NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 5.2055 8.5298 119.7259 55.5839 33.5782 174.3298 2 N 4.8510 8.4118 119.1491 49.6630 40.4417 173.4087 3 T 3.8544 9.4029 113.2717 65.7011 67.9900 176.5849 4 E 3.9678 8.0753 119.7990 59.5037 29.6888 179.0465 5 E 4.0660 7.6833 115.7590 59.0832 29.6342 178.8766 6 L 3.9577 7.9316 121.5870 58.2354 42.1782 178.9695 7 Q 4.1924 8.5749 118.6726 58.6176 28.6003 179.0909 8 V 3.7102 7.8651 119.8943 64.6450 31.6081 178.0206 9 A 3.9702 8.2357 121.8030 54.9006 18.0739 179.3438 10 A 3.8815 8.0188 118.8203 55.6114 18.4945 180.0009 11 F 3.7004 8.3537 116.2286 60.2440 38.9580 177.4171 12 E 3.9626 8.9415 119.5110 59.5213 29.3268 179.1278 13 I 3.6773 7.8602 119.4917 64.5308 37.2288 178.0972 14 I 3.5450 8.3753 121.2934 64.5735 37.0426 178.1104 15 L 3.9825 8.5527 119.5234 58.3676 41.6078 179.7327 16 N 4.4460 8.2627 115.9195 56.1219 38.3819 177.9059 17 S 4.2214 8.4432 117.2154 61.3421 62.9119 176.4870 18 G 3.8081 8.5776 108.8597 48.0751 0.0000 175.1524 19 N 4.3000 8.1141 119.3110 56.2723 39.0105 176.6624 20 A 3.9899 7.9766 122.2191 55.1747 18.3020 179.6821 21 R 3.8407 8.1861 117.4069 59.7154 30.2306 178.9194 22 S 4.2896 8.4643 114.4014 61.5888 62.7020 176.5853 23 I 3.9873 8.0477 125.1664 63.6789 36.7691 178.4396 24 V 3.4500 8.1375 119.5755 66.3206 31.2434 177.7762 25 H 4.3834 8.6544 116.3778 58.9195 28.6312 177.5757 26 E 4.0026 8.6198 120.7090 59.3751 29.3818 179.1932 27 A 4.0381 8.1447 120.9873 55.0107 18.4386 179.7291 28 F 4.1972 8.1468 116.4461 60.9330 38.9043 177.5391 29 D 4.4272 8.6735 118.6835 57.4297 40.5449 178.7562 30 A 3.9654 8.2902 121.3833 55.3454 18.3277 179.6348 31 M 3.8528 7.7920 116.9246 58.5893 31.7282 179.1545 32 R 4.4319 7.4571 118.0082 58.6514 30.3589 178.1889 33 E 4.1787 7.6666 115.5330 56.1249 29.6965 177.3245 34 K 3.1949 7.6291 119.2932 57.0251 31.8050 177.2805 35 N 4.4926 7.6626 117.5256 52.5466 35.9893 175.0790 36 Y 4.4951 7.2735 121.4696 60.3214 38.6459 177.4698 37 I 3.9896 7.6756 120.9929 63.9752 37.4549 177.5444 38 L 3.9097 7.9340 120.5267 58.1537 41.8098 178.8210 39 A 3.8719 8.1103 120.3798 55.3357 18.2559 179.1137 40 E 3.8133 8.0929 117.1710 59.8602 29.4480 179.7704 41 Q 3.9334 7.8415 118.5748 59.1217 29.2890 177.9795 42 K 3.8766 8.5048 119.7722 59.6261 32.0628 179.2835 43 L 4.0617 8.1231 119.1388 57.4682 41.4138 179.7147 44 Q 3.9171 7.7251 118.3847 58.9263 28.7826 177.9622 45 E 3.9027 8.3844 119.7566 59.7559 29.5984 179.5881 46 A 3.9955 8.3946 120.7936 54.9476 18.3769 179.0826 47 N 4.2241 7.9061 115.4665 56.9431 38.8665 176.6747 48 D 4.4697 7.8672 118.3670 55.7066 39.4379 178.0179 49 E 4.1047 8.1511 120.8693 59.2555 29.3662 178.8263 50 L 4.0134 8.0586 120.4818 58.0823 42.2059 178.8852 51 L 3.7367 8.1246 118.9724 57.7818 41.3990 178.9430 52 K 3.8813 7.8565 118.8335 59.4294 32.1039 178.3548 53 A 3.9882 7.9796 120.1734 55.5737 18.3837 178.9350 54 H 3.9602 9.0585 117.1966 59.3466 29.9153 177.2522 55 Q 3.9317 8.5249 121.4363 59.1996 29.0621 177.8290 56 A 3.9993 8.1174 121.8444 55.4070 18.2600 179.4486 57 Q 3.8662 7.9703 117.6984 59.6912 29.2066 178.4635 58 T 3.8613 8.4107 117.0698 66.6913 68.4410 176.0410 59 D 4.4056 8.4798 121.1708 57.5871 40.9221 179.1714 60 L 4.0164 7.8094 118.6656 57.9026 41.6188 179.6073 61 L 4.0923 8.2834 119.3004 57.7917 41.5914 179.4297 62 Q 3.9858 8.7307 120.0028 58.9982 28.8580 177.9501 63 E 3.9517 8.3720 119.7364 59.6934 29.5985 178.6810 64 Y 4.3344 8.3909 120.4272 60.2028 38.6306 177.9404 65 A 3.9638 8.1827 120.8317 54.7667 18.4675 178.6736 66 S 4.5208 7.4726 110.2203 58.5757 63.4873 175.2697 67 G 3.9090 7.7611 111.5713 45.8322 0.0000 174.9008 68 T 3.9216 7.5491 117.7333 63.3838 68.9678 173.1412 69 E 4.3470 8.6585 126.8913 55.8018 30.2849 175.8255 70 I 4.3402 8.2474 126.5051 59.0594 38.9113 175.1952 71 K 4.1036 8.6205 128.0441 55.7649 32.0468 176.2448 72 I 4.0502 8.2246 120.7938 60.3692 38.7102 175.7251 73 E 4.6426 8.3500 123.0042 54.4841 33.4768 176.8015 74 I 3.8407 8.0562 119.0211 63.9708 37.9680 177.6122 75 I 3.7239 7.6835 113.6685 63.6549 37.4109 177.9291 76 M 3.9300 7.8934 119.8147 58.6509 32.2887 177.7856 77 V 3.5654 7.4770 118.0920 66.5847 31.4273 177.5402 78 H 4.1649 8.2624 117.3157 59.0783 29.6692 176.9891 79 A 3.8591 8.4836 123.1084 55.4464 18.1776 179.5917 80 Q 3.9038 8.5556 116.7268 59.2283 28.6806 179.0239 81 D 4.3261 8.1243 119.9230 57.4941 40.8521 178.3177 82 H 3.8913 8.2865 117.0599 58.7394 28.7029 177.5420 83 L 4.4867 8.0620 123.4307 58.2218 42.0321 178.9910 84 M 4.1599 8.4190 119.3057 58.4682 31.8116 178.9693 85 T 3.9340 8.3827 110.5765 64.8819 68.9010 176.9980 86 T 3.8129 8.0359 118.5720 66.5520 68.4631 175.8219 87 M 3.9277 8.3303 120.5476 59.3338 32.1310 178.0960 88 T 3.8598 7.8333 115.3755 66.7556 68.7036 175.9933 89 L 4.0038 8.2782 122.2564 58.2579 42.0026 178.9392 90 R 3.7789 8.2447 118.7004 59.6602 29.9422 178.3360 91 E 3.9287 8.3926 118.3481 59.2372 29.3530 179.6845 92 V 3.6145 8.0146 118.2652 65.7990 31.6625 177.6226 93 A 3.8523 8.5621 120.9357 55.4033 18.0289 179.5893 94 I 3.5703 7.8953 118.0791 64.7191 37.2516 178.5932 95 E 3.9694 7.9891 119.0375 59.4646 29.2885 178.9680 96 M 4.1012 8.5741 118.7362 58.7199 32.3404 178.0154 97 L 3.9866 8.3890 120.8062 58.2025 42.0536 178.5743 98 E 3.9512 7.9539 117.9226 58.4545 29.5585 177.6752 99 L 4.3018 7.3601 118.6955 57.0018 42.7452 177.6645 100 Y 4.0682 8.3935 117.6115 60.3585 38.1249 178.9951 101 K 4.0767 7.6261 119.3715 57.0375 31.7210 177.0601 102 K 4.1226 10.1033 123.3181 58.1303 32.7548 175.4219 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 8.53 5.21 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.60 0.00 2 N 8.41 4.85 0.00 3.00 2.93 0.00 0.00 5.83 6.34 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 3 T 9.40 3.85 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 4 E 8.08 3.97 0.00 2.11 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 2.40 2.43 0.00 5 E 7.68 4.07 0.00 2.19 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 0.00 2.52 2.33 0.00 6 L 7.93 3.96 0.00 2.12 1.80 0.94 0.78 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 7 Q 8.57 4.19 0.00 2.21 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.60 0.00 0.00 0.00 0.00 0.00 2.45 2.78 0.00 8 V 7.87 3.71 2.11 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 0.90 0.00 0.00 0.96 0.00 0.00 9 A 8.24 3.97 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 10 A 8.02 3.88 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 F 8.35 3.70 0.00 3.13 3.14 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 12 E 8.94 3.96 0.00 2.14 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 2.34 2.40 0.00 13 I 7.86 3.68 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.53 0.89 0.00 0.00 14 I 8.38 3.55 1.69 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.54 0.74 0.00 0.00 15 L 8.55 3.98 0.00 1.84 1.78 1.18 0.76 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 16 N 8.26 4.45 0.00 2.90 3.04 0.00 0.00 7.11 7.32 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 17 S 8.44 4.22 0.00 4.23 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 18 G 8.58 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 19 N 8.11 4.30 0.00 2.90 2.83 0.00 0.00 7.16 8.29 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 20 A 7.98 3.99 1.40 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 0.00 0.00 21 R 8.19 3.84 0.00 2.14 2.12 0.00 3.13 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.68 0.00 22 S 8.46 4.29 0.00 4.10 4.16 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.05 3.99 2.01 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 1.53 1.16 0.92 0.00 0.00 24 V 8.14 3.45 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 0.87 0.00 0.00 0.94 0.00 0.00 25 H 8.65 4.38 0.00 3.40 3.43 0.00 5.68 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 26 E 8.62 4.00 0.00 2.18 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 2.35 2.54 0.00 27 A 8.14 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 28 F 8.15 4.20 0.00 3.26 3.05 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 29 D 8.67 4.43 0.00 2.82 2.75 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 30 A 8.29 3.97 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 31 M 7.79 3.85 0.00 0.57 1.99 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.33 0.00 32 R 7.46 4.43 0.00 1.97 2.11 0.00 3.18 0.00 0.00 3.16 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.85 0.00 33 E 7.67 4.18 0.00 1.99 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 0.00 2.49 2.43 0.00 34 K 7.63 3.19 0.00 1.78 1.69 0.00 1.79 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.00 1.40 7.81 35 N 7.66 4.49 0.00 2.71 2.66 0.00 0.00 7.03 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 36 Y 7.27 4.50 0.00 3.03 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 37 I 7.68 3.99 1.87 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 1.55 1.16 0.91 0.00 0.00 38 L 7.93 3.91 0.00 1.72 1.83 0.90 1.08 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 39 A 8.11 3.87 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 40 E 8.09 3.81 0.00 2.30 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 0.00 2.34 2.34 0.00 41 Q 7.84 3.93 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 42 K 8.50 3.88 0.00 1.93 1.80 0.00 1.59 0.00 0.00 1.63 0.00 0.00 3.41 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.52 7.81 43 L 8.12 4.06 0.00 1.81 1.65 0.80 0.45 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 44 Q 7.73 3.92 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.72 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 45 E 8.38 3.90 0.00 2.08 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 2.33 2.50 0.00 46 A 8.39 4.00 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 47 N 7.91 4.22 0.00 2.98 2.90 0.00 0.00 6.95 9.04 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 48 D 7.87 4.47 0.00 2.87 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 49 E 8.15 4.10 0.00 2.03 2.04 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 2.46 2.46 0.00 50 L 8.06 4.01 0.00 2.03 1.74 0.94 0.44 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 51 L 8.12 3.74 0.00 1.78 1.71 0.95 0.67 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 52 K 7.86 3.88 0.00 2.00 1.82 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.53 1.47 7.81 53 A 7.98 3.99 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 54 H 9.06 3.96 0.00 3.40 3.45 0.00 5.79 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 8.52 3.93 0.00 2.35 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.51 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 56 A 8.12 4.00 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 57 Q 7.97 3.87 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 58 T 8.41 3.86 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 1.26 0.00 0.00 59 D 8.48 4.41 0.00 2.84 2.75 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 60 L 7.81 4.02 0.00 1.90 1.73 0.92 0.43 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 L 8.28 4.09 0.00 1.81 1.76 0.90 0.83 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 62 Q 8.73 3.99 0.00 2.30 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 63 E 8.37 3.95 0.00 2.32 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 2.43 2.49 0.00 64 Y 8.39 4.33 0.00 3.09 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 65 A 8.18 3.96 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 66 S 7.47 4.52 0.00 4.05 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 67 G 7.76 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 0.00 0.00 0.00 68 T 7.55 3.92 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 1.23 0.00 0.00 69 E 8.66 4.35 0.00 1.95 1.88 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 2.34 2.30 0.00 70 I 8.25 4.34 1.95 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 1.35 0.88 0.93 0.00 0.00 71 K 8.62 4.10 0.00 1.73 1.76 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.44 7.81 72 I 8.22 4.05 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.96 0.86 0.00 0.00 73 E 8.35 4.64 0.00 1.98 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 2.47 2.29 0.00 74 I 8.06 3.84 1.86 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 1.68 1.34 0.89 0.00 0.00 75 I 7.68 3.72 1.56 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 1.42 0.86 0.80 0.00 0.00 76 M 7.89 3.93 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.63 0.00 77 V 7.48 3.57 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 0.93 0.00 0.00 0.94 0.00 0.00 78 H 8.26 4.16 0.00 3.35 3.32 0.00 5.84 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 79 A 8.48 3.86 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 80 Q 8.56 3.90 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.76 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 81 D 8.12 4.33 0.00 2.80 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 82 H 8.29 3.89 0.00 3.25 3.31 0.00 5.62 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.06 4.49 0.00 1.72 1.79 0.96 0.92 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 84 M 8.42 4.16 0.00 2.02 2.14 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 2.59 2.77 0.00 85 T 8.38 3.93 4.21 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 1.19 0.00 0.00 86 T 8.04 3.81 4.33 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 1.30 0.00 0.00 87 M 8.33 3.93 0.00 2.19 2.12 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 2.62 2.78 0.00 88 T 7.83 3.86 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 1.22 0.00 0.00 89 L 8.28 4.00 0.00 1.85 1.85 1.08 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.24 3.78 0.00 1.87 2.10 0.00 3.12 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 91 E 8.39 3.93 0.00 2.18 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 2.33 2.53 0.00 92 V 8.01 3.61 2.35 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 1.11 0.00 0.00 1.01 0.00 0.00 93 A 8.56 3.85 0.80 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 0.00 0.00 94 I 7.90 3.57 2.04 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 1.47 0.75 0.89 0.00 0.00 95 E 7.99 3.97 0.00 2.11 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 2.54 2.47 0.00 96 M 8.57 4.10 0.00 2.45 2.53 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 3.15 0.00 97 L 8.39 3.99 0.00 1.76 1.81 0.85 0.75 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 98 E 7.95 3.95 0.00 2.19 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 2.31 2.34 0.00 99 L 7.36 4.30 0.00 1.86 1.85 0.87 1.08 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 0.00 100 Y 8.39 4.07 0.00 2.98 2.42 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 0.00 101 K 7.63 4.08 0.00 1.72 1.22 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.33 7.81 102 K 10.10 4.12 0.00 1.91 1.81 0.00 1.82 0.00 0.00 1.78 0.00 0.00 3.20 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.61 1.59 7.81