NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.6545 0.0000 0.0000 62.6836 32.6780 174.6630 2 I 4.0389 8.1461 118.9584 60.0292 38.2739 170.5949 3 V 4.5420 8.2623 118.5613 59.7568 35.1718 175.2812 4 D 5.0148 8.3917 119.1732 53.0928 40.0789 175.0868 5 T 4.7379 7.4515 114.0838 63.6444 73.6282 176.5864 6 G 3.9240 8.9538 113.4768 46.5866 0.0000 176.1389 7 S 4.6385 8.3681 117.2429 56.7704 65.2176 172.7991 8 V 4.4527 7.8547 115.2395 58.9552 35.2367 175.7167 9 A 4.1389 8.4432 125.6384 51.4839 18.8817 175.9270 10 P 4.3858 0.0000 0.0000 62.3160 32.0490 176.6744 11 L 4.2941 8.2053 121.5562 54.6789 42.3738 177.7852 12 S 4.5560 9.4891 118.5233 57.3342 65.8848 175.1680 13 A 3.9330 8.6426 124.8351 55.5483 18.0837 180.1366 14 A 3.9343 7.9066 118.4265 55.3938 18.5619 179.4840 15 E 3.9352 8.0912 117.0297 59.5341 29.4846 179.6128 16 K 3.8998 8.2976 118.7041 59.9858 32.2782 179.4264 17 T 3.8872 7.8147 115.2825 66.5282 68.2668 176.8230 18 K 4.0046 8.0030 120.0515 59.4812 32.0392 179.2667 19 I 3.8529 7.9820 120.0206 64.7471 37.0807 178.4493 20 R 4.0880 8.2673 118.8203 59.6194 29.6735 179.3670 21 S 4.1223 7.8805 112.9750 61.7473 63.0516 176.3368 22 A 4.1165 8.1445 122.2511 54.6994 18.2962 179.3503 23 W 4.3443 9.0839 127.2587 61.1414 30.9826 178.5778 24 A 3.9573 8.2719 120.7826 54.5601 17.8182 177.6749 25 P 4.1411 0.0000 0.0000 65.6640 31.6342 178.7165 26 V 3.5388 7.6078 116.9265 66.1652 31.1703 177.5216 27 Y 3.9765 7.0746 117.4015 60.5000 38.7549 177.2868 28 S 4.2277 7.8534 115.6771 60.7846 63.7774 174.6795 29 T 4.5235 7.6336 112.5081 59.4762 68.6981 175.2733 30 Y 4.1716 7.6588 121.7025 60.9329 38.1433 177.1772 31 E 3.8056 7.2913 120.2691 59.8737 29.5673 179.1075 32 T 3.9831 7.6637 114.8626 66.4203 68.8208 176.7466 33 S 4.2188 8.0693 117.1115 61.8951 62.9907 177.2355 34 G 3.8300 8.4036 108.2652 47.9881 0.0000 175.6605 35 V 3.6317 7.4250 119.6125 65.6671 31.5204 177.6267 36 D 4.3654 8.1704 118.4777 57.5451 40.6475 178.7115 37 I 3.7617 7.8094 119.9947 64.6293 37.1888 178.2234 38 L 4.1259 8.1495 120.8590 58.2911 41.9200 179.1960 39 V 3.6033 8.3308 118.7068 65.5967 31.4773 177.9647 40 K 3.9530 8.5968 119.9161 59.4545 32.0341 178.3268 41 F 4.2422 8.5575 121.1071 61.4261 39.0847 176.8096 42 F 3.6623 8.2292 118.7365 61.4814 39.3234 176.9008 43 T 3.9532 8.0129 108.1816 64.1163 68.5930 175.4698 44 S 4.6206 7.6536 113.9061 57.9284 65.2360 174.6545 45 T 4.4876 7.0039 119.3318 60.0776 68.9216 172.1368 46 P 4.3111 0.0000 0.0000 64.8611 31.6259 177.5825 47 A 3.9866 8.0338 117.0668 54.7665 18.4781 178.2996 48 A 4.3386 7.4572 116.6979 52.3327 19.4392 178.8241 49 Q 4.1067 8.3769 118.4500 58.5799 28.5224 178.0360 50 E 4.1687 8.0838 115.7327 58.0192 29.7284 177.2477 51 F 4.3766 8.1540 117.4038 58.1514 39.6718 176.3823 52 F 4.5158 8.0219 120.9945 54.3009 38.1114 173.9482 53 P 4.2884 0.0000 0.0000 65.4776 31.5747 178.7010 54 K 4.2160 7.8865 114.9607 58.1642 32.3890 177.3386 55 F 4.9540 8.0953 117.4324 56.8433 39.2160 175.6879 56 K 4.2816 7.6543 121.9550 58.1487 32.1748 176.2998 57 G 4.0578 9.1742 111.3595 45.4586 0.0000 173.4519 58 L 4.3180 7.7559 120.0927 54.3317 41.8154 175.8759 59 T 4.5275 8.5305 113.2869 63.1207 70.7703 175.1182 60 T 4.1163 7.6013 111.5442 60.6890 69.9179 174.9352 61 A 4.1856 8.4198 123.8988 53.7184 18.2356 179.4626 62 D 4.3145 7.7771 116.2750 57.1030 41.8278 177.6732 63 Q 4.0828 8.1762 118.6634 59.0004 28.7691 178.5269 64 L 3.6541 7.3865 119.9146 58.0422 41.5734 179.8755 65 K 4.0524 7.3874 114.1380 58.1250 32.0264 178.2692 66 K 4.3697 7.8512 117.7139 55.5296 33.5049 176.7406 67 S 4.3165 7.5405 115.1875 57.5505 63.8490 174.6157 68 A 4.1126 8.5801 130.5189 55.1226 18.2419 179.4161 69 D 4.5406 7.9316 117.9463 57.4647 40.8092 179.0687 70 V 3.5764 7.6098 118.4255 65.8380 31.5224 178.1592 71 R 3.9863 7.9553 117.7035 58.9921 29.9844 178.6900 72 W 4.8233 8.5283 128.0244 61.2932 30.9477 177.4566 73 H 3.9670 8.7036 115.8506 59.0912 28.2272 177.5614 74 A 4.2833 8.5936 122.6180 54.9249 18.2429 179.5553 75 E 4.2117 8.7503 117.7925 59.4978 29.5270 179.8148 76 R 3.7042 7.8502 118.2099 59.1207 30.2207 178.8068 77 I 3.6381 7.2304 118.5502 64.7773 37.2870 178.3181 78 I 3.9666 7.8463 120.2398 64.8857 36.9195 178.0766 79 N 4.5128 8.1421 116.7617 55.6205 38.5028 177.4128 80 A 3.9436 7.8689 122.6028 55.0185 18.3555 179.8738 81 V 3.3085 7.6747 116.3740 66.0709 31.6252 177.7684 82 N 4.0316 8.0695 116.5786 56.6264 38.4219 176.5871 83 D 4.2106 8.0737 119.8786 57.0443 41.1667 178.2080 84 A 3.9706 7.5798 121.0967 55.2542 17.8918 179.5927 85 V 3.2952 7.5463 116.6121 66.2789 31.1856 177.9420 86 A 4.1273 7.7268 118.6424 53.9288 18.4151 178.6398 87 S 4.5712 7.9364 113.0023 58.4825 63.0593 175.7068 88 M 3.9165 7.4371 122.5163 58.2445 31.8621 177.3719 89 D 4.5425 7.9581 116.6147 55.2841 41.9213 176.1150 90 D 4.8093 7.8754 119.9500 51.5998 40.8372 175.7181 91 T 3.8417 7.9914 117.7473 64.5817 67.3547 174.6849 92 E 3.9040 8.1659 120.1055 59.2904 29.7343 179.0037 93 K 3.8866 7.8753 119.2828 59.6691 32.4194 178.2234 94 M 3.9288 7.9271 118.5068 58.9309 32.0087 178.3013 95 S 4.0238 7.9010 114.4791 61.8141 63.1882 176.1698 96 M 3.9234 7.6905 121.1776 58.6998 31.8102 178.9004 97 K 3.8681 7.7980 117.5022 59.7345 32.2431 179.4093 98 L 3.9355 7.7649 118.5167 57.8927 41.6646 179.8618 99 R 3.8404 8.5682 118.3441 59.1568 30.0383 178.6883 100 D 4.2513 7.9832 117.6844 57.2346 41.4012 178.0684 101 L 3.9996 7.8600 120.9272 57.9234 42.0409 178.8301 102 S 4.1660 8.7021 113.8184 61.2805 62.2881 176.2169 103 G 3.5747 7.8228 108.0166 47.9000 0.0000 175.5684 104 K 3.5278 7.7177 120.6646 59.3329 32.0464 179.1941 105 H 4.3416 8.1199 115.7021 58.7444 28.4498 177.8296 106 A 3.5230 7.5869 121.5639 54.7155 18.2273 179.2813 107 K 4.0514 7.9129 115.6846 57.9398 32.5427 178.1424 108 S 4.4504 7.3096 112.9751 60.2114 63.9752 175.5002 109 F 4.6483 7.3826 116.7526 58.1686 39.1609 175.6010 110 Q 3.6540 7.9757 118.0642 56.8536 26.1459 173.9959 111 V 4.0480 7.7087 109.1172 59.9816 33.0142 176.2785 112 D 4.2426 7.0367 122.8789 53.4043 41.6027 175.3092 113 P 3.1164 0.0000 0.0000 64.0004 31.3485 177.9796 114 Q 3.8432 7.5440 117.1015 58.5469 28.8536 177.1481 115 Y 4.3892 6.9477 115.4135 58.7868 38.1046 177.2727 116 F 4.4923 7.2246 118.9829 60.6450 39.0898 177.5760 117 K 4.1050 8.0729 117.6247 59.4947 32.0533 179.3753 118 V 3.6397 7.6605 119.4054 66.0290 31.6727 177.6419 119 L 3.7438 8.1032 119.9644 57.8361 41.7833 178.6845 120 A 4.0371 8.2090 120.6453 54.8916 18.2022 179.5091 121 A 4.0187 7.9849 119.6525 55.3131 18.4813 180.0634 122 V 3.6778 7.6416 115.7140 66.1559 31.5485 178.3212 123 I 3.8494 7.9665 119.4534 64.3656 36.9007 178.3385 124 A 4.4652 8.2951 121.6269 55.4819 18.1293 179.2464 125 D 4.3058 8.5231 115.5469 57.3651 41.2488 178.0517 126 T 4.2294 7.6044 115.4070 65.9633 68.9969 176.8773 127 V 3.7554 7.9881 119.1211 65.1187 33.1567 176.5680 128 A 4.3904 8.0915 117.9122 50.4176 20.7363 175.5623 129 A 4.1504 7.8791 123.6295 53.8466 19.1868 176.8066 130 G 4.1359 9.0987 110.9557 45.9899 0.0000 174.2265 131 D 4.4081 8.2763 119.5771 54.3043 42.3013 176.9132 132 A 4.2360 8.7859 128.9693 54.8187 18.5360 179.6427 133 G 3.5881 8.0938 104.1769 48.0475 0.0000 175.6245 134 F 4.1108 8.6855 123.0504 60.8407 39.4542 177.1487 135 E 4.0288 7.9803 117.8237 58.8614 29.0641 179.4764 136 K 3.9829 7.7290 118.3586 59.2296 32.0965 178.7465 137 L 3.7273 7.2895 120.6429 58.7267 41.8404 179.0305 138 M 3.7866 7.4750 118.1013 58.3875 31.7590 179.0896 139 S 4.5646 7.7282 116.7726 61.1150 62.9621 176.5308 140 M 3.9519 8.1849 121.6901 58.4178 31.6582 178.7299 141 I 3.5463 7.6983 119.9691 64.6553 36.7772 178.3436 142 C 4.0082 8.1366 117.4700 62.8649 27.7399 176.1703 143 I 3.9767 7.8004 121.9482 63.8739 36.9307 178.2047 144 L 4.1261 8.0499 119.8398 57.5355 41.2996 179.1625 145 L 3.9709 7.8875 117.5139 56.4209 41.7281 178.4352 146 R 4.7781 7.5907 116.7717 56.1839 30.5377 178.0812 147 S 4.1470 7.8441 113.6027 61.0787 62.9890 175.6519 148 A 4.1492 8.2580 123.1182 54.1277 18.6788 176.7940 149 Y 4.1811 7.9468 118.0140 58.4001 37.9131 175.4206 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 4.65 0.00 2.20 2.18 0.00 3.33 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.96 0.00 2 I 8.15 4.04 1.88 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 1.40 0.71 0.89 0.00 0.00 3 V 8.26 4.54 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 0.86 0.00 0.00 0.90 0.00 0.00 4 D 8.39 5.01 0.00 2.77 2.80 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 5 T 7.45 4.74 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 1.20 0.00 0.00 6 G 8.95 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 0.00 0.00 0.00 7 S 8.37 4.64 0.00 3.76 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 7.85 4.45 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 8.44 4.14 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 4.39 0.00 2.03 1.98 0.00 3.66 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 8.21 4.29 0.00 1.60 1.57 0.84 0.83 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 12 S 9.49 4.56 0.00 3.99 3.97 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 0.00 0.00 0.00 13 A 8.64 3.93 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 14 A 7.91 3.93 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 8.09 3.94 0.00 2.19 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 2.35 2.36 0.00 16 K 8.30 3.90 0.00 1.93 1.87 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.44 1.70 7.81 17 T 7.81 3.89 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 8.00 4.00 0.00 2.04 1.90 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.77 7.81 19 I 7.98 3.85 2.13 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 1.77 1.03 1.06 0.00 0.00 20 R 8.27 4.09 0.00 2.03 2.08 0.00 3.16 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 1.70 2.00 0.00 21 S 7.88 4.12 0.00 4.09 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 22 A 8.14 4.12 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 23 W 9.08 4.34 0.00 3.54 3.31 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 24 A 8.27 3.96 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 25 P 0.00 4.14 0.00 1.97 2.09 0.00 3.86 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 2.13 0.00 26 V 7.61 3.54 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 0.65 0.00 0.00 0.87 0.00 0.00 27 Y 7.07 3.98 0.00 2.16 2.80 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 28 S 7.85 4.23 0.00 4.03 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 29 T 7.63 4.52 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 1.11 0.00 0.00 30 Y 7.66 4.17 0.00 3.19 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 31 E 7.29 3.81 0.00 1.79 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 0.00 1.72 1.99 0.00 32 T 7.66 3.98 4.18 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 1.22 0.00 0.00 33 S 8.07 4.22 0.00 3.88 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 34 G 8.40 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 0.00 0.00 0.00 35 V 7.43 3.63 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 1.04 0.00 0.00 1.05 0.00 0.00 36 D 8.17 4.37 0.00 2.91 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 37 I 7.81 3.76 2.11 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.00 1.03 0.00 0.00 38 L 8.15 4.13 0.00 1.95 1.86 1.14 1.04 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 39 V 8.33 3.60 2.26 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 0.94 0.00 0.00 0.91 0.00 0.00 40 K 8.60 3.95 0.00 2.07 2.06 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.50 7.81 41 F 8.56 4.24 0.00 3.24 3.41 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 42 F 8.23 3.66 0.00 3.01 3.01 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 43 T 8.01 3.95 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 1.35 0.00 0.00 44 S 7.65 4.62 0.00 4.06 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 45 T 7.00 4.49 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 1.23 0.00 0.00 46 P 0.00 4.31 0.00 2.06 1.99 0.00 3.81 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 2.03 1.88 0.00 47 A 8.03 3.99 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 0.00 0.00 48 A 7.46 4.34 0.24 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 49 Q 8.38 4.11 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.79 0.00 0.00 0.00 0.00 0.00 1.16 1.96 0.00 50 E 8.08 4.17 0.00 1.84 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 2.15 1.66 0.00 51 F 8.15 4.38 0.00 3.11 2.96 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 0.00 0.00 0.00 52 F 8.02 4.52 0.00 3.13 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 0.00 0.00 0.00 53 P 0.00 4.29 0.00 2.16 2.12 0.00 3.51 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 2.10 2.11 0.00 54 K 7.89 4.22 0.00 1.61 1.94 0.00 1.88 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.45 7.81 55 F 8.10 4.95 0.00 3.07 2.62 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 56 K 7.65 4.28 0.00 1.85 1.82 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.56 7.81 57 G 9.17 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 0.00 0.00 0.00 58 L 7.76 4.32 0.00 1.74 1.52 0.84 0.68 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 59 T 8.53 4.53 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 60 T 7.60 4.12 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 1.21 0.00 0.00 61 A 8.42 4.19 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 62 D 7.78 4.31 0.00 2.67 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 4.08 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.48 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 64 L 7.39 3.65 0.00 1.48 1.42 0.88 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.39 4.05 0.00 1.74 1.83 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.74 7.81 66 K 7.85 4.37 0.00 1.80 1.80 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.54 7.81 67 S 7.54 4.32 0.00 3.77 3.63 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 68 A 8.58 4.11 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 69 D 7.93 4.54 0.00 2.85 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 70 V 7.61 3.58 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 0.84 0.00 0.00 -0.37 0.00 0.00 71 R 7.96 3.99 0.00 2.18 2.31 0.00 3.21 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 1.67 1.77 0.00 72 W 8.53 4.82 0.00 3.47 3.27 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 73 H 8.70 3.97 0.00 3.92 3.65 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 74 A 8.59 4.28 1.48 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 75 E 8.75 4.21 0.00 2.52 2.34 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 2.71 2.62 0.00 76 R 7.85 3.70 0.00 1.48 1.68 0.00 2.21 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.57 0.00 77 I 7.23 3.64 1.95 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.33 0.96 0.00 0.00 78 I 7.85 3.97 2.27 0.00 0.00 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 1.73 1.62 1.18 0.00 0.00 79 N 8.14 4.51 0.00 2.86 2.83 0.00 0.00 6.83 7.84 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 80 A 7.87 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 81 V 7.67 3.31 2.29 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 0.44 0.00 0.00 0.95 0.00 0.00 82 N 8.07 4.03 0.00 3.03 2.77 0.00 0.00 7.26 8.30 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 83 D 8.07 4.21 0.00 2.80 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 84 A 7.58 3.97 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 85 V 7.55 3.30 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 0.85 0.00 0.00 -0.00 0.00 0.00 86 A 7.73 4.13 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 87 S 7.94 4.57 0.00 3.84 3.97 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 0.00 0.00 0.00 88 M 7.44 3.92 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.42 0.00 89 D 7.96 4.54 0.00 2.64 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 90 D 7.88 4.81 0.00 2.63 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 91 T 7.99 3.84 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 1.18 0.00 0.00 92 E 8.17 3.90 0.00 2.26 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 2.29 0.00 93 K 7.88 3.89 0.00 1.94 1.88 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.42 7.81 94 M 7.93 3.93 0.00 2.20 1.98 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 95 S 7.90 4.02 0.00 4.09 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 7.69 3.92 0.00 1.97 2.11 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 2.81 2.59 0.00 97 K 7.80 3.87 0.00 1.89 1.80 0.00 1.64 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.59 7.81 98 L 7.76 3.94 0.00 1.64 1.60 0.79 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 99 R 8.57 3.84 0.00 1.76 1.94 0.00 3.09 0.00 0.00 3.06 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.83 0.00 100 D 7.98 4.25 0.00 2.79 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 0.00 101 L 7.86 4.00 0.00 1.93 1.78 1.01 0.58 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 0.00 102 S 8.70 4.17 0.00 3.99 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 7.82 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.72 3.53 0.00 1.84 1.16 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.29 1.57 7.81 105 H 8.12 4.34 0.00 3.72 3.87 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 7.59 3.52 0.22 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 0.00 107 K 7.91 4.05 0.00 1.60 1.75 0.00 1.57 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.40 7.81 108 S 7.31 4.45 0.00 3.06 3.69 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 0.00 109 F 7.38 4.65 0.00 3.18 2.96 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 0.00 0.00 0.00 110 Q 7.98 3.65 0.00 2.30 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.91 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 111 V 7.71 4.05 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 0.77 0.00 0.00 1.11 0.00 0.00 112 D 7.04 4.24 0.00 2.38 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 0.00 113 P 0.00 3.12 0.00 1.65 0.49 0.00 3.45 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.43 0.00 114 Q 7.54 3.84 0.00 1.82 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.93 0.00 0.00 0.00 0.00 0.00 1.73 1.16 0.00 115 Y 6.95 4.39 0.00 3.04 3.31 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 0.00 116 F 7.22 4.49 0.00 3.06 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 0.00 117 K 8.07 4.11 0.00 1.99 2.08 0.00 1.49 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.58 1.49 7.81 118 V 7.66 3.64 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 1.42 0.00 0.00 1.04 0.00 0.00 119 L 8.10 3.74 0.00 0.43 1.43 0.70 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.21 4.04 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 0.00 121 A 7.98 4.02 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.64 3.68 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 1.15 0.00 0.00 1.21 0.00 0.00 123 I 7.97 3.85 2.17 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 1.60 0.76 1.24 0.00 0.00 124 A 8.30 4.47 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 0.00 0.00 125 D 8.52 4.31 0.00 2.80 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 0.00 126 T 7.60 4.23 4.48 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 1.24 0.00 0.00 127 V 7.99 3.76 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 0.61 0.00 0.00 1.22 0.00 0.00 128 A 8.09 4.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.88 4.15 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 0.00 130 G 9.10 4.14 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 0.00 131 D 8.28 4.41 0.00 2.85 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 8.79 4.24 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 0.00 133 G 8.09 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 0.00 134 F 8.69 4.11 0.00 3.32 3.12 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 0.00 135 E 7.98 4.03 0.00 2.31 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 2.62 0.00 136 K 7.73 3.98 0.00 1.99 1.79 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.55 7.81 137 L 7.29 3.73 0.00 1.34 1.19 0.53 0.71 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 0.00 138 M 7.47 3.79 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.21 0.00 139 S 7.73 4.56 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 0.00 140 M 8.18 3.95 0.00 1.94 2.13 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.51 0.00 141 I 7.70 3.55 1.84 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.61 0.73 0.00 0.00 142 C 8.14 4.01 0.00 3.21 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 0.00 143 I 7.80 3.98 1.95 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 1.03 0.88 0.00 0.00 144 L 8.05 4.13 0.00 1.80 1.62 0.87 0.42 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 0.00 145 L 7.89 3.97 0.00 1.09 0.45 0.25 0.77 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 0.00 146 R 7.59 4.78 0.00 2.05 2.00 0.00 3.22 0.00 0.00 3.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.96 0.00 147 S 7.84 4.15 0.00 3.99 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 8.26 4.15 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 7.95 4.18 0.00 3.15 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