021 8.2939 120.7516 59.6774 29.4821 177.0933 105 C 4.1908 8.0817 118.3964 62.6085 27.9144 176.0934 106 I 3.6462 7.9026 121.7664 64.3122 36.6055 178.2812 107 L 4.1377 7.7637 119.7666 57.8752 41.6307 179.7540 108 V 3.3761 7.9628 118.3172 65.9564 31.2147 177.6371 109 Q 3.9149 8.1438 119.2767 59.3690 28.8875 178.2545 110 L 4.2943 8.5777 119.9122 58.0385 41.4850 179.4516 111 A 3.3581 7.6025 119.7732 55.0216 18.2263 179.8601 112 V 3.6257 7.4291 109.6290 63.7610 31.6150 178.1668 113 K 3.9978 7.3942 115.6647 56.8554 33.9761 177.2448 114 F 5.0930 8.5743 116.8145 55.7398 39.4727 174.7725 115 P 4.5113 0.0000 0.0000 65.7021 31.8036 179.3373 116 K 4.2173 8.1429 117.2896 59.0043 32.1791 177.7981 117 D 4.5706 8.2012 117.8802 56.6000 41.4513 176.8331 118 F 4.3420 7.9718 119.6132 56.9575 38.1820 176.0792 119 T 4.2203 7.3731 112.3518 60.9516 71.3196 173.1229 120 P 4.2674 0.0000 0.0000 65.9105 31.4972 178.9287 121 E 3.9502 8.0374 116.9854 59.0315 29.4930 179.2775 122 V 3.0754 7.4791 118.2020 65.9893 31.4581 177.4111 123 H 3.8832 8.0495 118.1891 59.1587 29.6108 176.6506 124 L 3.9238 7.8392 121.9184 58.4249 41.7660 179.1878 125 S 4.3154 7.6149 115.7125 61.2956 62.7004 176.3178 126 Y 4.4186 7.7389 119.3334 61.2793 37.6603 178.2164 127 D 4.6124 8.7623 119.2803 57.4147 41.3645 178.3264 128 K 3.9949 8.3978 119.1589 59.3750 32.0511 178.8784 129 F 4.0543 8.5495 121.0557 61.6068 39.3539 177.3533 130 F 3.9770 8.3884 117.2174 60.3295 38.6428 178.0152 131 S 4.1370 8.3327 114.9762 61.4863 62.5409 176.5117 132 A 3.9079 7.8798 123.5641 54.8447 17.9898 179.8374 133 V 3.1815 7.3606 116.5233 66.0206 31.6136 178.0827 134 A 3.5500 7.7806 120.4148 55.0392 17.9570 179.6308 135 R 3.7272 7.7894 115.9181 59.3773 30.4376 178.0497 136 A 4.3077 7.9580 122.1874 54.7108 18.1227 179.6791 137 L 3.8675 7.5964 115.8104 57.1692 41.7168 178.8275 138 A 4.2882 7.6914 119.7272 53.2026 18.3724 178.8747 139 E 3.9768 7.5497 116.9830 59.2869 29.6984 178.3028 140 K 4.5543 7.8898 114.4719 56.6011 32.2957 177.5162 141 Y 3.6875 7.9972 119.4278 60.7099 38.0474 176.2079 142 R 4.2731 7.8404 119.8404 56.7333 28.9661 174.4118 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 4.44 0.00 3.87 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 2 L 8.24 4.14 0.00 1.73 1.62 1.01 0.68 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 3 S 9.57 4.55 0.00 4.05 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 4 S 8.45 4.08 0.00 3.87 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 5 K 7.95 3.90 0.00 1.80 1.78 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.50 7.81 6 D 7.93 4.57 0.00 2.96 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 7 K 8.16 3.92 0.00 1.89 1.79 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.68 7.81 8 D 8.32 4.31 0.00 2.81 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 9 A 8.00 3.98 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 10 V 7.84 3.41 1.84 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 -0.21 0.00 0.00 0.76 0.00 0.00 11 K 8.11 3.86 0.00 1.90 1.81 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.55 7.81 12 A 8.31 4.02 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 7.98 3.78 0.00 1.68 1.72 0.63 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 14 W 8.12 3.97 0.00 3.43 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 15 G 8.17 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 16 K 7.48 3.99 0.00 1.59 1.62 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.51 7.81 17 I 7.16 3.72 1.46 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 -0.05 -0.12 0.00 0.00 18 A 7.26 3.78 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 19 D 8.09 4.37 0.00 2.68 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 20 K 8.03 4.44 0.00 1.99 1.88 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.40 1.57 7.81 21 A 7.62 3.82 1.09 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 0.00 0.00 22 E 8.08 3.93 0.00 1.97 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 2.38 2.34 0.00 23 E 8.10 4.09 0.00 2.11 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 2.38 0.00 24 I 8.12 3.81 2.00 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 1.56 1.04 0.94 0.00 0.00 25 G 8.21 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 0.00 0.00 0.00 26 A 7.88 3.97 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 27 D 8.31 4.27 0.00 2.83 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 28 A 8.19 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 29 L 8.08 4.03 0.00 2.05 1.79 0.98 1.22 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 30 G 8.21 3.70 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 0.00 0.00 0.00 31 R 8.26 3.96 0.00 2.09 2.05 0.00 3.15 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.89 0.00 32 M 8.18 4.21 0.00 2.28 2.14 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.74 0.00 33 L 7.93 4.08 0.00 1.83 1.78 1.02 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.62 4.05 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 35 V 8.10 3.73 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 0.30 0.00 0.00 0.97 0.00 0.00 36 Y 8.28 4.64 0.00 3.14 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 4.75 0.00 2.28 2.33 0.00 3.87 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.87 0.00 38 Q 8.22 4.12 0.00 2.25 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.11 0.00 0.00 0.00 0.00 0.00 2.44 2.52 0.00 39 T 8.17 4.45 4.53 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 0.00 0.00 0.00 1.42 0.00 0.00 40 K 8.11 4.16 0.00 1.98 1.94 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.54 1.53 7.81 41 T 7.85 3.66 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 0.45 0.00 0.00 42 Y 7.14 4.00 0.00 2.32 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 0.00 0.00 0.00 43 F 7.93 4.29 0.00 2.57 1.46 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 44 S 8.18 4.30 0.00 3.94 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 45 H 7.79 4.72 0.00 3.36 3.43 0.00 5.49 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 W 7.90 4.99 0.00 3.33 2.99 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 47 K 8.91 4.10 0.00 1.81 1.92 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.41 7.81 48 D 8.03 4.76 0.00 2.60 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 49 L 8.48 4.66 0.00 1.75 1.78 1.01 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 50 S 8.05 4.35 0.00 4.04 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 51 P 0.00 4.40 0.00 2.17 2.30 0.00 3.72 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 1.97 1.95 0.00 52 G 7.29 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 53 S 7.97 4.24 0.00 3.99 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 54 A 8.42 3.88 1.27 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 0.00 0.00 0.00 55 P 0.00 3.80 0.00 0.94 1.31 0.00 3.33 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 56 V 6.92 2.81 1.86 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 0.93 0.00 0.00 0.73 0.00 0.00 57 N 7.83 4.17 0.00 2.92 2.80 0.00 0.00 7.09 6.37 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 58 K 8.00 3.99 0.00 1.91 1.83 0.00 1.52 0.00 0.00 1.53 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.47 7.81 59 H 8.48 4.48 0.00 3.41 3.33 0.00 5.79 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 3.70 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 0.00 0.00 0.00 61 K 7.80 4.24 0.00 2.02 1.89 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.51 7.81 62 T 7.51 3.91 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 1.28 0.00 0.00 63 I 7.79 3.76 2.08 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.94 1.03 0.00 0.00 64 M 8.23 4.43 0.00 2.16 2.31 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.93 0.00 65 G 8.71 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 66 G 8.46 3.70 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 0.00 0.00 0.00 67 L 8.40 4.05 0.00 2.20 1.68 1.38 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 68 V 8.34 3.55 2.37 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 1.14 0.00 0.00 1.60 0.00 0.00 69 D 8.26 4.29 0.00 2.97 2.90 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 70 A 7.72 3.92 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 7.78 3.39 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 0.73 0.00 0.00 -0.32 0.00 0.00 72 A 7.86 4.02 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 73 S 7.84 4.62 0.00 3.97 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 74 I 7.33 3.67 2.01 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.93 0.89 0.00 0.00 75 D 7.98 4.52 0.00 2.69 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 76 D 8.11 4.69 0.00 2.64 2.47 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 0.00 77 L 8.12 3.97 0.00 1.64 1.58 0.73 0.64 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 78 N 8.17 4.21 0.00 2.94 2.86 0.00 0.00 7.03 7.54 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 79 A 7.88 4.11 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 80 G 8.12 3.70 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 0.00 0.00 0.00 81 L 8.15 4.60 0.00 1.57 1.60 0.77 0.42 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 82 L 7.87 3.91 0.00 1.87 1.68 0.94 1.01 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 83 A 7.98 4.01 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 84 L 7.91 4.02 0.00 1.86 1.78 0.95 0.92 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 85 S 8.60 4.24 0.00 3.98 4.06 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 0.00 0.00 0.00 0.00 86 E 8.45 4.10 0.00 2.11 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 2.43 2.52 0.00 87 L 8.13 3.94 0.00 1.86 1.99 0.92 0.94 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 88 H 8.41 4.33 0.00 3.55 3.69 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 8.00 2.72 -0.42 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 90 F 8.15 4.57 0.00 3.01 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 91 T 7.87 4.12 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 1.22 0.00 0.00 92 L 7.66 4.20 0.00 1.60 1.66 0.80 1.03 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 93 R 7.51 4.09 0.00 1.83 1.99 0.00 3.10 0.00 0.00 3.81 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 94 V 8.72 3.76 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 -0.01 0.00 0.00 0.56 0.00 0.00 95 D 8.76 4.26 0.00 2.77 2.53 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 0.00 0.00 0.00 0.00 96 P 0.00 3.55 0.00 2.00 1.21 0.00 3.54 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.41 0.00 97 A 8.12 4.11 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 98 N 8.03 4.37 0.00 2.37 2.65 0.00 0.00 6.85 8.32 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 99 F 7.16 4.39 0.00 3.02 2.93 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 0.00 100 K 8.05 4.09 0.00 1.98 2.08 0.00 1.48 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.46 7.81 101 I 7.57 3.27 1.88 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.35 0.34 0.00 0.00 102 L 7.59 3.92 0.00 1.75 1.73 0.97 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 103 S 8.03 3.75 0.00 4.09 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 0.00 104 H 8.29 4.10 0.00 3.26 3.41 0.00 5.78 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 8.08 4.19 0.00 3.15 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 0.00 106 I 7.90 3.65 1.54 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.70 0.94 0.00 0.00 107 L 7.76 4.14 0.00 1.85 1.89 1.17 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.96 3.38 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 0.93 0.00 0.00 0.77 0.00 0.00 109 Q 8.14 3.91 0.00 2.25 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.54 0.00 0.00 0.00 0.00 0.00 2.55 2.48 0.00 110 L 8.58 4.29 0.00 2.20 2.20 1.12 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.60 3.36 0.69 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 0.00 0.00 112 V 7.43 3.63 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 0.76 0.00 0.00 0.90 0.00 0.00 113 K 7.39 4.00 0.00 1.29 0.99 0.00 1.58 0.00 0.00 1.64 0.00 0.00 2.76 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.24 1.56 7.81 114 F 8.57 5.09 0.00 3.26 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 0.00 115 P 0.00 4.51 0.00 2.27 2.40 0.00 3.79 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 116 K 8.14 4.22 0.00 1.88 2.00 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.51 1.53 7.81 117 D 8.20 4.57 0.00 3.01 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 0.00 118 F 7.97 4.34 0.00 3.32 3.21 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 0.00 119 T 7.37 4.22 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 1.23 0.00 0.00 120 P 0.00 4.27 0.00 2.18 2.16 0.00 3.60 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 121 E 8.04 3.95 0.00 1.95 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 2.36 2.33 0.00 122 V 7.48 3.08 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 0.02 0.00 0.00 0.77 0.00 0.00 123 H 8.05 3.88 0.00 3.37 3.43 0.00 5.67 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 L 7.84 3.92 0.00 1.77 1.77 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 125 S 7.61 4.32 0.00 3.87 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 0.00 126 Y 7.74 4.42 0.00 3.22 3.22 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 0.00 127 D 8.76 4.61 0.00 3.08 2.93 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 0.00 128 K 8.40 3.99 0.00 2.05 1.88 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.64 7.81 129 F 8.55 4.05 0.00 3.03 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 0.00 130 F 8.39 3.98 0.00 3.21 3.06 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 0.00 0.00 0.00 0.00 131 S 8.33 4.14 0.00 4.03 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 0.00 132 A 7.88 3.91 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 0.00 133 V 7.36 3.18 1.87 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 0.87 0.00 0.00 0.02 0.00 0.00 134 A 7.78 3.55 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 0.00 135 R 7.79 3.73 0.00 1.96 1.90 0.00 3.26 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 136 A 7.96 4.31 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 0.00 137 L 7.60 3.87 0.00 0.58 0.97 0.34 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.69 4.29 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 0.00 139 E 7.55 3.98 0.00 2.15 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 0.00 2.35 2.53 0.00 140 K 7.89 4.55 0.00 1.80 2.01 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.33 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.49 1.62 7.81 141 Y 8.00 3.69 0.00 3.06 3.06 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 0.00 0.00 0.00 0.00 142 R 7.84 4.27 0.00 1.94 1.92 0.00 3.11 0.00 0.00 3.32 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00