NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 N 4.7158 8.4244 118.1280 52.2735 40.0801 174.3944 6 F 3.8125 8.1942 119.3727 58.1479 39.8728 171.2615 7 K 4.1335 7.6847 126.4243 57.0544 35.2202 174.8087 8 D 4.5443 7.0456 115.5072 51.6916 44.5772 176.2528 9 F 4.5685 8.7702 119.7105 59.1986 38.9302 177.5541 10 S 4.2764 8.0213 115.1667 59.8455 63.4191 176.2693 11 S 4.0686 7.7656 117.5103 60.5724 62.6417 174.9274 12 I 4.4219 7.1703 111.5826 60.2657 37.8656 175.5860 13 A 4.2785 7.5220 124.6028 53.9308 18.6538 179.2712 14 S 3.9788 9.3735 116.0591 58.7633 61.3573 170.3845 15 A 4.9017 7.3897 120.2745 49.9613 22.6618 176.2359 16 S 4.9525 8.6719 115.4328 58.6055 64.0518 174.1749 17 S 4.8085 9.1660 117.0107 56.9824 66.7139 172.8062 18 S 5.2167 8.3443 118.3232 57.1001 64.9233 173.1096 19 W 5.5258 9.3950 123.5601 54.9478 33.4974 173.9718 20 Q 5.7292 9.6131 124.1976 53.3937 32.0832 174.8177 21 N 5.5480 8.7837 123.7658 50.7703 39.5421 175.7558 22 Q 4.0476 8.6530 116.1966 58.7841 28.5235 177.2987 23 S 4.4485 8.2209 113.0353 58.0170 63.0960 174.5695 24 G 3.9694 7.9406 107.7809 46.4052 0.0000 174.2516 25 S 4.6030 8.2016 115.8228 58.2072 64.4933 173.2111 26 T 5.2457 9.0753 117.2803 60.5303 70.9313 172.4858 27 M 5.1516 9.4299 124.6542 53.5296 35.1915 174.0312 28 I 5.0923 8.8438 122.6015 59.6184 40.1624 174.4448 29 I 4.9307 9.0768 121.3167 59.0909 40.6784 174.3704 30 Q 5.0265 9.5784 125.0565 54.3661 31.0560 174.5344 31 V 4.6597 8.1501 123.0284 61.1239 33.9887 174.5303 32 D 5.1544 8.7786 127.9450 51.9140 41.5520 177.6426 33 S 4.1775 8.3367 113.1083 59.9339 63.2953 174.5257 34 F 4.8712 7.7245 119.3539 57.5502 38.9942 176.7014 35 G 3.9787 8.4300 108.4730 45.7646 0.0000 173.8055 36 N 5.0085 9.1194 118.3175 52.8670 40.2662 174.1873 37 V 4.8667 9.0184 122.3686 61.3090 34.2289 174.6622 38 S 5.0634 10.3242 123.0595 56.0081 67.1474 174.2151 39 G 4.1019 6.7996 106.9390 46.0082 0.0000 171.2732 40 Q 5.0183 8.3202 120.1643 54.4765 33.6908 173.4958 41 Y 4.8011 9.4052 125.1384 55.8577 41.3936 174.3684 42 V 4.6301 8.9450 128.6776 61.2624 33.1141 174.1212 43 N 5.0288 9.1103 127.8716 53.2215 40.2234 175.4482 44 R 4.8048 9.0736 123.8861 55.7727 32.4080 174.9404 45 A 4.0446 8.6324 123.0049 51.5978 18.6578 177.9857 46 Q 4.0161 8.6924 124.4941 57.9064 29.3755 176.6288 47 G 3.8654 8.8477 111.9771 46.2989 0.0000 172.9811 48 T 4.3602 7.4622 108.7732 59.1363 70.9620 174.2720 49 G 3.7014 8.0276 111.7245 45.1289 0.0000 173.6907 50 C 4.4684 8.5842 113.4408 58.0483 34.8221 173.3870 51 Q 4.7226 7.6097 117.3095 55.6160 30.4380 176.3694 52 N 4.3562 8.9538 115.7557 53.9083 37.0660 174.3060 53 S 4.9625 7.8091 111.9101 55.5318 65.7973 172.1837 54 P 4.7866 0.0000 0.0000 63.2345 32.1209 174.9566 55 Y 4.6767 9.0472 120.7234 55.4178 40.9419 173.6021 56 P 4.8798 0.0000 0.0000 62.5511 32.4335 175.4991 57 L 4.9621 8.6435 124.4085 53.6056 45.5206 175.0870 58 T 4.8499 8.8896 119.5109 60.7614 71.3280 172.5341 59 G 4.4966 8.8391 112.9491 45.7350 0.0000 171.7334 60 R 5.2038 9.0471 119.1106 54.3750 33.1895 176.2070 61 V 4.5883 8.6556 116.1052 60.3023 34.7106 176.1496 62 N 4.6934 9.7785 119.6149 53.8935 41.5134 176.7541 63 G 4.3737 8.5409 119.1755 46.8218 0.0000 173.0674 64 T 4.3589 8.7010 120.5722 61.6264 67.8248 172.5265 65 F 5.7563 8.2682 119.4816 56.6824 42.3783 174.3311 66 I 5.1557 9.1102 120.7241 59.5079 41.8903 173.5750 67 A 5.3270 8.9950 129.2776 50.2888 22.4411 174.9684 68 F 5.4790 8.9170 115.7896 55.8840 42.1803 173.4755 69 S 5.2971 9.5519 114.8102 57.2486 67.8937 173.5103 70 V 4.5730 9.0069 122.3236 61.2875 34.6899 174.0294 71 G 4.0849 8.5341 115.1245 44.2879 0.0000 174.5658 72 W 4.6243 8.3071 127.3011 54.7796 27.3540 175.7558 73 N 6.0240 8.3041 116.7437 52.1028 41.6244 173.1205 74 N 4.8958 8.7757 121.8029 52.1961 37.9208 175.5724 75 S 4.0751 8.7336 111.9456 59.5029 63.0067 171.1845 76 T 4.2408 8.4702 117.7716 65.4466 69.2672 175.1749 77 E 4.5854 8.1629 121.2555 54.8334 32.5848 172.7010 78 N 5.3408 8.9063 124.9470 52.5387 39.7769 174.7088 79 C 4.5335 9.0383 122.9073 56.0933 39.9523 173.1448 80 N 4.1542 8.4302 118.7826 53.5094 37.1019 171.3950 81 S 5.1009 7.2833 113.2982 58.0325 67.2550 174.7383 82 A 5.2289 8.9339 120.5601 51.0301 23.0869 175.3238 83 T 5.5681 8.2358 114.8328 61.6867 73.4564 173.4209 84 G 4.4222 8.5155 112.4081 44.1673 0.0000 171.5812 85 W 5.3410 8.9413 123.9285 55.1674 32.1168 175.2358 86 T 4.9785 8.8276 118.8352 61.8844 72.5039 174.2139 87 G 4.6986 8.8495 111.3248 46.4789 0.0000 171.1323 88 Y 5.5282 7.3088 116.6068 55.7729 41.5321 174.6871 89 A 4.9296 8.5259 123.5201 51.7943 20.4095 175.9434 90 Q 4.5365 8.4867 116.1653 55.9368 32.6663 172.9023 91 V 4.7199 8.4285 119.4109 61.2785 32.9767 174.5369 92 N 5.1078 8.6349 124.5008 52.2356 42.8271 175.2045 93 G 3.7771 8.5451 109.4519 47.3647 0.0000 174.1144 94 N 5.0064 8.8180 119.5468 52.2292 38.0473 173.6700 95 N 5.2747 7.9554 115.5233 52.1973 41.5623 172.9069 96 T 4.8563 8.3109 108.6736 60.7198 71.2589 173.4629 97 E 5.3113 9.5751 122.9428 54.7635 33.9218 175.2401 98 I 4.6932 8.9898 122.7922 59.7699 40.1045 174.7114 99 V 4.5799 8.4156 128.8958 61.6849 32.4234 174.9753 100 T 5.4142 9.6315 117.7103 60.0456 72.9462 172.6693 101 S 5.0752 9.1675 116.5580 56.3335 66.7196 172.9062 102 W 6.0824 8.4462 117.2851 53.8660 31.9412 173.4099 103 N 5.4342 8.6560 118.0699 51.4350 41.6112 172.9973 104 L 4.8976 9.4244 126.0541 53.3790 44.4993 174.8175 105 A 5.1927 8.8589 130.1375 51.1046 20.2577 175.5038 106 Y 5.0301 8.8010 120.2027 55.5361 42.4673 174.4926 107 E 4.5182 8.3621 121.3485 54.8841 29.3475 176.3140 108 G 3.8645 8.3632 116.6406 44.5516 0.0000 173.2308 109 G 3.7947 8.5784 108.1251 47.5023 0.0000 174.6139 110 S 4.4829 7.7297 114.3888 57.9120 63.8012 172.8166 111 G 3.7106 8.0074 107.5576 43.2743 0.0000 170.5817 112 P 4.5063 0.0000 0.0000 62.3340 31.7972 175.3109 113 A 4.6119 7.8768 124.9167 49.9230 22.5035 174.8750 114 I 5.0139 7.9531 118.5472 59.8380 40.1597 175.4977 115 E 4.6598 9.6762 128.7876 55.4016 31.6304 174.7073 116 Q 4.7525 7.3941 120.9271 53.1878 33.2654 174.6370 117 G 2.9218 5.9476 106.0018 45.8367 0.0000 171.5015 118 Q 5.0697 8.4028 117.6294 53.0573 31.9337 174.9350 119 D 5.3605 9.1543 122.5891 52.9977 44.0557 175.5449 120 T 5.1107 8.9169 118.4118 62.0076 71.5477 173.0432 121 F 5.3559 9.8130 125.7247 56.0451 41.8272 174.8597 122 Q 5.1882 9.3721 121.1341 54.1155 31.8853 174.4102 123 Y 3.5406 8.4373 125.0928 57.1749 39.5460 174.8595 124 V 3.9898 7.2245 127.1673 59.8742 33.3769 173.7037 125 P 4.2147 0.0000 0.0000 62.4776 31.9850 175.9968 126 T 4.0239 8.0956 116.0866 63.7532 69.0464 174.7057 127 T 4.4936 8.1314 121.9146 62.3331 70.3427 174.7798 128 E 4.2617 8.4777 122.0646 56.6365 30.0518 176.1398 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 5 N 8.42 4.72 0.00 2.73 2.90 0.00 0.00 6.85 6.56 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 6 F 8.19 3.81 0.00 2.97 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 7 K 7.68 4.13 0.00 1.51 1.43 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.18 1.27 7.81 8 D 7.05 4.54 0.00 2.55 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 0.00 0.00 0.00 0.00 9 F 8.77 4.57 0.00 3.50 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 10 S 8.02 4.28 0.00 3.97 4.10 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 11 S 7.77 4.07 0.00 3.64 3.82 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 12 I 7.17 4.42 2.14 0.00 0.00 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 1.68 1.11 1.17 0.00 0.00 13 A 7.52 4.28 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 14 S 9.37 3.98 0.00 3.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.39 4.90 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 16 S 8.67 4.95 0.00 3.79 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 17 S 9.17 4.81 0.00 4.05 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 18 S 8.34 5.22 0.00 3.70 3.63 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 19 W 9.39 5.53 0.00 3.17 3.23 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 0.00 20 Q 9.61 5.73 0.00 2.05 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.70 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 21 N 8.78 5.55 0.00 2.46 1.42 0.00 0.00 6.48 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 22 Q 8.65 4.05 0.00 2.19 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 7.12 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 23 S 8.22 4.45 0.00 3.98 3.92 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 24 G 7.94 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 0.00 0.00 0.00 25 S 8.20 4.60 0.00 4.10 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 26 T 9.08 5.25 4.18 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 1.15 0.00 0.00 27 M 9.43 5.15 0.00 1.66 1.89 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 28 I 8.84 5.09 1.86 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 1.27 0.67 0.92 0.00 0.00 29 I 9.08 4.93 1.72 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.01 0.55 0.00 0.00 30 Q 9.58 5.03 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 31 V 8.15 4.66 2.32 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 1.06 0.00 0.00 0.93 0.00 0.00 32 D 8.78 5.15 0.00 2.79 2.76 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 33 S 8.34 4.18 0.00 3.66 3.82 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 34 F 7.72 4.87 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.43 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 36 N 9.12 5.01 0.00 2.93 2.76 0.00 0.00 6.40 8.11 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 37 V 9.02 4.87 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 0.73 0.00 0.00 0.74 0.00 0.00 38 S 10.32 5.06 0.00 3.72 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 39 G 6.80 4.10 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 0.00 0.00 0.00 40 Q 8.32 5.02 0.00 1.92 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.71 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 41 Y 9.41 4.80 0.00 2.96 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 42 V 8.95 4.63 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 0.93 0.00 0.00 0.96 0.00 0.00 43 N 9.11 5.03 0.00 3.21 2.95 0.00 0.00 6.87 7.65 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 44 R 9.07 4.80 0.00 1.74 1.83 0.00 3.33 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 45 A 8.63 4.04 1.23 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 0.00 0.00 0.00 46 Q 8.69 4.02 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.44 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 47 G 8.85 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 48 T 7.46 4.36 3.92 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 1.02 0.00 0.00 49 G 8.03 3.70 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 0.00 0.00 0.00 50 C 8.58 4.47 0.00 2.68 2.96 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 0.00 0.00 0.00 51 Q 7.61 4.72 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.72 6.24 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 52 N 8.95 4.36 0.00 2.90 2.92 0.00 0.00 6.72 7.09 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 53 S 7.81 4.96 0.00 3.75 3.82 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 54 P 0.00 4.79 0.00 2.31 2.11 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.97 0.00 55 Y 9.05 4.68 0.00 3.01 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 56 P 0.00 4.88 0.00 1.93 1.97 0.00 3.70 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 57 L 8.64 4.96 0.00 1.67 1.45 0.49 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 58 T 8.89 4.85 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 1.22 0.00 0.00 59 G 8.84 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 60 R 9.05 5.20 0.00 1.71 1.82 0.00 3.27 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 61 V 8.66 4.59 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 0.02 0.00 0.00 0.98 0.00 0.00 62 N 9.78 4.69 0.00 2.84 2.85 0.00 0.00 7.50 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 63 G 8.54 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 0.00 0.00 0.00 0.00 64 T 8.70 4.36 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 65 F 8.27 5.76 0.00 3.35 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 66 I 9.11 5.16 1.10 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.66 1.00 0.00 0.00 67 A 8.99 5.33 1.24 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 68 F 8.92 5.48 0.00 3.00 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 69 S 9.55 5.30 0.00 3.74 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 70 V 9.01 4.57 1.58 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 -0.44 0.00 0.00 0.67 0.00 0.00 71 G 8.53 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 72 W 8.31 4.62 0.00 3.22 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 73 N 8.30 6.02 0.00 2.93 2.77 0.00 0.00 7.12 7.79 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 74 N 8.78 4.90 0.00 2.50 2.19 0.00 0.00 6.35 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.73 4.08 0.00 4.18 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 76 T 8.47 4.24 4.34 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 1.23 0.00 0.00 77 E 8.16 4.59 0.00 2.07 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 2.37 0.00 78 N 8.91 5.34 0.00 2.89 2.78 0.00 0.00 7.12 7.65 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 79 C 9.04 4.53 0.00 2.98 3.03 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 0.00 0.00 0.00 80 N 8.43 4.15 0.00 2.97 2.83 0.00 0.00 6.67 7.05 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 81 S 7.28 5.10 0.00 4.14 4.08 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 0.00 0.00 0.00 82 A 8.93 5.23 1.23 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 0.00 0.00 0.00 83 T 8.24 5.57 4.13 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 -0.39 0.00 0.00 84 G 8.52 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 0.00 0.00 0.00 0.00 85 W 8.94 5.34 0.00 1.78 2.54 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 86 T 8.83 4.98 4.30 0.00 0.00 0.00 0.00 0.00 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 87 G 8.85 4.70 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 0.00 0.00 0.00 88 Y 7.31 5.53 0.00 2.91 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 89 A 8.53 4.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Q 8.49 4.54 0.00 2.17 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.71 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 91 V 8.43 4.72 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 0.86 0.00 0.00 1.00 0.00 0.00 92 N 8.63 5.11 0.00 2.93 2.67 0.00 0.00 6.49 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 93 G 8.55 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 94 N 8.82 5.01 0.00 2.80 2.88 0.00 0.00 5.62 8.04 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 95 N 7.96 5.27 0.00 2.80 2.96 0.00 0.00 6.72 8.38 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 96 T 8.31 4.86 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 1.15 0.00 0.00 97 E 9.58 5.31 0.00 1.86 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 2.30 2.31 0.00 98 I 8.99 4.69 1.81 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.35 0.92 0.00 0.00 99 V 8.42 4.58 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 0.91 0.00 0.00 0.85 0.00 0.00 100 T 9.63 5.41 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 1.47 0.00 0.00 101 S 9.17 5.08 0.00 3.80 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 0.00 102 W 8.45 6.08 0.00 2.60 2.29 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 0.00 103 N 8.66 5.43 0.00 2.60 2.72 0.00 0.00 6.39 6.74 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 0.00 104 L 9.42 4.90 0.00 1.76 1.81 0.96 0.80 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 0.00 105 A 8.86 5.19 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.80 5.03 0.00 2.99 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 0.00 107 E 8.36 4.52 0.00 2.03 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 2.29 2.29 0.00 108 G 8.36 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 0.00 109 G 8.58 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 0.00 110 S 7.73 4.48 0.00 3.83 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 0.00 111 G 8.01 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 0.00 0.00 0.00 112 P 0.00 4.51 0.00 2.09 2.01 0.00 3.41 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 1.93 2.03 0.00 113 A 7.88 4.61 0.82 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 0.00 0.00 114 I 7.95 5.01 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.68 0.93 0.00 0.00 115 E 9.68 4.66 0.00 2.21 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 2.27 2.34 0.00 116 Q 7.39 4.75 0.00 1.66 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.65 0.00 0.00 0.00 0.00 0.00 2.35 2.07 0.00 117 G 5.95 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 0.00 0.00 0.00 118 Q 8.40 5.07 0.00 1.92 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 119 D 9.15 5.36 0.00 3.31 2.27 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 0.00 120 T 8.92 5.11 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 1.28 0.00 0.00 121 F 9.81 5.36 0.00 3.02 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 0.00 122 Q 9.37 5.19 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.01 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 123 Y 8.44 3.54 0.00 1.68 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 0.00 124 V 7.22 3.99 1.72 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 0.65 0.00 0.00 0.76 0.00 0.00 125 P 0.00 4.21 0.00 2.15 2.03 0.00 3.54 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.90 0.00 126 T 8.10 4.02 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 1.18 0.00 0.00 127 T 8.13 4.49 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 1.18 0.00 0.00 128 E 8.48 4.26 0.00 1.89 1.79 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 2.17 2.18 0.00