NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.7138 8.2649 122.4706 52.1638 20.2962 175.6863 2 T 4.5246 8.7743 116.9457 61.2215 71.4684 171.8986 3 K 5.2369 9.0450 126.0266 54.7637 36.6772 174.5890 4 A 5.4475 9.1370 124.5132 50.8469 23.5331 174.9248 5 V 5.1100 8.7522 116.8779 60.7065 35.3080 173.4496 6 A 5.0500 9.2336 123.7459 50.3571 22.5768 175.1191 7 V 4.4439 8.3723 122.4882 61.2880 33.4081 174.6328 8 L 4.5340 9.1814 130.2619 54.2925 42.6567 176.5275 9 K 4.8886 9.2489 123.0192 55.1662 36.9114 176.2967 10 G 4.0099 8.0008 108.1212 45.4506 0.0000 172.0602 11 D 4.5260 8.7501 117.7224 55.5403 41.6775 176.8130 12 G 4.2195 7.5845 108.6006 43.8769 0.0000 171.5138 13 P 4.4141 0.0000 0.0000 63.3903 32.0259 175.4580 14 V 4.5045 7.5595 120.6722 62.8976 31.9127 174.9186 15 Q 4.8106 8.6219 125.4015 55.0832 32.5172 173.6826 16 G 4.2249 7.9855 106.5363 46.3184 0.0000 171.9429 17 I 5.0342 7.7743 120.2937 59.3157 40.4487 175.0185 18 I 4.5696 8.7519 127.7538 59.5093 40.0550 174.4886 19 N 4.9517 8.6748 125.0656 51.5662 40.8947 174.0661 20 F 5.4061 9.0763 120.0683 55.8897 43.2226 173.8054 21 E 5.2253 9.6292 122.7989 55.0305 33.7284 173.7877 22 Q 4.7841 9.3520 127.3436 54.4147 31.4044 175.3559 23 K 3.9909 9.0735 128.7730 58.5954 32.8355 176.8388 24 E 4.8357 7.8130 117.1444 53.9977 32.4859 177.0953 25 S 4.1472 8.8329 116.9843 60.6796 63.2262 174.7293 26 N 4.8132 8.2248 116.4545 52.2299 37.2421 174.1632 27 G 4.1169 7.7314 108.7278 43.2767 0.0000 171.6470 28 P 4.6929 0.0000 0.0000 62.6421 32.6660 175.8549 29 V 4.5816 9.2003 122.0059 61.2487 33.4823 174.7850 30 K 4.7310 9.3335 128.9268 56.1652 33.3996 176.0400 31 V 4.7682 9.3062 126.1393 60.7962 33.7635 174.3521 32 W 5.4135 8.6676 124.1301 54.7193 31.9316 175.3284 33 G 3.9847 7.8373 106.1227 45.9922 0.0000 171.2025 34 S 5.1630 7.7272 114.2458 57.0601 66.8638 173.4456 35 I 4.9416 8.7285 122.5696 59.4210 40.6346 174.7426 36 K 4.8113 9.3207 125.1975 55.6773 36.1801 177.0060 37 G 3.8535 8.7829 105.8060 46.5373 0.0000 173.4649 38 L 4.4140 7.4641 119.5916 53.1516 42.8772 176.5288 39 T 4.2054 8.2270 112.0339 61.1181 69.1534 173.8747 40 E 4.1135 8.7428 124.5893 58.0150 30.6490 175.0011 41 G 4.3138 8.7328 110.3375 44.1060 0.0000 171.9595 42 L 5.1030 8.4276 118.9187 53.9624 44.1739 175.6687 43 H 5.0619 8.9708 119.0827 53.6410 33.0001 173.3310 44 G 4.1171 9.2032 110.9431 46.9855 0.0000 172.6097 45 F 5.4102 8.8357 124.9710 57.0673 42.1097 172.8038 46 H 5.1819 8.8884 122.7574 53.8687 33.6470 172.8923 47 V 4.3998 8.5034 121.7048 62.5773 32.7249 175.1267 48 H 5.0196 9.6305 126.5093 54.5633 30.4472 176.0285 49 E 3.8039 8.8129 122.2524 58.7909 29.9044 177.1180 50 F 5.0452 8.4041 118.3430 54.8970 41.7728 176.7584 51 G 4.5034 8.4347 111.6366 44.7556 0.0000 173.8707 52 D 4.7709 8.0437 118.5648 52.5562 42.3454 174.4154 53 N 5.4302 8.7430 124.6989 52.7955 39.2836 176.4047 54 T 4.0443 8.6137 109.3852 63.1041 69.0311 174.4493 55 A 4.6698 7.7239 125.5036 51.6118 20.1321 177.6659 56 G 3.8105 8.1039 109.5882 46.6533 0.0000 175.4512 57 A 4.0283 8.4678 119.3275 55.2574 18.0364 179.7552 58 T 3.8965 8.0374 114.5476 66.8146 68.3073 175.5579 59 S 4.4510 7.8636 112.0862 58.9816 63.8490 175.1984 60 A 4.6400 7.5522 126.5549 53.5684 18.2703 178.6060 61 G 3.7318 7.8491 106.0970 43.7250 0.0000 170.9093 62 P 4.6746 0.0000 0.0000 62.1358 33.3640 175.1857 63 H 4.2129 8.5869 116.6620 55.8701 29.4088 175.4922 64 F 4.2048 9.1645 125.8160 58.2746 40.3174 174.8298 65 N 5.0865 7.8011 125.7991 51.4792 38.7224 173.0010 66 P 4.0947 0.0000 0.0000 64.8473 32.0952 177.9087 67 L 4.2539 7.5617 116.9936 53.7050 42.2137 176.2605 68 S 3.5956 7.4511 113.4839 60.1785 60.5777 170.5483 69 R 4.6957 8.1585 117.7096 54.3988 33.4670 175.8049 70 K 4.6186 7.9844 117.4470 55.2477 34.4920 176.3002 71 H 4.2136 8.2951 121.8925 57.0848 30.5518 175.2559 72 G 3.9257 7.7508 108.2519 46.2525 0.0000 172.6589 73 G 4.2549 8.7616 108.5766 42.5262 0.0000 173.3829 74 P 4.2614 0.0000 0.0000 65.8889 31.3105 178.1971 75 K 4.1951 7.9170 115.9110 56.9942 32.1129 177.0354 76 D 4.6590 7.5719 118.8116 53.5564 41.8091 177.2237 77 E 3.8034 8.6921 122.9430 59.2274 29.9122 176.8580 78 E 4.1155 7.9874 120.9530 55.9506 29.6013 175.3700 79 R 4.6338 7.5951 120.3674 56.3855 31.6776 173.6856 80 H 4.4804 8.8252 116.2591 55.2328 29.3542 177.1064 81 V 3.5553 8.3783 122.5713 66.1685 31.4157 177.5430 82 G 3.7522 8.3224 107.2575 46.9759 0.0000 172.8232 83 D 4.8041 7.9560 119.9189 54.6645 39.4650 175.5403 84 L 4.7523 8.3525 124.6078 54.0147 43.2758 179.0765 85 G 3.8732 8.0450 108.9971 47.0943 0.0000 174.2400 86 N 5.5815 8.7438 120.7546 51.4225 41.8376 173.7974 87 V 4.2347 8.4037 115.4953 60.2117 34.8558 174.9936 88 T 4.9731 8.2236 118.9617 61.9034 71.0062 173.0238 89 A 4.8971 9.0792 129.9098 50.6323 20.9376 177.2961 90 D 4.6204 8.7438 122.9065 52.0251 41.2771 176.9757 91 K 4.1076 8.5185 116.6803 59.4618 32.3063 177.1205 92 D 4.6141 8.2923 116.9686 53.7863 41.1113 176.6604 93 G 4.1385 8.3770 107.5094 45.0431 0.0000 172.9203 94 V 4.7549 8.2238 120.0254 60.7520 33.7696 174.3046 95 A 5.3508 9.1356 130.4667 49.8552 20.7409 175.6003 96 D 4.8585 8.6432 123.6165 53.6710 41.4799 176.2563 97 V 3.9457 8.6709 125.4392 61.9233 33.1478 175.2424 98 S 5.0008 8.5076 122.8635 57.6130 63.8960 172.6221 99 I 4.8210 9.6560 128.5233 59.2830 41.1552 174.4394 100 E 5.2440 8.8208 123.6699 54.7586 32.5743 174.9295 101 D 4.9046 9.3712 122.7903 52.6160 45.0576 175.5584 102 S 4.8414 8.8916 117.9240 58.1593 63.7954 174.3872 103 V 4.0945 8.0480 121.0272 64.7097 32.3877 176.4816 104 I 4.0873 7.8271 111.5791 60.9345 38.3256 174.9496 105 S 4.6928 8.2177 114.5720 57.0726 65.3733 174.2719 106 L 4.4338 8.9935 124.3367 54.8454 41.8969 176.1826 107 S 4.5342 7.5520 112.6350 57.1795 66.5430 173.9268 108 G 3.9672 8.5725 107.0987 44.8035 0.0000 173.9617 109 D 4.4894 8.3933 116.9641 55.4803 39.5841 176.6967 110 H 5.1581 7.8806 116.2850 55.3160 29.3952 174.5291 111 A 4.3838 7.6613 121.7675 52.4760 18.8171 178.7563 112 I 3.7273 8.1774 112.5561 60.8440 38.4190 176.2368 113 I 3.7226 7.2954 122.9563 63.1389 37.3731 176.2177 114 G 3.7949 9.4957 113.3641 45.4291 0.0000 172.9216 115 R 4.9175 7.4325 119.2928 54.7806 33.6646 174.5932 116 T 4.9349 8.0581 115.5015 61.9842 71.2968 173.6480 117 L 4.7829 8.6460 129.0044 54.1618 43.8689 175.3899 118 V 4.9748 8.8557 126.2608 60.9945 34.9277 174.1873 119 V 5.0900 8.6218 127.1303 60.5873 33.6499 174.8765 120 H 5.2981 9.0160 121.3669 54.0933 30.8777 174.7420 121 E 4.1818 9.3421 121.6057 59.1818 29.8819 176.7955 122 K 4.7233 8.6223 117.4382 53.8366 35.8927 175.3085 123 A 4.5666 8.2879 122.7713 51.5882 19.0478 176.8600 124 D 4.7286 9.9531 123.6805 53.8327 41.8983 175.8687 125 D 4.6375 9.1216 124.7351 53.0109 39.5835 176.5860 126 L 3.7999 9.3023 118.4025 56.1987 39.5556 175.4375 127 G 3.9904 8.5214 104.1277 46.1501 0.0000 175.0271 128 K 4.5530 8.1607 116.8112 55.8867 32.5897 177.7040 129 G 3.8477 7.6948 110.2734 46.6228 0.0000 175.0487 130 G 3.8614 9.7793 106.5612 44.8415 0.0000 170.9881 131 N 4.8404 7.4322 114.4554 51.6397 40.4006 175.1786 132 E 3.9783 8.7420 116.7676 59.5098 29.7674 179.2976 133 E 4.0005 8.2613 118.7417 58.9161 29.7618 178.4790 134 S 4.1020 8.4496 113.6968 61.1098 62.4122 175.4190 135 T 4.1687 7.7053 110.1568 62.6635 68.5164 175.1416 136 K 4.2487 7.1562 120.8493 57.8941 34.0925 177.1808 137 T 3.9487 8.0170 106.4861 60.3964 70.4627 175.1602 138 G 3.7550 7.7078 109.7230 45.7135 0.0000 173.3753 139 N 4.3070 7.5705 113.0195 53.9434 36.7696 175.2070 140 A 4.3511 7.9559 119.5532 52.3864 19.9290 179.5989 141 G 3.8652 7.9821 103.5593 44.8516 0.0000 173.3860 142 S 4.4324 8.5798 115.0472 58.4776 64.7749 174.0903 143 R 4.4195 8.3583 120.0828 55.5181 29.6518 176.4542 144 L 4.3645 8.9673 125.3588 57.1396 43.1697 176.9817 145 A 4.8328 7.7383 117.5343 51.0782 22.8017 174.9147 146 A 5.4480 8.6187 120.1738 51.9532 23.4468 175.6440 147 G 4.5392 8.1579 104.1099 45.5888 0.0000 172.8476 148 V 4.2489 8.3013 123.0765 62.5403 32.7517 175.8248 149 I 4.1032 9.0490 129.2719 60.9432 37.5527 175.2812 150 G 4.3952 8.8885 115.2889 43.9641 0.0000 171.7266 151 I 4.2463 8.2654 121.6727 61.1556 37.5463 175.5617 152 A 4.8055 8.4742 128.6284 49.6316 21.8581 176.3466 153 Q 4.0700 8.5223 119.0266 56.4458 29.1832 176.1484 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 A 8.26 4.71 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 2 T 8.77 4.52 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 1.22 0.00 0.00 3 K 9.05 5.24 0.00 1.87 1.73 0.00 1.68 0.00 0.00 1.92 0.00 0.00 3.23 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.56 1.49 7.81 4 A 9.14 5.45 1.09 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 5 V 8.75 5.11 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 0.95 0.00 0.00 6 A 9.23 5.05 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 7 V 8.37 4.44 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 0.98 0.00 0.00 0.92 0.00 0.00 8 L 9.18 4.53 0.00 1.80 1.60 1.04 0.59 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 9 K 9.25 4.89 0.00 1.63 1.63 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.36 7.81 10 G 8.00 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 0.00 0.00 0.00 11 D 8.75 4.53 0.00 2.68 2.73 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 0.00 12 G 7.58 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 0.00 0.00 0.00 0.00 13 P 0.00 4.41 0.00 2.22 2.29 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.94 0.00 14 V 7.56 4.50 2.07 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 0.79 0.00 0.00 0.94 0.00 0.00 15 Q 8.62 4.81 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.54 0.00 0.00 0.00 0.00 0.00 2.43 2.31 0.00 16 G 7.99 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 0.00 0.00 0.00 0.00 17 I 7.77 5.03 1.82 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 1.20 1.51 0.83 0.00 0.00 18 I 8.75 4.57 1.86 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 1.27 1.37 0.48 0.00 0.00 19 N 8.67 4.95 0.00 1.44 1.46 0.00 0.00 6.36 5.54 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 20 F 9.08 5.41 0.00 2.85 2.94 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 21 E 9.63 5.23 0.00 2.50 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 0.00 2.33 2.42 0.00 22 Q 9.35 4.78 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 23 K 9.07 3.99 0.00 1.78 1.84 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.48 7.81 24 E 7.81 4.84 0.00 2.01 1.92 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 2.29 2.20 0.00 25 S 8.83 4.15 0.00 3.99 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 26 N 8.22 4.81 0.00 2.84 2.93 0.00 0.00 5.85 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 27 G 7.73 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 28 P 0.00 4.69 0.00 2.13 2.10 0.00 3.77 0.00 0.00 3.61 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 29 V 9.20 4.58 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 1.32 0.00 0.00 1.07 0.00 0.00 30 K 9.33 4.73 0.00 1.93 1.84 0.00 1.61 0.00 0.00 1.39 0.00 0.00 2.71 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.47 1.43 7.81 31 V 9.31 4.77 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 0.70 0.00 0.00 1.06 0.00 0.00 32 W 8.67 5.41 0.00 3.51 3.16 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 33 G 7.84 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 34 S 7.73 5.16 0.00 3.83 3.90 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 35 I 8.73 4.94 1.80 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 1.28 0.83 0.96 0.00 0.00 36 K 9.32 4.81 0.00 1.71 1.88 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.34 7.81 37 G 8.78 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 38 L 7.46 4.41 0.00 1.68 1.38 0.82 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.23 4.21 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 40 E 8.74 4.11 0.00 2.03 1.89 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 2.39 2.36 0.00 41 G 8.73 4.31 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 0.00 42 L 8.43 5.10 0.00 1.58 1.57 0.92 0.95 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 43 H 8.97 5.06 0.00 3.04 3.31 0.00 5.63 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 44 G 9.20 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 45 F 8.84 5.41 0.00 3.01 3.02 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 46 H 8.89 5.18 0.00 3.05 2.98 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.50 4.40 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 0.88 0.00 0.00 0.90 0.00 0.00 48 H 9.63 5.02 0.00 3.10 3.39 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.81 3.80 0.00 1.76 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 1.59 2.23 0.00 50 F 8.40 5.05 0.00 3.20 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 51 G 8.43 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 0.00 0.00 0.00 0.00 52 D 8.04 4.77 0.00 2.61 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 53 N 8.74 5.43 0.00 2.80 2.70 0.00 0.00 7.44 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 54 T 8.61 4.04 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 55 A 7.72 4.67 1.25 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 0.00 0.00 0.00 56 G 8.10 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 57 A 8.47 4.03 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 58 T 8.04 3.90 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 59 S 7.86 4.45 0.00 4.10 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 60 A 7.55 4.64 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 61 G 7.85 3.73 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 0.00 0.00 0.00 0.00 62 P 0.00 4.67 0.00 2.05 2.21 0.00 3.63 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 2.07 1.98 0.00 63 H 8.59 4.21 0.00 2.90 3.24 0.00 5.73 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 64 F 9.16 4.20 0.00 2.96 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 65 N 7.80 5.09 0.00 2.53 2.38 0.00 0.00 6.92 7.71 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 66 P 0.00 4.09 0.00 1.61 1.78 0.00 3.04 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.05 0.00 67 L 7.56 4.25 0.00 1.55 1.65 0.86 0.78 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 68 S 7.45 3.60 0.00 3.97 3.86 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 69 R 8.16 4.70 0.00 1.76 1.98 0.00 3.11 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 70 K 7.98 4.62 0.00 1.71 1.68 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.50 7.81 71 H 8.30 4.21 0.00 3.11 3.25 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.75 3.93 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 0.00 0.00 0.00 73 G 8.76 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 0.00 0.00 0.00 0.00 74 P 0.00 4.26 0.00 2.24 2.25 0.00 3.80 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 75 K 7.92 4.20 0.00 1.78 1.91 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.42 7.81 76 D 7.57 4.66 0.00 2.93 2.56 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 0.00 77 E 8.69 3.80 0.00 1.90 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 0.00 2.28 2.34 0.00 78 E 7.99 4.12 0.00 1.93 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 2.26 2.31 0.00 79 R 7.60 4.63 0.00 1.93 1.77 0.00 2.73 0.00 0.00 2.44 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 80 H 8.83 4.48 0.00 3.27 3.39 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.38 3.56 1.68 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 0.91 0.00 0.00 0.75 0.00 0.00 82 G 8.32 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 83 D 7.96 4.80 0.00 2.82 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 84 L 8.35 4.75 0.00 1.89 1.88 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.05 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 86 N 8.74 5.58 0.00 2.59 2.70 0.00 0.00 6.68 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 87 V 8.40 4.23 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 -0.20 0.00 0.00 0.76 0.00 0.00 88 T 8.22 4.97 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 1.20 0.00 0.00 89 A 9.08 4.90 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 90 D 8.74 4.62 0.00 2.91 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 91 K 8.52 4.11 0.00 1.88 2.00 0.00 1.17 0.00 0.00 1.27 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.41 1.43 7.81 92 D 8.29 4.61 0.00 2.79 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.38 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 94 V 8.22 4.75 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 1.00 0.00 0.00 0.97 0.00 0.00 95 A 9.14 5.35 1.13 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 0.00 0.00 0.00 0.00 0.00 96 D 8.64 4.86 0.00 2.56 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 97 V 8.67 3.95 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 0.72 0.00 0.00 0.64 0.00 0.00 98 S 8.51 5.00 0.00 3.90 3.73 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 0.00 99 I 9.66 4.82 2.06 0.00 0.00 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 1.28 0.77 1.00 0.00 0.00 100 E 8.82 5.24 0.00 1.83 1.85 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 2.22 2.28 0.00 101 D 9.37 4.90 0.00 2.81 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 8.89 4.84 0.00 4.01 3.93 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 0.00 103 V 8.05 4.09 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 0.87 0.00 0.00 0.95 0.00 0.00 104 I 7.83 4.09 1.95 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.82 1.05 0.00 0.00 105 S 8.22 4.69 0.00 3.86 3.79 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 0.00 106 L 8.99 4.43 0.00 1.76 1.65 1.05 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.55 4.53 0.00 3.86 3.80 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 0.00 108 G 8.57 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 0.00 109 D 8.39 4.49 0.00 2.76 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 0.00 110 H 7.88 5.16 0.00 3.21 3.44 0.00 5.73 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.66 4.38 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 0.00 112 I 8.18 3.73 1.62 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.32 0.92 0.00 0.00 113 I 7.30 3.72 1.78 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.77 0.83 0.00 0.00 114 G 9.50 3.79 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 0.00 0.00 0.00 115 R 7.43 4.92 0.00 1.57 1.81 0.00 2.21 0.00 0.00 2.30 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.34 0.00 116 T 8.06 4.93 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 1.21 0.00 0.00 117 L 8.65 4.78 0.00 1.78 1.53 0.37 0.66 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 0.00 118 V 8.86 4.97 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 0.73 0.00 0.00 0.77 0.00 0.00 119 V 8.62 5.09 2.31 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 0.73 0.00 0.00 1.05 0.00 0.00 120 H 9.02 5.30 0.00 3.30 3.60 0.00 5.66 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.34 4.18 0.00 2.13 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 2.36 2.34 0.00 122 K 8.62 4.72 0.00 1.82 1.69 0.00 1.91 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.39 7.81 123 A 8.29 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 9.95 4.73 0.00 2.73 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 0.00 125 D 9.12 4.64 0.00 2.98 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 0.00 126 L 9.30 3.80 0.00 1.81 1.79 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.52 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 0.00 0.00 0.00 128 K 8.16 4.55 0.00 1.86 1.80 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.55 7.81 129 G 7.69 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 0.00 130 G 9.78 3.86 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 0.00 0.00 0.00 131 N 7.43 4.84 0.00 2.91 2.92 0.00 0.00 6.11 7.66 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 0.00 132 E 8.74 3.98 0.00 2.05 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 2.40 2.30 0.00 133 E 8.26 4.00 0.00 2.07 2.17 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 2.36 2.39 0.00 134 S 8.45 4.10 0.00 3.94 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 0.00 135 T 7.71 4.17 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 1.24 0.00 0.00 136 K 7.16 4.25 0.00 1.86 1.79 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.46 7.81 137 T 8.02 3.95 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 1.21 0.00 0.00 138 G 7.71 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 7.57 4.31 0.00 2.87 2.89 0.00 0.00 6.82 7.23 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 0.00 140 A 7.96 4.35 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 0.00 141 G 7.98 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 0.00 142 S 8.58 4.43 0.00 3.95 4.04 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 0.00 143 R 8.36 4.42 0.00 1.68 1.82 0.00 3.25 0.00 0.00 3.08 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.66 0.00 144 L 8.97 4.36 0.00 1.70 1.69 0.98 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.74 4.83 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 0.00 146 A 8.62 5.45 1.19 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 0.00 0.00 147 G 8.16 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.30 4.25 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 0.81 0.00 0.00 0.97 0.00 0.00 149 I 9.05 4.10 1.77 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 0.92 0.63 0.28 0.00 0.00 150 G 8.89 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 0.00 0.00 0.00 0.00 151 I 8.27 4.25 1.85 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 1.24 0.53 0.90 0.00 0.00 152 A 8.47 4.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 8.52 4.07 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00