NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.3244 8.3144 122.0586 56.4452 33.5786 175.3871 4 C 4.7396 9.3268 126.7600 54.9663 44.5690 171.0901 5 S 4.8389 10.2860 122.2702 56.5454 64.2440 173.7049 6 L 3.9369 8.6544 126.7094 57.5264 41.4287 177.1974 7 T 3.7064 7.9468 115.7923 64.6256 68.4553 174.0957 8 G 3.8458 7.3447 114.6608 44.4164 0.0000 170.1381 9 K 4.7332 7.4257 118.7352 55.1504 33.8692 176.5126 10 W 5.4807 9.1678 123.3865 55.4164 34.0102 173.9430 11 T 5.2155 9.3057 114.6072 60.9058 70.8022 172.1327 12 N 5.7326 8.9264 124.1821 49.5715 40.3698 174.9030 13 D 4.4404 8.7445 117.7505 56.1331 39.3391 177.7647 14 L 4.1532 8.3246 119.7210 56.4551 41.9404 177.3367 15 G 4.0216 7.7813 103.5550 45.1212 0.0000 174.2268 16 S 4.5350 8.3035 116.7146 58.5722 64.3726 172.9367 17 N 5.6481 8.8303 120.3122 52.0044 41.7797 173.6234 18 M 5.1032 8.6206 117.3587 54.3003 35.3319 173.8662 19 T 4.9610 8.9370 117.7023 62.1243 72.0185 172.9323 20 I 4.5720 8.4524 127.6267 59.8194 39.8596 175.9832 21 G 4.4876 8.1660 112.7059 44.1968 0.0000 172.5493 22 A 4.1048 8.7923 122.5012 51.7201 18.5100 177.5819 23 V 4.2725 8.2840 123.8280 60.3274 32.3277 176.1198 24 N 4.6491 8.7548 123.6384 51.9857 38.1376 175.6243 25 S 4.1023 8.7955 112.1555 61.9596 62.5457 175.8685 26 R 4.0097 8.0020 116.1790 56.3554 29.8637 177.2732 27 G 3.9664 8.6430 107.4821 45.7012 0.0000 173.0245 28 E 4.6975 8.4444 119.5864 55.2850 31.7761 175.1644 29 F 5.2513 7.6396 114.9809 56.5896 42.2848 172.6096 30 T 4.9777 8.2525 114.3078 62.4573 73.6085 173.6862 31 G 4.6497 8.1140 108.0906 46.3530 0.0000 172.1303 32 T 5.0343 7.6645 107.7954 59.9714 72.9022 172.4064 33 Y 4.7984 9.1027 124.2307 56.4895 41.8767 174.4666 34 T 4.6067 8.6203 125.2045 61.9961 69.5316 174.5541 35 T 4.6454 9.1104 120.6048 62.0624 68.2559 173.8922 36 A 4.5317 8.6163 127.9646 52.5017 20.2818 177.3074 37 V 4.5857 7.4321 113.2532 60.3893 34.6258 174.5555 38 T 4.4262 7.9012 112.6877 60.8012 70.0272 173.3308 39 A 4.1687 8.2654 128.2650 53.5741 19.5100 177.5262 40 T 4.3767 7.7261 111.7024 60.6350 68.4212 175.1843 41 S 4.5067 8.5872 120.5529 58.9994 62.0312 173.5640 42 N 4.6095 7.9579 116.4665 52.5953 38.8993 174.2306 43 E 4.1278 8.4991 121.1223 55.1405 30.0753 176.4632 44 I 2.0000 7.9308 127.2781 61.1604 37.6367 175.5929 45 K 4.5887 6.9398 122.4817 54.0451 35.9882 175.7006 46 E 4.3770 8.9402 123.6023 56.9999 30.0341 176.1091 47 S 5.1385 8.9345 122.5140 55.8626 66.8182 171.9824 48 P 4.8924 0.0000 0.0000 62.8575 33.0764 174.7648 49 L 5.1503 8.4366 121.9199 53.8749 45.9873 174.8004 50 H 4.9128 9.1961 122.0631 54.4751 32.0947 171.5884 51 G 4.3244 8.1701 114.9246 46.1275 0.0000 170.1526 52 T 4.4413 8.2628 112.9811 60.9745 71.3221 173.5323 53 E 5.4169 9.1041 126.4986 54.4088 32.2762 175.0972 54 N 4.6621 9.2200 122.0141 53.5755 39.7471 174.7254 55 T 4.6694 8.3345 113.5922 61.2988 70.0220 175.3276 56 I 3.6970 8.1351 124.0237 64.9070 37.1763 178.1274 57 N 4.8278 7.6913 115.1646 56.4758 39.5641 175.5688 58 K 4.0431 8.1503 113.7797 57.2318 29.9702 175.6792 59 R 4.1104 7.6250 120.1555 56.8526 31.2702 177.6964 60 T 4.2263 8.4564 110.0472 63.4685 69.6202 173.6174 61 Q 5.1303 7.8765 120.5449 52.2391 28.8624 173.5964 62 P 4.5676 0.0000 0.0000 62.5983 33.7296 175.7813 63 T 4.7594 8.3509 117.7307 62.9912 70.6528 173.8530 64 F 5.3398 7.9453 119.4452 56.1404 42.4722 173.0806 65 G 4.9857 9.1903 101.9175 46.6006 0.0000 172.8517 66 F 5.4913 8.1126 117.9951 55.4771 42.3323 173.0770 67 T 5.1062 8.6646 115.8269 61.8679 71.4839 173.4005 68 V 4.3591 8.6584 126.2922 61.0382 33.6016 174.1228 69 N 4.5834 8.1733 127.6743 52.1189 38.9436 174.5268 70 W 4.3855 7.8949 127.2494 56.3828 28.7814 177.2519 71 K 4.1908 9.3131 126.3617 58.6011 31.7686 178.1124 72 F 4.8479 8.2216 111.4500 56.4706 38.3083 174.7896 73 S 4.5237 7.1724 114.5213 57.6451 65.6487 173.3232 74 E 4.3767 8.5535 118.1601 56.3995 29.5051 176.4808 75 S 4.8603 7.6269 114.8750 57.6270 65.7786 173.0685 76 T 5.2462 8.4753 115.4507 62.2821 72.7432 173.4145 77 T 5.1251 8.4791 118.8438 62.1204 73.2006 173.4120 78 V 4.9582 8.5218 118.4248 59.5570 35.4445 174.6491 79 F 5.4404 8.7390 122.2809 56.0579 42.4909 174.3866 80 T 4.8090 8.8649 118.6404 62.3332 72.7318 173.9588 81 G 3.8745 7.2728 108.7334 46.5303 0.0000 171.6331 82 Q 4.6581 8.0741 120.3280 54.6135 33.2209 174.6528 83 C 4.8583 9.0479 126.2693 55.9273 45.3640 172.4282 84 F 5.2631 9.2444 125.7515 56.2077 41.8005 175.4478 85 I 5.0248 8.8471 122.3497 58.9918 37.6828 174.9914 86 D 4.5261 9.1569 127.0983 54.2903 41.9190 177.4980 87 R 4.1588 8.4619 123.1002 58.8301 30.3076 177.2063 88 N 4.6784 8.2038 113.8192 52.3880 37.4185 176.0845 89 G 3.9840 8.8708 106.9865 45.5507 0.0000 173.7055 90 K 4.7826 7.7454 118.6288 54.5825 35.6601 175.5065 91 E 4.9657 8.7595 121.7919 56.7241 30.6697 176.2653 92 V 5.0900 9.1673 123.1692 60.1692 35.7092 173.9971 93 L 5.3961 8.9981 122.9398 52.3669 44.3586 175.5024 94 K 5.0450 9.0253 124.4707 55.3018 33.5742 175.8175 95 T 5.3332 9.1712 115.1410 60.1892 72.7402 172.8206 96 M 5.1072 9.2393 121.8489 53.3849 36.2933 174.5244 97 W 5.3776 8.5370 119.1358 54.5847 32.6831 173.9924 98 L 5.2114 8.7669 119.2273 53.0126 45.1320 175.4652 99 L 4.6556 9.3402 127.1081 53.3653 44.2541 174.8470 100 R 4.8827 8.6164 127.9794 55.5328 31.4638 175.7193 101 S 5.0541 9.2072 123.3038 57.0278 65.4778 174.1191 102 S 4.4933 8.4112 116.4075 57.0560 63.0769 174.3698 103 V 4.1420 7.9352 118.5930 60.0655 32.6909 175.7450 104 N 4.4992 8.1569 118.2732 55.0388 39.3575 174.8579 105 D 4.7227 7.5590 117.2518 52.9007 42.9121 177.3359 106 I 3.7997 8.5089 125.2037 63.9746 37.5685 178.0927 107 G 3.7759 8.6965 105.7095 47.2612 0.0000 174.6510 108 D 4.6420 8.3139 120.0289 55.2916 41.1248 177.5558 109 D 4.3266 8.0131 119.7354 57.1462 40.8403 178.0654 110 W 4.4830 8.3226 115.9033 58.1695 27.8541 176.2531 111 K 4.0135 6.7454 117.9474 56.4048 32.2667 176.1167 112 A 4.5459 7.9804 119.0637 52.8555 20.2831 177.1732 113 T 4.9847 7.5528 113.2716 62.8169 71.8853 173.6967 114 R 4.8381 9.2813 126.1523 54.5550 32.9818 175.6961 115 V 4.5244 8.0572 120.6809 60.0954 34.2939 174.8443 116 G 2.8707 6.9808 109.8506 45.0518 0.0000 170.9786 117 I 5.0122 7.4022 119.0554 59.3724 41.5176 174.8347 118 N 4.6876 8.4431 116.9899 52.8593 44.1169 173.8251 119 I 5.0000 8.8254 126.1477 59.8873 39.2543 174.6887 120 F 5.2108 9.2899 127.1657 56.5155 40.6440 175.3120 121 T 5.3142 9.3556 118.1339 59.8651 70.9855 173.2094 122 R 3.5053 7.9097 121.9920 56.0845 30.4845 176.7557 123 L 4.1797 7.9733 125.7385 55.2645 41.7172 176.4484 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 3 K 8.31 4.32 0.00 1.81 1.80 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.62 7.81 4 C 9.33 4.74 0.00 3.09 3.04 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 5 S 10.29 4.84 0.00 3.85 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 6 L 8.65 3.94 0.00 1.26 1.03 0.45 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 7 T 7.95 3.71 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 1.16 0.00 0.00 8 G 7.34 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 0.00 0.00 0.00 9 K 7.43 4.73 0.00 1.55 1.62 0.00 1.54 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.36 7.81 10 W 9.17 5.48 0.00 3.22 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 T 9.31 5.22 4.29 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 1.27 0.00 0.00 12 N 8.93 5.73 0.00 2.41 1.50 0.00 0.00 6.61 7.38 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 13 D 8.74 4.44 0.00 2.83 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 14 L 8.32 4.15 0.00 1.84 1.80 1.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 15 G 7.78 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.30 4.53 0.00 3.84 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 17 N 8.83 5.65 0.00 2.60 2.66 0.00 0.00 6.54 7.28 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 18 M 8.62 5.10 0.00 1.56 1.77 0.00 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 19 T 8.94 4.96 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 1.15 0.00 0.00 20 I 8.45 4.57 1.85 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.99 0.29 0.00 0.00 21 G 8.17 4.49 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 0.00 22 A 8.79 4.10 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 23 V 8.28 4.27 2.43 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 0.75 0.00 0.00 1.05 0.00 0.00 24 N 8.75 4.65 0.00 2.92 3.06 0.00 0.00 6.27 7.24 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 25 S 8.80 4.10 0.00 4.00 4.07 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 0.00 0.00 0.00 26 R 8.00 4.01 0.00 2.17 2.01 0.00 3.25 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 27 G 8.64 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 0.00 0.00 0.00 28 E 8.44 4.70 0.00 1.90 1.75 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 2.21 2.31 0.00 29 F 7.64 5.25 0.00 3.00 3.07 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 0.00 0.00 0.00 30 T 8.25 4.98 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 1.15 0.00 0.00 31 G 8.11 4.65 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 32 T 7.66 5.03 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 33 Y 9.10 4.80 0.00 2.92 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 34 T 8.62 4.61 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 1.26 0.00 0.00 35 T 9.11 4.65 4.93 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 1.43 0.00 0.00 36 A 8.62 4.53 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 37 V 7.43 4.59 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 0.73 0.00 0.00 0.92 0.00 0.00 38 T 7.90 4.43 4.29 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 1.30 0.00 0.00 39 A 8.27 4.17 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 40 T 7.73 4.38 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 1.25 0.00 0.00 41 S 8.59 4.51 0.00 3.86 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 42 N 7.96 4.61 0.00 2.90 3.01 0.00 0.00 6.82 7.20 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 43 E 8.50 4.13 0.00 1.91 1.83 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 2.19 2.29 0.00 44 I 7.93 2.00 1.57 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 0.70 0.23 0.68 0.00 0.00 45 K 6.94 4.59 0.00 1.81 1.81 0.00 1.74 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.47 7.81 46 E 8.94 4.38 0.00 2.04 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 2.36 2.43 0.00 47 S 8.93 5.14 0.00 3.65 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 48 P 0.00 4.89 0.00 2.08 2.17 0.00 3.83 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.97 0.00 49 L 8.44 5.15 0.00 1.66 1.51 0.56 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 50 H 9.20 4.91 0.00 3.04 3.09 0.00 5.61 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 G 8.17 4.32 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 0.00 52 T 8.26 4.44 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 1.20 0.00 0.00 53 E 9.10 5.42 0.00 2.19 2.28 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 2.53 2.32 0.00 54 N 9.22 4.66 0.00 2.75 2.78 0.00 0.00 6.93 7.50 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 55 T 8.33 4.67 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 56 I 8.14 3.70 1.97 0.00 0.00 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 1.46 0.81 0.92 0.00 0.00 57 N 7.69 4.83 0.00 2.68 2.79 0.00 0.00 7.12 7.61 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 58 K 8.15 4.04 0.00 1.81 2.06 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.41 7.81 59 R 7.62 4.11 0.00 1.80 1.88 0.00 3.34 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 60 T 8.46 4.23 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 1.23 0.00 0.00 61 Q 7.88 5.13 0.00 1.81 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 7.08 0.00 0.00 0.00 0.00 0.00 2.28 2.18 0.00 62 P 0.00 4.57 0.00 2.19 2.20 0.00 3.69 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.03 0.00 63 T 8.35 4.76 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 1.16 0.00 0.00 64 F 7.95 5.34 0.00 3.52 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 65 G 9.19 4.99 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 0.00 0.00 0.00 66 F 8.11 5.49 0.00 3.12 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 67 T 8.66 5.11 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 1.19 0.00 0.00 68 V 8.66 4.36 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 -0.41 0.00 0.00 0.87 0.00 0.00 69 N 8.17 4.58 0.00 2.74 2.67 0.00 0.00 7.31 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 W 7.89 4.39 0.00 3.32 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.31 4.19 0.00 1.95 2.05 0.00 1.63 0.00 0.00 1.93 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.50 7.81 72 F 8.22 4.85 0.00 3.25 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 73 S 7.17 4.52 0.00 3.73 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 74 E 8.55 4.38 0.00 1.95 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 2.25 2.26 0.00 75 S 7.63 4.86 0.00 3.94 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 76 T 8.48 5.25 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 1.20 0.00 0.00 77 T 8.48 5.13 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 0.76 0.00 0.00 78 V 8.52 4.96 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 0.71 0.00 0.00 0.91 0.00 0.00 79 F 8.74 5.44 0.00 1.88 2.78 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 80 T 8.86 4.81 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 1.17 0.00 0.00 81 G 7.27 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 8.07 4.66 0.00 1.80 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.82 0.00 0.00 0.00 0.00 0.00 1.61 2.05 0.00 83 C 9.05 4.86 0.00 3.16 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 F 9.24 5.26 0.00 3.18 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 85 I 8.85 5.02 1.97 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.96 0.98 0.00 0.00 86 D 9.16 4.53 0.00 2.85 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 87 R 8.46 4.16 0.00 1.87 2.02 0.00 3.20 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 88 N 8.20 4.68 0.00 2.82 2.91 0.00 0.00 6.12 7.00 0.00 0.00 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 G 8.87 3.98 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 0.00 90 K 7.75 4.78 0.00 1.84 1.93 0.00 1.37 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.48 7.81 91 E 8.76 4.97 0.00 2.11 2.39 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 2.64 2.45 0.00 92 V 9.17 5.09 2.24 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 1.05 0.00 0.00 1.08 0.00 0.00 93 L 9.00 5.40 0.00 1.67 1.75 -0.47 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 94 K 9.03 5.04 0.00 1.94 1.88 0.00 1.75 0.00 0.00 1.91 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.81 1.43 7.81 95 T 9.17 5.33 4.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 96 M 9.24 5.11 0.00 1.82 1.91 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.36 0.00 97 W 8.54 5.38 0.00 2.82 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 98 L 8.77 5.21 0.00 1.60 1.59 0.91 0.63 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 99 L 9.34 4.66 0.00 1.61 1.75 0.80 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 100 R 8.62 4.88 0.00 2.00 1.78 0.00 3.15 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 101 S 9.21 5.05 0.00 3.76 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 0.00 102 S 8.41 4.49 0.00 3.94 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 7.94 4.14 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 0.69 0.00 0.00 0.92 0.00 0.00 104 N 8.16 4.50 0.00 2.70 2.80 0.00 0.00 6.83 8.06 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 0.00 105 D 7.56 4.72 0.00 2.68 2.52 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 0.00 106 I 8.51 3.80 1.88 0.00 0.00 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 1.60 1.20 0.93 0.00 0.00 107 G 8.70 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 0.00 0.00 0.00 108 D 8.31 4.64 0.00 2.79 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 0.00 0.00 0.00 0.00 109 D 8.01 4.33 0.00 2.86 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 0.00 110 W 8.32 4.48 0.00 3.62 3.24 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 0.00 111 K 6.75 4.01 0.00 1.09 0.74 0.00 1.04 0.00 0.00 1.26 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.30 0.21 7.81 112 A 7.98 4.55 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 T 7.55 4.98 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 1.22 0.00 0.00 114 R 9.28 4.84 0.00 1.99 2.13 0.00 3.07 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 115 V 8.06 4.52 1.95 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 0.58 0.00 0.00 0.75 0.00 0.00 116 G 6.98 2.87 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 0.00 117 I 7.40 5.01 1.81 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 1.56 0.97 0.98 0.00 0.00 118 N 8.44 4.69 0.00 3.29 2.87 0.00 0.00 7.28 7.22 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 0.00 119 I 8.83 5.00 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.12 1.02 0.00 0.00 120 F 9.29 5.21 0.00 2.84 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 0.00 121 T 9.36 5.31 4.39 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 1.30 0.00 0.00 122 R 7.91 3.51 0.00 1.60 1.54 0.00 2.99 0.00 0.00 2.62 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.32 0.00 123 L 7.97 4.18 0.00 1.77 1.37 0.91 1.02 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