NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 S 4.3464 8.1776 116.7702 58.5131 63.9045 175.3040 15 S 3.9080 8.6253 129.2108 61.3655 63.5806 174.3329 16 H 4.2782 8.2143 121.2510 58.5269 28.8913 178.8351 17 R 3.7218 7.4906 119.3806 59.2503 29.9942 178.7987 18 L 3.1888 7.3142 118.3513 57.5830 41.5679 179.5900 19 A 3.9637 7.6072 120.4925 55.0038 18.2724 179.6022 20 L 4.0215 7.4993 117.5558 58.1125 41.7233 178.8767 21 Y 4.5803 8.2219 116.8412 61.5809 37.8990 179.0752 22 R 4.2338 8.3192 119.4219 59.6589 30.0674 178.2480 23 N 4.4231 8.1623 116.6644 56.1600 37.3583 177.2849 24 Q 4.0270 8.8930 120.6203 58.6261 28.7702 178.5060 25 A 4.0462 8.9905 122.3430 54.8819 18.4097 179.7779 26 K 3.8813 8.1601 117.0906 59.9105 32.1406 179.6632 27 S 3.9651 7.8222 115.3419 61.4333 62.7422 176.6062 28 L 3.9382 8.0286 122.9899 58.2018 41.6618 179.0140 29 L 4.1105 7.9877 117.7905 57.3973 41.5899 179.3717 30 T 4.0563 7.4822 115.2973 66.7954 68.7657 176.3255 31 H 4.6203 8.0133 115.9334 56.2147 29.4979 176.8198 32 G 4.0538 9.9353 109.6657 45.0384 0.0000 172.8404 33 R 5.1134 7.3626 113.7188 55.4725 32.3452 174.0238 34 I 4.6658 8.8195 119.7060 60.3429 42.0877 173.2947 35 T 5.1119 8.3396 122.5098 62.4937 71.8290 173.4171 36 T 4.7004 8.3738 121.0004 62.9143 73.6324 173.3255 37 T 4.5701 8.4529 110.9799 61.3629 69.7716 175.4442 38 V 3.5806 8.4307 121.7805 65.6828 31.5329 176.4809 39 P 4.1999 0.0000 0.0000 65.7020 31.3638 178.6883 40 K 3.9811 8.2351 116.9808 59.5033 31.9077 179.2855 41 A 4.0175 8.0526 121.1001 54.8339 18.2251 179.8768 42 K 3.8926 7.9400 117.0621 59.7431 32.3201 179.4090 43 E 3.8371 8.0901 118.8154 59.1274 29.2156 179.3026 44 L 3.7560 7.6819 120.2066 58.0962 42.2523 178.6823 45 R 3.9497 8.0271 118.8344 59.7067 30.0241 178.6427 46 G 3.6041 7.8948 104.8659 47.6380 0.0000 175.5324 47 F 4.5450 7.9703 122.7034 61.1081 39.3360 177.5202 48 V 3.1987 8.0567 118.1997 66.0856 31.3887 177.6206 49 D 4.5271 8.1762 118.6239 57.8003 40.1230 178.5012 50 H 4.2511 8.2044 118.2589 59.2988 29.9023 177.4250 51 L 3.8261 7.5572 120.4010 57.6985 41.4209 179.5363 52 I 3.4579 7.8669 120.1426 64.2135 36.9948 177.9362 53 H 4.0251 7.9947 119.2769 59.2637 29.7295 177.4020 54 L 3.9804 7.6004 119.8911 57.5263 41.2188 179.2536 55 A 2.5800 7.3876 120.0535 54.4817 18.1821 179.5466 56 K 3.9334 7.5020 116.4333 59.3879 32.2035 179.3417 57 R 3.8877 7.9049 117.7426 57.6208 31.2297 177.2062 58 G 4.1163 7.2573 107.1770 46.7476 0.0000 171.9612 59 D 5.0802 7.3995 122.2751 50.4290 44.1328 176.4185 60 L 3.8696 8.4136 119.5175 59.7691 39.9680 179.2211 61 H 4.2457 8.2131 116.4962 58.1640 28.7631 177.5365 62 A 4.0725 7.9444 121.2803 55.2651 18.1327 179.5222 63 R 3.7928 8.4912 117.6867 59.5000 30.0506 178.8101 64 R 3.9018 7.6417 118.1448 59.5768 30.3410 178.6259 65 L 4.1234 7.9513 118.5876 57.5209 41.4916 179.7043 66 V 3.6805 8.0810 118.6151 65.8972 31.2794 177.8957 67 L 4.1895 7.4881 120.4796 57.6808 42.0369 178.5970 68 R 4.0511 7.8253 117.5030 59.2501 30.0119 177.8842 69 D 4.8314 7.8855 117.5880 55.1694 41.2467 176.1551 70 L 4.6075 8.3562 123.9108 53.4374 42.7089 176.9333 71 Q 4.3778 8.4669 130.4168 54.7940 28.2459 177.6691 72 D 4.5217 7.5554 117.2213 52.0246 44.7625 174.0958 73 V 3.5468 8.5045 127.1545 66.0858 31.7760 177.6944 74 K 3.9748 8.1414 118.0349 60.1914 32.0374 178.7979 75 L 3.9507 7.8031 119.3200 57.6841 41.7567 179.2747 76 V 3.7816 7.8377 118.1914 65.9576 31.3507 178.0975 77 R 3.8488 8.5259 118.8275 59.2100 30.0005 178.0936 78 K 3.8160 8.1454 119.5195 59.6830 32.1482 178.1645 79 L 3.8821 8.3067 119.3284 58.0864 41.3886 179.7619 80 F 3.9465 8.1250 115.5118 60.1311 39.0101 176.7429 81 D 4.8789 7.8514 115.0426 53.4094 39.5761 175.5124 82 E 4.4272 8.0551 118.4710 57.7161 31.8309 177.5581 83 I 3.6358 7.6756 118.1716 64.1543 37.3807 178.0326 84 A 3.9214 8.2801 121.8407 54.9220 18.3233 177.6396 85 P 4.1194 0.0000 0.0000 65.9863 31.1646 178.5945 86 R 3.8072 7.2135 114.6919 58.7713 29.5729 177.1477 87 Y 5.0762 7.4445 114.9362 57.8918 38.5395 177.9928 88 R 4.1325 7.8435 121.7001 58.8122 30.4706 177.9769 89 D 4.5575 8.1322 116.7519 55.6722 40.1260 177.4367 90 R 4.2478 7.4790 116.2823 55.9316 30.7995 175.7246 91 Q 4.5469 8.8161 119.3641 54.8263 29.4706 174.1131 92 G 3.5183 9.0860 101.8242 42.8541 0.0000 173.5359 93 G 3.7502 7.6452 106.3935 46.7913 0.0000 173.6538 94 Y 3.8724 6.9272 114.8248 59.5277 39.7236 177.1056 95 T 4.9319 7.6717 115.8401 61.5520 70.8275 173.7628 96 R 4.5770 9.3584 127.1188 54.5186 32.6793 174.7136 97 V 4.7562 8.3548 125.2941 61.1351 33.8764 174.3746 98 L 4.7046 9.0885 128.7011 52.6088 43.8824 176.2150 99 K 4.3732 8.7500 124.3391 56.4684 32.5789 176.7148 100 L 4.7422 8.3979 124.2551 52.9748 43.6358 176.9320 101 A 4.0453 8.7768 125.0139 55.2912 18.9115 178.3396 102 E 4.1103 8.0746 113.1554 57.1526 29.9317 175.8493 103 R 5.3058 8.2252 116.2189 54.0689 34.3698 174.1218 104 R 4.8231 8.4130 114.2138 54.6827 33.5471 174.9186 105 R 3.8143 8.4359 115.9088 57.1933 29.6053 175.6904 106 G 4.2370 10.3640 112.5631 45.3639 0.0000 174.2184 107 D 4.6021 7.5355 115.1407 52.2283 42.0178 175.2410 108 G 4.0929 7.9090 105.9942 45.1324 0.0000 172.8615 109 A 4.1274 8.1349 123.5625 50.3855 19.1708 175.8494 110 P 4.2582 0.0000 0.0000 64.4741 32.3922 175.4549 111 L 5.1177 8.5108 120.2980 53.3528 45.5834 175.1483 112 A 5.0437 8.6061 121.0548 50.6731 23.2651 174.8748 113 L 4.8896 9.1845 124.1670 53.5982 44.0491 175.2679 114 V 4.9858 8.8712 126.8095 61.2881 34.1032 174.0681 115 E 5.1262 8.8356 123.6142 55.2096 33.3106 174.1767 116 L 4.7180 7.9815 121.0983 54.4308 42.2570 177.7477 117 V 3.8207 8.6423 124.3236 61.0654 32.3983 175.9980 118 E 4.8340 8.8768 122.2422 56.4320 30.0918 176.5267 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 14 S 8.18 4.35 0.00 3.69 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 15 S 8.63 3.91 0.00 4.02 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 16 H 8.21 4.28 0.00 3.15 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.49 3.72 0.00 1.81 1.29 0.00 3.06 0.00 0.00 3.31 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 18 L 7.31 3.19 0.00 1.42 1.49 0.53 0.52 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 19 A 7.61 3.96 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 20 L 7.50 4.02 0.00 2.00 1.90 1.00 0.94 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 21 Y 8.22 4.58 0.00 2.72 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 22 R 8.32 4.23 0.00 2.09 2.19 0.00 3.14 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.89 0.00 23 N 8.16 4.42 0.00 3.04 3.28 0.00 0.00 7.07 7.04 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 24 Q 8.89 4.03 0.00 2.33 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.45 2.62 0.00 25 A 8.99 4.05 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 26 K 8.16 3.88 0.00 2.04 1.89 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.70 7.81 27 S 7.82 3.97 0.00 3.96 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 28 L 8.03 3.94 0.00 1.85 1.84 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 29 L 7.99 4.11 0.00 1.62 1.69 0.90 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.48 4.06 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 1.23 0.00 0.00 31 H 8.01 4.62 0.00 3.14 3.33 0.00 5.68 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 9.94 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.36 5.11 0.00 1.80 1.88 0.00 3.07 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 1.69 1.66 0.00 34 I 8.82 4.67 1.90 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 1.27 1.48 0.93 0.00 0.00 35 T 8.34 5.11 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 1.29 0.00 0.00 36 T 8.37 4.70 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 1.24 0.00 0.00 37 T 8.45 4.57 4.25 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 1.23 0.00 0.00 38 V 8.43 3.58 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.98 0.00 0.00 39 P 0.00 4.20 0.00 2.21 2.09 0.00 3.62 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 40 K 8.24 3.98 0.00 1.91 1.91 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.65 7.81 41 A 8.05 4.02 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 42 K 7.94 3.89 0.00 2.00 1.85 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.72 7.81 43 E 8.09 3.84 0.00 1.97 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 2.35 2.49 0.00 44 L 7.68 3.76 0.00 1.91 1.62 0.94 0.94 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 45 R 8.03 3.95 0.00 1.90 2.14 0.00 3.10 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 46 G 7.89 3.60 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 0.00 0.00 0.00 47 F 7.97 4.54 0.00 2.88 3.10 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 0.00 0.00 0.00 48 V 8.06 3.20 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 0.96 0.00 0.00 0.86 0.00 0.00 49 D 8.18 4.53 0.00 2.99 2.83 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 50 H 8.20 4.25 0.00 3.37 3.63 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 51 L 7.56 3.83 0.00 1.65 1.49 0.44 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.87 3.46 1.32 0.00 0.00 0.75 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 0.73 -0.10 0.00 0.00 53 H 7.99 4.03 0.00 3.42 3.50 0.00 5.58 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 54 L 7.60 3.98 0.00 1.79 1.71 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.39 2.58 0.68 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 56 K 7.50 3.93 0.00 1.74 1.80 0.00 1.70 0.00 0.00 1.49 0.00 0.00 3.12 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.23 1.33 7.81 57 R 7.90 3.89 0.00 1.90 2.13 0.00 3.33 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 58 G 7.26 4.12 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 0.00 59 D 7.40 5.08 0.00 2.87 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 60 L 8.41 3.87 0.00 1.72 1.91 0.84 0.63 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 61 H 8.21 4.25 0.00 3.45 3.40 0.00 5.62 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 62 A 7.94 4.07 1.60 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 0.00 0.00 63 R 8.49 3.79 0.00 1.67 2.01 0.00 2.21 0.00 0.00 2.61 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.28 0.00 64 R 7.64 3.90 0.00 1.91 2.15 0.00 3.17 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 65 L 7.95 4.12 0.00 1.81 1.79 0.97 0.91 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 66 V 8.08 3.68 2.49 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 1.14 0.00 0.00 1.08 0.00 0.00 67 L 7.49 4.19 0.00 1.82 1.86 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.83 4.05 0.00 2.08 2.11 0.00 3.34 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 69 D 7.89 4.83 0.00 3.13 3.10 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 0.00 0.00 0.00 70 L 8.36 4.61 0.00 1.80 1.63 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.47 4.38 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.46 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 72 D 7.56 4.52 0.00 2.71 2.49 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 73 V 8.50 3.55 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.93 0.00 0.00 74 K 8.14 3.97 0.00 1.99 2.08 0.00 1.57 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.83 1.50 7.81 75 L 7.80 3.95 0.00 1.91 1.76 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 76 V 7.84 3.78 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 1.01 0.00 0.00 1.01 0.00 0.00 77 R 8.53 3.85 0.00 2.02 2.08 0.00 3.16 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.61 0.00 78 K 8.15 3.82 0.00 1.87 2.01 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.49 7.81 79 L 8.31 3.88 0.00 2.03 1.59 0.87 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.12 3.95 0.00 2.93 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 81 D 7.85 4.88 0.00 2.83 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 82 E 8.06 4.43 0.00 1.84 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 83 I 7.68 3.64 1.91 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 1.69 1.22 0.95 0.00 0.00 84 A 8.28 3.92 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 85 P 0.00 4.12 0.00 2.09 2.09 0.00 3.58 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 86 R 7.21 3.81 0.00 1.66 1.65 0.00 2.21 0.00 0.00 3.00 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.41 0.00 87 Y 7.44 5.08 0.00 3.00 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 88 R 7.84 4.13 0.00 2.05 2.02 0.00 3.24 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 89 D 8.13 4.56 0.00 2.82 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 90 R 7.48 4.25 0.00 1.96 1.88 0.00 3.35 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.09 0.00 91 Q 8.82 4.55 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.95 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 92 G 9.09 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 7.65 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 6.93 3.87 0.00 2.70 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 95 T 7.67 4.93 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 96 R 9.36 4.58 0.00 1.81 1.86 0.00 3.03 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 97 V 8.35 4.76 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 0.87 0.00 0.00 0.91 0.00 0.00 98 L 9.09 4.70 0.00 1.56 1.55 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.75 4.37 0.00 1.64 1.75 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.47 7.81 100 L 8.40 4.74 0.00 1.52 1.57 0.93 0.69 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 0.00 101 A 8.78 4.05 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 0.00 102 E 8.07 4.11 0.00 2.12 2.14 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 2.37 2.31 0.00 103 R 8.23 5.31 0.00 1.65 1.94 0.00 3.20 0.00 0.00 2.96 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.45 0.00 104 R 8.41 4.82 0.00 1.82 1.97 0.00 3.00 0.00 0.00 3.40 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 105 R 8.44 3.81 0.00 1.87 2.19 0.00 3.15 0.00 0.00 3.35 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.62 0.00 106 G 10.36 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 0.00 0.00 0.00 0.00 107 D 7.54 4.60 0.00 2.74 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 0.00 108 G 7.91 4.09 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 0.00 109 A 8.13 4.13 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.26 0.00 2.12 2.23 0.00 3.65 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.04 0.00 111 L 8.51 5.12 0.00 1.77 1.58 0.93 0.42 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 0.00 112 A 8.61 5.04 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 0.00 113 L 9.18 4.89 0.00 1.66 1.54 1.01 0.85 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 0.00 114 V 8.87 4.99 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.93 0.00 0.00 115 E 8.84 5.13 0.00 2.14 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 2.29 0.00 116 L 7.98 4.72 0.00 1.80 1.87 1.00 0.94 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 0.00 117 V 8.64 3.82 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 0.53 0.00 0.00 0.92 0.00 0.00 118 E 8.88 4.83 0.00 2.31 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 2.11 2.05 0.00