NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3535 0.0000 0.0000 62.4136 32.0772 175.5162 2 I 4.1013 8.3197 125.2661 59.3417 38.1683 170.6244 3 V 4.4736 8.2315 119.1957 59.8027 34.6293 175.4928 4 D 5.0505 8.3531 118.1606 52.6525 40.0495 175.0009 5 S 4.5212 7.8589 112.3354 58.6365 66.6578 175.8901 6 G 3.9478 9.1920 108.7417 46.1272 0.0000 174.1422 7 S 4.6407 8.2842 117.4176 56.7099 65.4350 173.2563 8 V 4.4557 7.8937 116.6303 58.8855 34.8853 175.7541 9 A 4.1623 8.3627 125.0113 51.3822 18.8979 175.9326 10 P 4.3112 0.0000 0.0000 62.3937 31.9508 176.7396 11 L 4.1964 8.2736 122.5224 54.6528 42.0705 178.1257 12 S 4.4661 9.2567 119.6849 57.3199 65.3956 175.3105 13 A 3.9243 8.4037 122.8135 55.1992 18.1019 179.4998 14 A 3.9375 7.9718 118.7162 55.4341 18.4204 179.4509 15 E 3.9332 7.9910 116.4237 59.5534 29.4895 179.7024 16 K 3.9138 8.1957 118.4581 59.9406 32.0333 179.4321 17 T 3.8712 8.0764 115.9025 66.5835 68.3408 176.6354 18 K 4.0264 8.2908 121.5224 59.4241 32.1918 179.0025 19 I 3.9147 8.1630 120.4642 64.6028 37.0614 178.6205 20 R 4.0876 8.3752 119.3916 59.3345 29.6694 179.2862 21 S 4.2723 7.9017 112.7637 61.1625 63.2476 176.0670 22 A 4.1649 7.9917 123.7957 54.4107 18.3777 178.9912 23 W 4.3251 8.7208 127.0333 60.0238 30.7791 177.8839 24 A 4.0785 8.1352 121.1403 55.0705 17.5380 177.8433 25 P 4.1955 0.0000 0.0000 65.0791 31.2766 178.6512 26 V 3.5088 7.4813 116.4724 66.2011 31.1738 177.2610 27 Y 3.9412 7.4508 118.4653 60.1904 38.6598 177.1608 28 S 4.2552 8.2992 115.4502 60.3325 63.5290 173.9057 29 N 4.7402 7.6914 120.2499 52.0057 39.2086 175.2576 30 Y 4.1597 7.4821 118.6235 60.0247 38.0773 177.2999 31 E 3.8409 7.0841 119.9271 59.5880 29.6262 179.3143 32 T 3.8027 7.5424 114.8921 66.8137 68.7678 176.8205 33 S 4.2127 7.9015 117.0057 61.6490 62.8044 177.1791 34 G 3.6760 8.5890 108.5136 47.7496 0.0000 175.8830 35 V 3.5730 7.5639 120.8413 65.9112 31.5581 177.6972 36 D 4.4479 8.1362 118.5264 57.4743 40.5394 179.0232 37 I 3.7372 7.7502 120.0270 64.3168 37.1191 178.1246 38 L 4.0727 8.1169 121.0525 58.2492 41.8753 179.0903 39 V 3.5713 8.2783 118.4100 66.0574 31.2507 177.8356 40 K 3.9162 8.4934 119.6586 59.3412 31.9765 178.5993 41 F 4.3662 8.5010 121.1386 61.1495 39.2300 176.8947 42 F 3.6580 8.6871 119.9680 61.5272 39.2561 176.4817 43 T 3.8585 8.0199 107.3312 64.3674 68.7354 175.5527 44 S 4.3410 7.4016 115.4179 60.0551 63.6352 174.6170 45 T 4.4267 7.0280 116.5214 59.4927 68.7481 172.1211 46 P 3.8349 0.0000 0.0000 65.5667 31.3605 177.3938 47 A 3.9341 8.0054 118.3673 55.3630 18.2801 179.2560 48 A 3.9381 7.5051 117.8637 54.4928 18.2666 179.6889 49 Q 4.3010 7.9885 117.9485 59.0632 28.4906 178.5855 50 E 4.0120 7.6522 116.2436 59.1030 29.4132 178.4288 51 F 4.4928 7.9476 116.0648 57.5271 40.6923 176.0464 52 F 4.5207 8.2604 119.2994 54.2929 38.2204 174.0065 53 P 4.1379 0.0000 0.0000 65.7131 31.6936 178.5901 54 K 4.2689 7.8183 114.1769 57.9151 32.5214 177.3188 55 F 5.0083 8.6528 118.2646 56.7582 39.2076 175.1507 56 K 4.1715 7.6998 123.6554 58.3616 32.0169 176.9868 57 G 3.9424 9.2445 115.2103 45.4040 0.0000 172.8976 58 M 4.8172 7.9353 118.7043 54.1298 31.5677 175.7447 59 T 4.3555 8.5683 114.0066 63.5235 70.5807 176.5338 60 S 4.3088 7.7385 117.8001 57.3638 65.0896 174.7732 61 A 4.0431 8.4469 125.1230 55.1746 18.0175 179.3218 62 D 4.2839 8.1392 115.3401 57.8464 41.3971 178.4994 63 Q 4.0923 7.6909 117.0790 59.0111 28.6617 178.5899 64 L 3.7271 7.3312 118.7486 57.9239 41.4411 179.9190 65 K 3.9388 7.7930 116.8314 59.0301 31.9729 178.9152 66 K 4.2006 7.6105 117.4926 56.9353 32.7598 177.4634 67 S 4.1238 7.2962 114.9247 57.9015 62.9491 174.8423 68 A 4.1067 8.6971 129.4591 55.3753 18.0829 179.4061 69 D 4.5540 8.1455 117.1220 57.3799 40.8898 178.9636 70 V 3.4279 7.4754 119.0832 65.6525 31.3769 178.2907 71 R 3.9298 8.0439 117.8200 59.0193 30.0284 178.4957 72 W 4.8653 8.5253 128.1792 61.2691 30.7960 177.3511 73 H 3.9370 8.3538 117.4187 59.3226 29.3085 177.0647 74 A 4.1367 8.4980 122.7891 55.1536 18.2059 179.5207 75 E 4.1568 8.6613 117.6153 59.6267 29.3332 179.7701 76 R 3.7122 7.3881 117.2127 59.0311 30.3263 178.8960 77 I 3.8640 7.6082 119.1067 64.5770 37.3361 178.2520 78 I 3.9710 7.9090 119.3180 64.4684 37.6760 177.5749 79 N 4.5297 8.3634 116.9090 55.6957 38.3550 177.3780 80 A 3.9153 7.9073 122.6555 55.1680 18.4490 179.8448 81 V 3.3626 7.7674 116.2647 65.7918 31.4808 177.6577 82 N 3.9014 7.9664 116.7050 56.5713 38.5891 176.3976 83 D 4.2340 7.8843 119.0341 57.3504 41.2162 178.5109 84 A 3.9618 7.7303 120.9218 55.1581 17.9354 179.7325 85 V 3.2378 7.4439 116.5694 65.9848 31.2996 177.5861 86 A 4.2173 8.0079 118.0636 53.3196 18.5077 177.8920 87 S 4.6496 7.5725 113.1890 58.2926 63.5250 176.1303 88 M 4.1467 7.5581 122.0297 58.0268 31.6514 177.0205 89 D 4.7661 7.8842 116.3157 54.1259 41.6198 176.9837 90 D 4.7395 8.1856 120.2329 52.0993 42.3141 175.5282 91 T 3.8591 7.9956 120.3438 65.8683 68.7887 175.2580 92 E 3.8478 8.0855 120.9489 59.2303 29.7594 178.6706 93 K 3.8706 7.8188 118.5717 59.6672 32.2688 178.1923 94 M 3.9222 7.9636 118.4703 58.9114 32.0031 178.4614 95 S 4.0625 8.4362 115.5126 61.7200 62.9905 176.4292 96 M 4.0102 7.9462 121.3856 58.3681 31.6359 179.0963 97 K 3.9095 7.9026 118.2253 59.5923 32.3463 179.5349 98 L 3.9055 7.8262 119.1764 57.7693 41.4171 179.9249 99 R 3.8920 8.3456 118.5736 59.1669 30.0297 178.4765 100 D 4.2698 7.9614 117.9037 57.2981 41.2050 178.1233 101 L 4.0072 8.1254 121.1106 58.0218 42.0542 178.7569 102 S 4.3219 8.6163 113.6967 61.3697 62.3343 176.2864 103 G 3.5631 8.1329 108.3075 47.7576 0.0000 175.5798 104 K 3.4627 7.7846 120.9733 59.2748 31.9905 179.0221 105 H 4.3435 8.3520 115.9913 59.0860 28.6178 177.6332 106 A 3.8172 7.9052 120.0195 54.1872 17.9007 177.2470 107 K 4.2771 7.7004 114.2711 57.3281 34.4395 178.4342 108 S 3.9481 7.5262 118.1097 62.0699 63.3547 176.4152 109 F 4.6084 7.6393 116.9333 58.3984 39.0374 175.5506 110 Q 3.5460 7.3563 118.1739 56.8483 26.6408 173.9999 111 V 3.6531 7.8766 109.6823 59.4349 33.1535 176.2593 112 D 4.2071 6.9484 123.7148 53.5592 41.4673 175.1449 113 P 3.5080 0.0000 0.0000 64.1990 31.4846 178.2825 114 Q 3.7720 7.6563 118.4317 58.9370 28.8448 177.6489 115 Y 4.4956 6.9496 113.6750 59.6883 37.8861 177.5816 116 F 4.3961 7.2036 119.4773 60.7893 39.1066 177.7915 117 K 4.0884 8.1594 117.4762 59.7662 32.2605 179.2066 118 V 3.6823 7.7331 119.1978 65.9686 31.6354 177.6543 119 L 3.6199 7.9320 119.8022 57.6937 41.6855 178.7082 120 A 4.0694 8.1106 120.8156 54.7812 18.2060 179.4887 121 A 4.0012 8.2376 119.5960 55.2470 18.4514 179.9446 122 V 3.6019 7.6325 116.8865 66.3054 31.6493 178.1523 123 I 3.8085 7.8894 119.2640 64.6349 36.9897 178.3323 124 A 4.1756 8.6470 121.8266 55.1651 17.9825 179.1969 125 D 4.2836 8.3265 116.4188 57.8371 41.3766 178.3148 126 T 4.0681 7.9775 115.5220 66.0589 68.5378 176.7752 127 V 3.7462 7.5096 119.2256 64.5097 33.2290 176.4404 128 A 4.4043 7.7237 116.4362 50.6402 21.1663 174.3861 129 A 4.0621 7.9952 123.0452 53.5235 19.0570 178.7053 130 G 3.9345 8.9996 111.8210 45.5303 0.0000 173.3786 131 D 4.4471 8.3875 120.2996 53.9510 41.7231 176.5406 132 A 4.2011 8.7583 129.8266 54.8536 18.6712 179.2027 133 G 3.6805 8.0963 104.1501 48.1452 0.0000 175.6872 134 F 4.0747 10.1120 124.4726 60.7742 39.3424 177.0366 135 E 4.0266 8.2433 118.2509 59.0646 29.1144 179.1222 136 K 3.9106 7.7715 119.6157 59.3446 32.1772 178.6522 137 L 3.7453 7.4934 120.1208 58.2825 41.9505 178.6883 138 M 3.8330 7.7219 118.6792 58.2912 31.7860 178.9203 139 S 4.4556 8.3013 117.0223 61.3543 63.0135 176.5155 140 M 3.9640 8.1591 121.6115 58.4814 31.7035 178.9877 141 I 3.5342 7.7354 119.7641 64.6231 37.3282 178.3578 142 C 4.0280 8.2419 117.8842 62.6907 27.6599 176.3087 143 I 3.9484 7.7143 122.3286 63.9257 37.1358 178.2248 144 L 4.0831 7.8069 119.8309 57.6569 41.2133 179.4944 145 L 3.8285 8.0412 118.1228 56.7661 41.5863 178.6751 146 R 4.5938 7.5494 116.6597 56.6602 30.3625 178.1518 147 S 4.0869 7.7019 113.5682 61.3138 62.7019 175.3974 148 A 4.1782 8.1748 123.8806 53.8734 18.8722 176.7893 149 Y 4.1489 8.2298 118.3512 58.3307 37.9254 175.3856 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 P 0.00 4.35 0.00 2.06 2.10 0.00 3.64 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 1.93 2.12 0.00 2 I 8.32 4.10 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.69 0.92 0.00 0.00 3 V 8.23 4.47 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 1.01 0.00 0.00 0.91 0.00 0.00 4 D 8.35 5.05 0.00 2.77 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 5 S 7.86 4.52 0.00 3.93 3.81 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 6 G 9.19 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 7 S 8.28 4.64 0.00 3.76 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 8 V 7.89 4.46 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 0.75 0.00 0.00 0.88 0.00 0.00 9 A 8.36 4.16 1.22 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 0.00 0.00 10 P 0.00 4.31 0.00 2.03 1.98 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 11 L 8.27 4.20 0.00 1.59 1.58 0.82 0.84 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 12 S 9.26 4.47 0.00 4.02 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 13 A 8.40 3.92 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 14 A 7.97 3.94 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 15 E 7.99 3.93 0.00 2.20 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 2.34 2.36 0.00 16 K 8.20 3.91 0.00 1.93 1.85 0.00 1.65 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.43 1.74 7.81 17 T 8.08 3.87 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 1.23 0.00 0.00 18 K 8.29 4.03 0.00 2.00 1.86 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.66 7.81 19 I 8.16 3.91 2.08 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.70 1.00 0.00 0.00 20 R 8.38 4.09 0.00 1.90 2.06 0.00 3.15 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.94 0.00 21 S 7.90 4.27 0.00 4.02 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 22 A 7.99 4.16 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.72 4.33 0.00 3.67 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 24 A 8.14 4.08 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.20 0.00 1.97 2.08 0.00 3.80 0.00 0.00 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 26 V 7.48 3.51 1.59 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 0.50 0.00 0.00 0.77 0.00 0.00 27 Y 7.45 3.94 0.00 2.24 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 28 S 8.30 4.26 0.00 4.05 4.19 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 29 N 7.69 4.74 0.00 2.67 2.58 0.00 0.00 6.79 7.44 0.00 0.00 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 Y 7.48 4.16 0.00 3.21 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 31 E 7.08 3.84 0.00 1.79 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 2.19 2.28 0.00 32 T 7.54 3.80 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 33 S 7.90 4.21 0.00 3.83 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 34 G 8.59 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 0.00 0.00 0.00 35 V 7.56 3.57 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 0.81 0.00 0.00 1.00 0.00 0.00 36 D 8.14 4.45 0.00 2.74 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 37 I 7.75 3.74 2.15 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 1.47 0.81 1.01 0.00 0.00 38 L 8.12 4.07 0.00 1.81 1.78 1.06 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 39 V 8.28 3.57 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 1.02 0.00 0.00 0.90 0.00 0.00 40 K 8.49 3.92 0.00 2.22 1.96 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.48 7.81 41 F 8.50 4.37 0.00 3.20 3.36 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 42 F 8.69 3.66 0.00 2.85 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 43 T 8.02 3.86 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 1.27 0.00 0.00 44 S 7.40 4.34 0.00 3.94 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 T 7.03 4.43 3.46 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 1.05 0.00 0.00 46 P 0.00 3.83 0.00 2.03 1.97 0.00 3.49 0.00 0.00 3.60 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 47 A 8.01 3.93 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 48 A 7.51 3.94 0.71 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 0.00 0.00 49 Q 7.99 4.30 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.70 0.00 0.00 0.00 0.00 0.00 1.16 1.88 0.00 50 E 7.65 4.01 0.00 1.90 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 2.42 1.47 0.00 51 F 7.95 4.49 0.00 3.10 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 52 F 8.26 4.52 0.00 3.10 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 0.00 0.00 0.00 53 P 0.00 4.14 0.00 2.14 2.14 0.00 3.47 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 2.11 2.14 0.00 54 K 7.82 4.27 0.00 1.64 1.97 0.00 1.74 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.41 7.81 55 F 8.65 5.01 0.00 2.98 2.60 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 0.00 0.00 0.00 0.00 56 K 7.70 4.17 0.00 1.74 1.89 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.46 7.81 57 G 9.24 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 58 M 7.94 4.82 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.44 0.00 59 T 8.57 4.36 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 60 S 7.74 4.31 0.00 4.06 4.03 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 61 A 8.45 4.04 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 62 D 8.14 4.28 0.00 2.64 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 63 Q 7.69 4.09 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.54 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 64 L 7.33 3.73 0.00 1.76 1.39 1.01 0.19 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 65 K 7.79 3.94 0.00 1.69 1.83 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.61 7.81 66 K 7.61 4.20 0.00 1.86 1.83 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.42 1.59 7.81 67 S 7.30 4.12 0.00 3.72 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 68 A 8.70 4.11 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 69 D 8.15 4.55 0.00 2.96 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 70 V 7.48 3.43 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 0.81 0.00 0.00 -0.35 0.00 0.00 71 R 8.04 3.93 0.00 2.16 2.07 0.00 3.22 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 72 W 8.53 4.87 0.00 3.46 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 73 H 8.35 3.94 0.00 3.61 3.70 0.00 5.66 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 74 A 8.50 4.14 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.66 4.16 0.00 2.40 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 2.73 2.55 0.00 76 R 7.39 3.71 0.00 1.61 1.73 0.00 2.21 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.50 0.00 77 I 7.61 3.86 2.10 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.02 0.99 0.00 0.00 78 I 7.91 3.97 2.15 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.62 1.20 0.00 0.00 79 N 8.36 4.53 0.00 3.02 2.82 0.00 0.00 6.83 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 80 A 7.91 3.92 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 81 V 7.77 3.36 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 0.48 0.00 0.00 0.98 0.00 0.00 82 N 7.97 3.90 0.00 3.09 2.79 0.00 0.00 7.11 8.04 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 83 D 7.88 4.23 0.00 2.78 2.64 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 84 A 7.73 3.96 1.14 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 0.00 0.00 85 V 7.44 3.24 1.62 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 0.81 0.00 0.00 -0.02 0.00 0.00 86 A 8.01 4.22 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 87 S 7.57 4.65 0.00 3.83 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 88 M 7.56 4.15 0.00 1.95 2.07 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 2.78 2.38 0.00 89 D 7.88 4.77 0.00 2.63 2.66 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 90 D 8.19 4.74 0.00 2.54 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 8.00 3.86 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 1.15 0.00 0.00 92 E 8.09 3.85 0.00 2.00 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 2.35 2.35 0.00 93 K 7.82 3.87 0.00 1.97 1.88 0.00 1.67 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.41 7.81 94 M 7.96 3.92 0.00 2.18 1.97 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 95 S 8.44 4.06 0.00 3.99 3.85 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 96 M 7.95 4.01 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.56 0.00 97 K 7.90 3.91 0.00 1.78 1.80 0.00 1.64 0.00 0.00 1.60 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.44 7.81 98 L 7.83 3.91 0.00 1.70 1.60 0.82 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 99 R 8.35 3.89 0.00 2.01 1.94 0.00 3.10 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 100 D 7.96 4.27 0.00 2.78 2.82 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 0.00 101 L 8.13 4.01 0.00 1.91 1.82 1.08 1.15 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 0.00 102 S 8.62 4.32 0.00 4.08 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 0.00 103 G 8.13 3.56 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 0.00 104 K 7.78 3.46 0.00 1.87 0.83 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.23 1.55 7.81 105 H 8.35 4.34 0.00 3.82 3.97 0.00 5.81 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 0.00 106 A 7.91 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 K 7.70 4.28 0.00 1.60 1.55 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.18 1.54 7.81 108 S 7.53 3.95 0.00 3.27 3.78 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 0.00 109 F 7.64 4.61 0.00 3.16 2.91 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 0.00 110 Q 7.36 3.55 0.00 2.27 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.70 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 111 V 7.88 3.65 1.69 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 0.75 0.00 0.00 0.89 0.00 0.00 112 D 6.95 4.21 0.00 2.50 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 0.00 0.00 0.00 0.00 113 P 0.00 3.51 0.00 1.68 0.49 0.00 3.52 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 1.74 1.63 0.00 114 Q 7.66 3.77 0.00 1.32 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.03 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 115 Y 6.95 4.50 0.00 2.95 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 F 7.20 4.40 0.00 3.14 2.89 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 0.00 117 K 8.16 4.09 0.00 2.01 2.10 0.00 1.52 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.64 1.54 7.81 118 V 7.73 3.68 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 1.41 0.00 0.00 1.14 0.00 0.00 119 L 7.93 3.62 0.00 0.34 1.30 0.72 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.11 4.07 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.24 4.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.63 3.60 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 1.18 0.00 0.00 1.15 0.00 0.00 123 I 7.89 3.81 2.24 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 1.60 0.82 1.32 0.00 0.00 124 A 8.65 4.18 1.66 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 0.00 125 D 8.33 4.28 0.00 2.83 2.89 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 0.00 126 T 7.98 4.07 4.38 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 1.19 0.00 0.00 127 V 7.51 3.75 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 0.44 0.00 0.00 1.12 0.00 0.00 128 A 7.72 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.00 4.06 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 0.00 130 G 9.00 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 0.00 131 D 8.39 4.45 0.00 2.82 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 0.00 132 A 8.76 4.20 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 0.00 133 G 8.10 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 0.00 0.00 0.00 134 F 10.11 4.07 0.00 3.30 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 0.00 135 E 8.24 4.03 0.00 2.22 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 2.44 2.62 0.00 136 K 7.77 3.91 0.00 1.76 1.97 0.00 1.60 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.40 7.81 137 L 7.49 3.75 0.00 1.41 1.14 0.41 0.74 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 0.00 138 M 7.72 3.83 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.46 0.00 139 S 8.30 4.46 0.00 3.94 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 0.00 140 M 8.16 3.96 0.00 1.93 2.13 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.51 0.00 141 I 7.74 3.53 1.85 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 0.57 0.73 0.00 0.00 142 C 8.24 4.03 0.00 3.14 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 0.00 143 I 7.71 3.95 1.99 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 1.49 1.01 0.87 0.00 0.00 144 L 7.81 4.08 0.00 1.80 1.61 0.87 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 145 L 8.04 3.83 0.00 0.88 0.16 0.43 0.58 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 0.00 146 R 7.55 4.59 0.00 1.98 1.99 0.00 3.38 0.00 0.00 3.43 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.85 0.00 147 S 7.70 4.09 0.00 4.05 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 0.00 148 A 8.17 4.18 1.18 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 0.00 0.00 149 Y 8.23 4.15 0.00 3.10 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