NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4389 8.3049 118.1934 54.9259 32.7448 173.6581 2 E 4.2038 8.4688 117.9966 55.6041 30.6352 174.4978 3 L 5.0490 8.7299 124.3210 53.5336 44.9617 175.7073 4 T 5.0630 9.2027 118.2736 60.9495 70.8059 172.3425 5 T 5.2852 8.4594 108.4224 60.6020 72.3458 173.0723 6 R 4.7440 8.8536 121.3760 55.2374 34.3564 173.6096 7 T 5.0221 8.3161 120.1335 61.5663 70.7787 174.0537 8 L 4.3122 9.0873 128.3142 53.6421 42.6942 175.6518 9 P 4.5783 0.0000 0.0000 62.1755 32.1859 176.1442 10 A 4.0324 8.5461 122.0190 54.3314 18.2961 177.8715 11 R 4.2034 7.6261 116.5315 54.8880 29.4558 175.7299 12 K 4.3906 8.4389 124.8965 56.5435 34.0125 176.1615 13 H 5.2606 9.6580 121.2058 54.7497 30.2635 173.8304 14 I 4.9374 9.1698 125.6364 59.6526 39.3062 174.7812 15 A 5.1705 9.0900 129.4358 50.3388 21.1821 175.4450 16 L 5.0511 9.0256 123.0261 52.8851 44.5932 175.9556 17 V 4.6515 9.0086 123.3890 61.2513 35.2242 173.8198 18 A 5.3583 8.3499 126.3501 51.0627 22.4596 175.6692 19 H 4.7675 9.3567 118.6410 55.4364 30.0771 176.5138 20 D 4.4747 9.1198 121.6312 58.3041 40.7611 179.0376 21 H 4.4398 8.3675 112.4886 57.3875 28.9892 175.9754 22 C 4.8151 8.9458 117.5197 59.0642 29.2595 175.6592 23 K 4.0564 7.9228 124.0836 60.4320 31.7148 179.5847 24 Q 4.2081 8.2996 122.6826 61.1416 28.0662 180.8556 25 M 4.4289 7.9930 121.6123 59.5746 31.5006 180.6063 26 L 4.4462 8.4313 121.5911 58.2530 42.2044 178.8749 27 M 4.1237 8.6064 119.1826 58.5832 32.0090 178.6401 28 S 4.1257 8.2337 113.1886 61.1989 62.3362 176.0402 29 W 4.1710 8.1251 129.9919 60.3131 30.7687 177.8994 30 V 3.6783 8.6068 118.6555 66.2554 30.9629 177.9473 31 E 3.9641 8.4442 118.4661 59.3403 29.0336 179.3490 32 R 3.8843 7.7523 117.6732 58.4556 30.2752 176.6707 33 H 4.6824 7.4310 114.0731 54.9241 30.0286 174.8059 34 Q 3.9006 7.7405 123.7544 59.2232 28.3668 177.1658 35 P 4.1932 0.0000 0.0000 65.4638 31.6239 178.0418 36 L 4.3146 7.7130 118.4199 58.2290 42.2380 178.7110 37 L 4.1202 7.9981 118.8194 57.7597 41.2519 179.0885 38 E 3.9703 8.2862 118.6810 58.7745 29.5711 177.8477 39 Q 4.3745 7.9038 115.6868 55.8171 29.2769 174.1503 40 H 4.9854 7.9906 116.9697 53.8525 32.9931 172.9305 41 V 4.2258 8.4791 119.1639 61.7429 32.8177 174.4747 42 L 5.3122 8.3960 127.9000 53.6979 43.9393 175.2208 43 Y 5.2375 9.0853 119.6570 56.6605 42.6316 174.0086 44 A 5.1224 8.5573 120.5936 52.2344 23.5771 176.0249 45 T 3.9445 8.4879 109.5695 61.7036 70.3243 175.0978 46 G 3.6761 9.0171 106.9285 49.3097 0.0000 176.2072 47 T 3.8444 8.1440 115.0076 66.2518 68.9987 176.5012 48 T 3.9929 8.0876 116.9928 66.7022 68.5159 176.5083 49 G 3.6068 8.5025 107.6291 48.0614 0.0000 175.3697 50 N 4.3689 8.1786 119.7098 55.8333 38.3392 177.5148 51 L 4.0059 7.9637 119.4271 57.8817 42.0954 179.4507 52 I 3.8791 7.8722 119.9850 64.2634 37.1322 178.3762 53 S 4.2864 8.1686 114.9094 61.0911 63.7747 174.5989 54 R 4.3748 7.8944 123.1121 52.5076 26.9236 175.4562 55 A 5.4653 6.9032 135.0000 52.7864 19.0564 177.7716 56 T 4.4078 7.5083 103.1406 60.2310 70.3446 175.1902 57 G 3.8927 8.6241 109.8301 46.2486 0.0000 173.6480 58 M 4.3374 7.7165 118.6985 54.2823 32.8031 175.9206 59 N 4.5000 8.4503 119.2473 53.1605 39.3476 174.9510 60 V 4.3671 8.0042 122.1463 61.2172 34.7696 174.9750 61 N 4.5946 8.8892 126.2305 52.5449 38.2856 173.6845 62 A 4.6511 8.3065 125.4058 52.0069 19.4142 176.7795 63 M 4.6792 9.0251 122.5306 53.9712 35.5783 175.6651 64 L 4.2824 8.7192 119.5280 54.7766 43.6137 176.8587 65 S 4.3814 8.6368 115.1302 58.5062 63.4172 174.8298 66 G 3.8751 9.1670 112.7204 48.0377 0.0000 174.1974 67 P 4.3750 0.0000 0.0000 64.6146 31.4027 177.5574 68 M 4.4450 7.8545 114.8164 54.6877 32.7089 175.7226 69 G 3.8072 8.1409 108.3477 45.5544 0.0000 176.6505 70 G 3.6613 8.4935 107.9154 47.9066 0.0000 175.5824 71 D 4.2701 8.0089 120.6193 57.3686 40.8197 178.5413 72 Q 4.0816 7.9650 117.8260 58.3920 28.8458 178.4066 73 Q 3.9310 7.8634 119.3871 58.8352 28.7825 178.8179 74 V 3.5536 7.7778 119.3676 65.9823 31.6255 178.1753 75 G 3.6472 8.1167 105.2107 47.7826 0.0000 175.4619 76 A 3.9174 8.1849 123.2362 55.0092 18.3363 179.7739 77 L 3.8084 7.7861 117.5199 57.7218 41.6104 179.8493 78 I 3.4937 7.6499 120.0694 64.3357 36.8740 178.6943 79 S 2.7900 7.4570 113.2789 60.2469 62.8376 175.3006 80 E 4.0048 7.2851 119.7793 55.6645 29.4896 177.0776 81 G 3.6834 7.1932 107.2333 45.6992 0.0000 174.8001 82 K 3.9918 7.8770 119.4845 56.7831 32.6165 176.9291 83 I 4.2497 7.2963 119.2559 59.4803 39.0992 174.7628 84 D 4.7660 8.9736 124.8596 55.1050 42.4612 177.1505 85 V 4.7257 7.6107 116.8819 60.9084 35.6585 173.7924 86 L 5.1066 8.7698 128.2518 53.3615 45.1486 174.9619 87 I 4.5794 8.9282 127.9405 59.7733 39.5060 174.5117 88 F 5.4645 9.3314 131.3442 56.5820 41.1782 173.2887 89 F 5.2189 9.4227 126.1972 56.1238 38.2045 174.5237 90 W 4.6936 7.8693 119.6865 54.6620 30.0505 176.0392 91 D 4.2922 9.0107 122.0984 53.7341 40.5558 174.2595 92 P 4.3078 0.0000 0.0000 63.5454 31.9363 176.4940 93 L 4.6323 7.9610 118.2835 54.1762 42.0187 175.9872 94 N 4.6323 7.7967 115.6771 52.0690 41.9379 174.2455 95 A 4.1884 8.6723 127.4060 52.1114 19.4384 176.7010 96 V 4.5050 8.0844 115.6425 58.4702 34.3278 175.1219 97 P 4.2899 0.0000 0.0000 65.9656 31.2113 177.1359 98 N 4.8173 7.9434 116.1106 52.8852 38.6897 176.7093 99 D 4.3262 7.9002 122.6702 58.0765 41.2585 175.4968 100 P 4.2042 0.0000 0.0000 66.0171 31.2749 177.9814 101 D 4.3430 8.1077 118.2246 57.0063 40.7927 178.7749 102 V 3.8084 7.8867 118.5806 66.1984 31.5117 178.2851 103 K 3.8329 8.1938 118.0554 59.2621 31.7881 179.2487 104 A 3.9698 8.3321 121.4772 54.9456 18.2955 179.4406 105 L 3.8875 8.0088 118.8079 58.4125 42.2801 179.2507 106 L 4.0738 7.9370 118.8862 57.6334 41.4363 179.5046 107 R 3.8657 8.2406 119.0582 59.4901 29.9860 178.6147 108 L 4.0451 8.1799 118.6267 57.8313 41.4315 179.4020 109 A 4.0933 8.2954 120.6055 55.1784 18.2725 179.9738 110 T 3.9118 7.7028 114.1082 66.6260 68.4505 177.2041 111 V 3.3325 7.5984 119.2538 65.8455 31.4709 176.8003 112 W 4.3705 8.3235 116.3132 56.0316 29.2543 175.8524 113 N 4.1290 7.5729 116.5880 54.7869 37.0749 173.0412 114 I 4.6844 7.2379 110.5681 58.2492 41.2056 175.5085 115 P 4.4627 0.0000 0.0000 63.1281 32.3431 175.4827 116 V 4.9700 8.4795 123.0614 61.0707 34.5085 174.0733 117 A 4.9594 9.2062 129.8491 50.4784 21.2063 176.4776 118 T 5.2285 9.1404 110.9455 60.8026 70.2881 173.8352 119 N 4.3335 7.4982 119.4410 50.1546 41.7740 175.0943 120 V 3.4304 7.6032 119.2058 66.0232 31.5306 177.6789 121 A 4.1350 7.8418 119.9398 55.6239 18.2953 179.6430 122 T 3.8211 8.5085 114.2752 66.6001 68.5099 176.9097 123 A 4.0297 8.1103 122.7663 55.3157 18.3203 179.4866 124 D 4.6039 8.9085 117.8977 57.6411 40.7144 178.9915 125 F 3.9950 8.4372 117.4573 60.4643 39.2042 177.6378 126 I 3.9950 8.0738 119.4237 64.5810 36.8629 178.4392 127 I 2.7164 7.7450 117.4408 62.8895 37.8121 176.7882 128 Q 4.2753 7.6221 116.6763 54.9358 29.6230 175.6765 129 S 4.3309 7.6025 116.7896 57.2173 63.6765 172.8087 130 P 4.2274 0.0000 0.0000 66.3616 31.4994 177.6524 131 H 5.1114 8.0235 111.8644 55.5527 28.4555 176.9632 132 F 4.1624 8.2417 123.9947 60.4417 39.2679 175.6466 133 N 4.8542 7.8235 114.5542 52.9539 38.6217 173.6740 134 D 5.1214 7.6397 118.3573 52.0149 44.6176 175.1655 135 A 4.6912 8.4316 122.3909 51.8966 19.2918 177.5033 136 V 4.4559 8.4959 121.8124 59.9067 34.9863 174.5387 137 D 5.2808 8.7808 124.1155 53.8523 41.8639 175.7235 138 I 4.7432 8.8516 116.1748 58.9980 41.3770 174.2197 139 L 5.0462 8.5218 123.9801 54.1883 42.5932 176.1018 140 I 4.8787 8.5884 116.3808 57.9234 41.5803 172.8606 141 P 4.4839 0.0000 0.0000 63.1941 31.9212 176.7065 142 D 4.6218 9.5995 123.5254 53.5904 40.6727 176.1806 143 Y 4.1629 8.6160 127.8494 60.5252 39.0261 176.9731 144 Q 3.9055 8.3646 119.9124 59.5964 29.0932 178.7029 145 R 3.8731 7.8620 117.4726 59.2962 29.9916 178.0963 146 Y 4.0674 8.0678 119.3602 61.0405 38.4984 178.3364 147 L 3.4942 7.8321 119.6660 57.5850 42.4167 178.4115 148 A 4.0569 7.8201 120.9298 55.3764 18.3732 179.3246 149 D 4.2480 7.9246 117.2166 57.5935 40.6256 179.2174 150 R 3.8308 7.2336 117.6571 58.4080 30.0321 178.0323 151 L 4.5833 7.1937 117.6610 54.6306 42.1263 177.3086 152 K 4.0782 7.7339 126.6234 55.0009 31.5955 181.1429 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 M 8.30 4.44 0.00 2.17 2.23 0.00 0.00 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.53 0.00 2 E 8.47 4.20 0.00 2.02 1.93 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 2.38 2.36 0.00 3 L 8.73 5.05 0.00 1.50 1.55 0.90 0.81 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 4 T 9.20 5.06 4.50 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 1.39 0.00 0.00 5 T 8.46 5.29 4.26 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 1.23 0.00 0.00 6 R 8.85 4.74 0.00 1.92 1.78 0.00 3.00 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 7 T 8.32 5.02 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 1.25 0.00 0.00 8 L 9.09 4.31 0.00 1.52 1.55 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.58 0.00 2.18 2.06 0.00 4.00 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 2.15 2.02 0.00 10 A 8.55 4.03 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 11 R 7.63 4.20 0.00 1.73 1.86 0.00 3.18 0.00 0.00 3.19 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 12 K 8.44 4.39 0.00 1.53 1.58 0.00 1.51 0.00 0.00 1.86 0.00 0.00 2.44 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.28 0.43 7.81 13 H 9.66 5.26 0.00 3.13 3.15 0.00 5.79 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 9.17 4.94 2.03 0.00 0.00 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 1.33 0.75 1.07 0.00 0.00 15 A 9.09 5.17 1.20 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 0.00 0.00 16 L 9.03 5.05 0.00 1.57 1.54 1.02 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 17 V 9.01 4.65 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 0.75 0.00 0.00 0.67 0.00 0.00 18 A 8.35 5.36 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 19 H 9.36 4.77 0.00 3.26 3.31 0.00 5.68 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 9.12 4.47 0.00 2.78 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 21 H 8.37 4.44 0.00 3.25 3.38 0.00 5.84 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 C 8.95 4.82 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 23 K 7.92 4.06 0.00 1.92 1.93 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.55 1.72 7.81 24 Q 8.30 4.21 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.91 0.00 0.00 0.00 0.00 0.00 2.36 2.00 0.00 25 M 7.99 4.43 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.16 0.00 26 L 8.43 4.45 0.00 1.82 1.92 0.43 0.83 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 27 M 8.61 4.12 0.00 2.09 2.30 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.95 0.00 28 S 8.23 4.13 0.00 4.03 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 29 W 8.13 4.17 0.00 3.64 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 30 V 8.61 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 1.02 0.00 0.00 1.21 0.00 0.00 31 E 8.44 3.96 0.00 2.03 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 2.33 2.51 0.00 32 R 7.75 3.88 0.00 1.82 1.86 0.00 3.11 0.00 0.00 3.16 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.47 0.00 33 H 7.43 4.68 0.00 2.48 2.78 0.00 5.70 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.74 3.90 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.21 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 35 P 0.00 4.19 0.00 2.02 2.08 0.00 3.65 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.11 0.00 36 L 7.71 4.31 0.00 1.74 1.72 1.20 0.57 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 37 L 8.00 4.12 0.00 1.73 1.76 0.89 0.79 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 38 E 8.29 3.97 0.00 2.22 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 2.32 2.35 0.00 39 Q 7.90 4.37 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.43 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 40 H 7.99 4.99 0.00 3.21 3.44 0.00 5.63 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.48 4.23 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 0.85 0.00 0.00 0.86 0.00 0.00 42 L 8.40 5.31 0.00 1.77 1.60 0.96 0.93 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 43 Y 9.09 5.24 0.00 2.80 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 44 A 8.56 5.12 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 45 T 8.49 3.94 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 1.14 0.00 0.00 46 G 9.02 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 47 T 8.14 3.84 4.28 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 1.24 0.00 0.00 48 T 8.09 3.99 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 1.23 0.00 0.00 49 G 8.50 3.61 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 0.00 0.00 0.00 50 N 8.18 4.37 0.00 2.77 2.89 0.00 0.00 7.13 6.36 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 51 L 7.96 4.01 0.00 1.79 1.76 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.87 3.88 2.03 0.00 0.00 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 1.63 1.40 0.94 0.00 0.00 53 S 8.17 4.29 0.00 4.09 4.17 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 54 R 7.89 4.37 0.00 1.81 2.10 0.00 3.41 0.00 0.00 3.23 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 55 A 6.90 5.47 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 56 T 7.51 4.41 4.44 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 1.27 0.00 0.00 57 G 8.62 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 M 7.72 4.34 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.50 0.00 59 N 8.45 4.50 0.00 2.66 2.70 0.00 0.00 6.64 7.68 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 60 V 8.00 4.37 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 0.80 0.00 0.00 0.97 0.00 0.00 61 N 8.89 4.59 0.00 2.10 2.57 0.00 0.00 6.46 8.66 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 62 A 8.31 4.65 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 63 M 9.03 4.68 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.81 0.00 64 L 8.72 4.28 0.00 1.74 1.59 0.92 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.64 4.38 0.00 3.92 3.74 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 66 G 9.17 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 0.00 0.00 0.00 67 P 0.00 4.38 0.00 2.05 2.16 0.00 3.70 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.22 0.00 68 M 7.85 4.45 0.00 1.99 2.20 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 69 G 8.14 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 0.00 0.00 0.00 70 G 8.49 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 71 D 8.01 4.27 0.00 2.72 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 72 Q 7.97 4.08 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 73 Q 7.86 3.93 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 74 V 7.78 3.55 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 0.88 0.00 0.00 0.91 0.00 0.00 75 G 8.12 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.18 3.92 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 77 L 7.79 3.81 0.00 1.66 1.49 0.82 0.76 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 78 I 7.65 3.49 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.98 0.90 0.00 0.00 79 S 7.46 2.79 0.00 3.84 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 80 E 7.29 4.00 0.00 1.97 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 0.00 2.13 2.17 0.00 81 G 7.19 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 82 K 7.88 3.99 0.00 1.62 1.64 0.00 1.53 0.00 0.00 1.61 0.00 0.00 2.76 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.29 1.23 7.81 83 I 7.30 4.25 1.69 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.60 0.86 0.00 0.00 84 D 8.97 4.77 0.00 2.49 2.68 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 85 V 7.61 4.73 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 1.19 0.00 0.00 1.03 0.00 0.00 86 L 8.77 5.11 0.00 1.79 1.50 0.82 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 87 I 8.93 4.58 1.59 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.59 -0.05 0.00 0.00 88 F 9.33 5.46 0.00 2.99 2.97 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 89 F 9.42 5.22 0.00 2.97 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 90 W 7.87 4.69 0.00 3.08 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 0.00 0.00 0.00 0.00 91 D 9.01 4.29 0.00 2.76 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 92 P 0.00 4.31 0.00 1.87 1.15 0.00 3.50 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.53 0.00 93 L 7.96 4.63 0.00 1.55 1.63 0.86 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 94 N 7.80 4.63 0.00 2.81 2.63 0.00 0.00 7.04 7.35 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 95 A 8.67 4.19 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 96 V 8.08 4.51 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 0.80 0.00 0.00 0.99 0.00 0.00 97 P 0.00 4.29 0.00 2.18 2.20 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 98 N 7.94 4.82 0.00 2.98 3.10 0.00 0.00 5.87 8.07 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 99 D 7.90 4.33 0.00 2.92 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 0.00 100 P 0.00 4.20 0.00 2.30 2.28 0.00 3.76 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 2.08 2.06 0.00 101 D 8.11 4.34 0.00 3.04 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 0.00 102 V 7.89 3.81 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 0.67 0.00 0.00 1.22 0.00 0.00 103 K 8.19 3.83 0.00 1.92 1.77 0.00 1.30 0.00 0.00 1.88 0.00 0.00 2.87 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.34 1.33 7.81 104 A 8.33 3.97 1.38 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 0.00 0.00 0.00 105 L 8.01 3.89 0.00 1.84 1.94 0.85 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 106 L 7.94 4.07 0.00 1.86 1.68 0.50 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.24 3.87 0.00 1.96 2.10 0.00 3.07 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 1.60 1.64 0.00 108 L 8.18 4.05 0.00 1.94 1.86 1.01 0.96 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 0.00 109 A 8.30 4.09 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 0.00 110 T 7.70 3.91 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 1.19 0.00 0.00 111 V 7.60 3.33 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 0.84 0.00 0.00 112 W 8.32 4.37 0.00 3.41 3.20 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 0.00 113 N 7.57 4.13 0.00 2.79 2.91 0.00 0.00 6.93 7.86 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 0.00 114 I 7.24 4.68 2.13 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 1.45 0.88 1.00 0.00 0.00 115 P 0.00 4.46 0.00 2.21 2.15 0.00 3.85 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 2.19 2.17 0.00 116 V 8.48 4.97 2.15 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 0.90 0.00 0.00 1.06 0.00 0.00 117 A 9.21 4.96 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 0.00 118 T 9.14 5.23 4.41 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 1.47 0.00 0.00 119 N 7.50 4.33 0.00 2.63 2.60 0.00 0.00 5.86 7.68 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 0.00 120 V 7.60 3.43 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 1.31 0.00 0.00 0.69 0.00 0.00 121 A 7.84 4.13 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 0.00 122 T 8.51 3.82 4.26 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 1.26 0.00 0.00 123 A 8.11 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 8.91 4.60 0.00 3.13 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 0.00 125 F 8.44 4.00 0.00 3.22 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 0.00 126 I 8.07 4.00 2.11 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 1.54 1.14 1.11 0.00 0.00 127 I 7.74 2.72 1.97 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 -0.30 0.67 0.00 0.00 128 Q 7.62 4.28 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.61 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 129 S 7.60 4.33 0.00 4.22 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 0.00 130 P 0.00 4.23 0.00 2.04 2.03 0.00 3.63 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 2.07 2.10 0.00 131 H 8.02 5.11 0.00 3.26 3.32 0.00 5.90 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 F 8.24 4.16 0.00 3.28 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 0.00 133 N 7.82 4.85 0.00 2.90 2.86 0.00 0.00 6.84 7.94 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 0.00 134 D 7.64 5.12 0.00 2.68 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 A 8.43 4.69 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 0.00 136 V 8.50 4.46 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 0.93 0.00 0.00 137 D 8.78 5.28 0.00 2.57 2.65 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 0.00 138 I 8.85 4.74 1.91 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 1.39 0.87 0.94 0.00 0.00 139 L 8.52 5.05 0.00 1.56 1.65 0.93 0.80 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 0.00 140 I 8.59 4.88 2.14 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.09 1.14 0.00 0.00 141 P 0.00 4.48 0.00 1.77 1.77 0.00 3.49 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.99 0.00 142 D 9.60 4.62 0.00 2.73 2.68 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 0.00 143 Y 8.62 4.16 0.00 3.40 3.17 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 0.00 144 Q 8.36 3.91 0.00 2.24 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 145 R 7.86 3.87 0.00 1.96 1.97 0.00 3.41 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 146 Y 8.07 4.07 0.00 3.03 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 0.00 147 L 7.83 3.49 0.00 0.94 1.49 0.84 1.09 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 0.00 148 A 7.82 4.06 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 0.00 149 D 7.92 4.25 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 0.00 150 R 7.23 3.83 0.00 1.69 1.82 0.00 3.04 0.00 0.00 2.68 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.10 0.00 151 L 7.19 4.58 0.00 1.56 1.63 0.88 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 152 K 7.73 4.08 0.00 1.79 1.60 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.39 1.27 7.81