NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 4.0209 8.3549 109.7310 44.9038 0.0000 173.7762 3 K 4.5789 7.7002 118.6484 55.5292 34.5317 173.5955 4 R 4.7666 8.8277 121.2668 55.4493 31.9823 175.3477 5 V 4.8975 8.8925 124.4480 60.9541 34.6587 173.8277 6 L 4.9810 8.9170 130.1187 53.7585 43.8707 174.8712 7 I 4.7995 8.4936 127.8776 59.1729 39.2593 174.8961 8 V 4.8841 8.3299 127.8318 61.6355 33.5126 173.8552 9 D 4.7065 8.8025 125.3787 53.4699 44.6250 175.9207 10 D 4.4417 9.4299 124.9154 56.4949 41.7616 176.9339 11 A 4.3394 8.6270 122.1369 51.2291 19.6681 177.9824 12 A 4.0038 8.7278 127.0945 55.3063 18.6004 179.3942 13 F 4.2803 8.2603 118.7313 61.7174 39.6901 177.1785 14 M 3.9831 8.0795 117.9485 58.4292 31.7693 178.8110 15 R 3.9595 8.0638 118.3117 59.2336 30.1901 178.7711 16 M 3.9766 7.9434 118.2063 58.8449 32.3809 178.0052 17 M 3.9312 7.8205 118.3543 58.3969 32.2660 177.9977 18 L 3.6172 7.6885 120.2403 57.7728 42.1845 179.0251 19 K 3.9034 8.3025 118.9704 59.2831 31.9681 178.7834 20 D 4.2761 8.0375 118.2568 57.4164 41.1973 178.3666 21 I 3.6580 7.4826 119.8343 64.4157 37.0925 178.3755 22 I 3.6387 7.9175 120.9047 64.7300 37.0239 178.6488 23 T 4.0251 8.0173 116.3217 66.7891 68.1412 177.0739 24 K 4.0665 7.9761 118.4859 58.8257 32.0841 178.2796 25 A 4.4957 7.8751 118.9189 51.8483 18.8249 178.0438 26 G 3.7762 7.9851 106.0541 45.6057 0.0000 173.1952 27 Y 4.4588 8.0651 118.0071 56.4440 40.8023 173.8734 28 E 4.7919 9.0937 120.2192 54.4644 33.7316 174.8210 29 V 4.2882 8.3941 124.6247 62.3031 31.2644 175.5114 30 A 4.0965 9.2484 132.2889 53.6013 19.1731 177.1358 31 G 4.0647 7.2790 99.9111 46.8123 0.0000 171.3386 32 E 5.4501 8.5114 115.9169 54.9679 32.9117 174.4724 33 A 5.1849 9.2678 121.9856 50.8249 22.3354 176.9800 34 T 4.5463 9.7389 109.2386 61.3809 70.2085 174.0117 35 N 5.0651 7.6514 119.3632 50.4565 41.9170 175.2122 36 G 3.6197 8.5762 106.8571 47.6506 0.0000 175.9543 37 R 3.8826 7.9939 120.5351 59.4387 30.1988 178.1717 38 E 3.9676 9.2136 119.1837 58.8773 29.4717 178.5637 39 A 4.0123 7.9555 121.1503 55.2603 18.4497 179.7646 40 V 3.5780 7.7286 116.4626 66.1325 31.5824 178.1492 41 E 4.0064 8.0605 118.3965 59.4719 29.3718 179.5347 42 K 4.0670 8.4977 118.8579 59.3141 32.0163 178.8856 43 Y 3.8177 8.2571 120.3173 60.5154 38.5134 178.2450 44 K 4.0451 7.8041 117.9456 59.5454 32.2785 178.6970 45 E 4.0896 7.9636 118.2468 58.8692 29.6936 178.0988 46 L 4.1310 8.3250 118.0022 54.2458 43.1935 176.8092 47 K 3.4738 7.5743 117.5433 56.6185 29.8408 172.9154 48 P 4.4440 0.0000 0.0000 62.6163 32.8519 176.6501 49 D 4.6509 8.7670 119.3041 56.5938 42.1119 176.7316 50 I 5.1019 7.6602 117.1105 59.4536 42.1123 174.6204 51 V 5.0174 8.8918 124.6634 61.3287 35.0051 174.0801 52 T 4.9802 8.7969 118.0034 60.1891 71.1817 172.8447 53 M 4.8233 9.0063 126.6501 53.3517 34.7357 173.9895 54 D 5.0541 8.7230 127.5248 54.0293 40.9192 175.7442 55 I 4.7462 8.7517 118.0741 60.8171 38.8730 177.5589 56 T 4.0687 8.5539 114.6521 64.3370 68.9592 173.6961 57 M 4.5057 7.3729 119.8570 52.4396 32.6552 174.3109 58 P 4.2585 0.0000 0.0000 65.5757 31.4663 178.7169 59 E 4.0295 8.1146 115.6133 59.0963 29.5474 177.8705 60 M 4.0887 8.0026 118.2300 55.9057 32.2302 175.4075 61 N 4.1644 8.2581 117.1546 54.4667 38.0988 176.1261 62 G 3.6517 8.0060 105.4523 47.6252 0.0000 174.7357 63 I 3.6803 7.7014 120.5159 64.1048 38.0221 177.3352 64 D 4.3102 8.0587 118.2997 57.2283 40.9589 178.0786 65 A 3.9926 7.9533 120.9039 54.8919 18.3064 179.5799 66 I 3.5900 7.5842 118.3864 64.5793 37.2361 178.7469 67 K 3.9391 7.8869 119.0072 59.5023 31.8379 179.3326 68 E 3.9405 8.3480 118.9139 59.4725 29.3010 179.4992 69 I 3.4765 7.9159 120.0664 64.4901 36.8538 178.4277 70 M 4.1318 8.3005 119.9396 58.1745 31.4656 179.0329 71 K 4.0619 7.6493 118.1019 59.4483 32.3075 179.1725 72 I 4.1425 7.4271 119.1191 62.9728 37.3954 175.9030 73 D 4.5100 8.3375 121.2669 51.9625 42.4380 173.7296 74 P 4.5187 0.0000 0.0000 64.3269 31.5024 176.8559 75 N 4.7791 8.2850 115.4065 52.7433 38.6944 174.9296 76 A 4.1501 7.7610 121.9059 52.4559 18.9695 178.2123 77 K 4.5325 8.6617 120.4056 54.9530 34.3494 174.8012 78 I 4.9161 8.2375 126.0839 59.3943 40.1408 174.7146 79 I 4.7854 8.9062 128.1236 59.5462 39.3127 175.1562 80 V 4.4292 8.9260 128.1954 62.6608 33.2164 174.4306 81 C 5.3676 9.2609 125.6605 58.4288 30.4054 173.0290 82 S 5.3488 9.1335 118.9864 56.4165 66.5544 172.1860 83 A 5.0693 8.1758 119.5608 49.8953 22.7420 175.7297 84 M 3.9667 8.5085 118.5329 57.0152 32.3772 177.7112 85 G 4.2307 8.8592 109.7832 46.3104 0.0000 174.1602 86 Q 4.5941 7.5021 118.7682 55.6311 30.1428 177.7089 87 Q 3.8112 8.1070 121.4419 59.3962 28.4887 177.6111 88 A 3.9305 7.8198 122.0277 55.2224 18.4412 179.3787 89 M 3.9827 7.8667 116.7461 58.3306 31.9967 179.0011 90 V 3.4290 7.7044 118.3285 66.0861 31.7014 178.0667 91 I 3.6080 7.7404 119.6429 64.4069 37.0273 178.0471 92 E 3.9113 8.2719 119.8608 59.1796 29.4760 178.7731 93 A 4.0173 8.2231 121.2097 55.1278 18.4380 179.6952 94 I 4.0288 7.9463 119.9640 64.0605 36.9658 178.8809 95 K 4.0445 7.9815 118.0430 59.0803 31.9442 178.6713 96 A 4.2294 7.5399 118.9183 52.7608 18.5332 176.8524 97 G 3.4506 7.7385 106.1009 45.0918 0.0000 174.7638 98 A 4.1299 8.0976 124.8253 52.5773 18.9153 178.2703 99 K 4.2057 8.6945 121.0454 58.7909 33.3817 175.9752 100 D 4.8161 7.7867 117.7397 53.7631 44.7920 173.6160 101 F 5.6744 8.1579 113.9360 55.4177 40.9112 173.6049 102 I 4.7541 9.1810 113.2845 59.1874 41.3097 174.0587 103 V 4.9314 8.3093 122.1885 61.0423 33.8515 175.3155 104 K 4.1631 9.0324 127.7966 55.1161 32.7564 175.4143 105 P 4.0840 0.0000 0.0000 62.0829 32.0362 176.3078 106 F 4.3155 8.1115 119.6411 58.4335 39.3381 175.2787 107 Q 4.5586 8.7297 125.0770 53.4107 30.1370 174.2215 108 P 4.1998 0.0000 0.0000 66.3421 31.0365 178.2834 109 S 4.1206 8.0907 113.5520 61.0296 62.8033 176.5975 110 R 3.8757 7.8523 121.1321 58.9389 29.9173 178.9232 111 V 3.4869 7.7552 118.1283 65.8618 31.4331 178.2460 112 V 3.4365 8.0568 118.4190 65.9921 31.3538 177.6790 113 E 3.8807 8.2194 118.8811 59.0017 29.4228 178.6069 114 A 4.0171 8.0365 120.9266 55.0462 18.2282 179.5546 115 L 3.6936 7.5978 116.2438 57.9557 41.7728 179.2029 116 N 4.8583 8.1310 117.6944 55.9621 38.3063 177.7466 117 K 4.0258 8.2471 118.9415 59.4010 32.2068 179.6391 118 V 3.7848 7.7192 111.6053 63.5037 31.4945 176.4535 119 S 4.4105 7.6612 119.3279 58.6159 62.8490 173.8262 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 2 G 8.35 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 3 K 7.70 4.58 0.00 1.59 1.34 0.00 0.67 0.00 0.00 1.48 0.00 0.00 2.69 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.24 1.23 7.81 4 R 8.83 4.77 0.00 1.88 1.83 0.00 3.05 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 5 V 8.89 4.90 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 0.95 0.00 0.00 0.94 0.00 0.00 6 L 8.92 4.98 0.00 1.74 1.57 1.09 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.49 4.80 1.86 0.00 0.00 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 1.03 1.54 0.89 0.00 0.00 8 V 8.33 4.88 2.21 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 0.97 0.00 0.00 0.97 0.00 0.00 9 D 8.80 4.71 0.00 2.79 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.43 4.44 0.00 2.70 2.71 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 11 A 8.63 4.34 1.36 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 0.00 0.00 12 A 8.73 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 13 F 8.26 4.28 0.00 3.14 3.13 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 14 M 8.08 3.98 0.00 2.27 2.30 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.67 0.00 15 R 8.06 3.96 0.00 2.03 2.06 0.00 3.18 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 16 M 7.94 3.98 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 17 M 7.82 3.93 0.00 2.25 1.78 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 18 L 7.69 3.62 0.00 1.78 1.44 -0.45 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.30 3.90 0.00 1.93 1.82 0.00 1.71 0.00 0.00 1.56 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.70 7.81 20 D 8.04 4.28 0.00 2.88 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 21 I 7.48 3.66 1.83 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 1.47 0.49 0.81 0.00 0.00 22 I 7.92 3.64 2.01 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 1.35 0.62 0.97 0.00 0.00 23 T 8.02 4.03 4.35 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 0.00 0.00 0.00 1.21 0.00 0.00 24 K 7.98 4.07 0.00 1.80 1.88 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.48 1.55 7.81 25 A 7.88 4.50 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.99 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 27 Y 8.07 4.46 0.00 3.10 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 28 E 9.09 4.79 0.00 1.98 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 0.00 2.19 2.22 0.00 29 V 8.39 4.29 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 0.83 0.00 0.00 0.92 0.00 0.00 30 A 9.25 4.10 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 31 G 7.28 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.51 5.45 0.00 1.93 1.97 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 2.17 2.31 0.00 33 A 9.27 5.18 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 34 T 9.74 4.55 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 35 N 7.65 5.07 0.00 2.96 2.93 0.00 0.00 6.15 6.93 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 36 G 8.58 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.99 3.88 0.00 1.90 2.17 0.00 3.19 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 38 E 9.21 3.97 0.00 2.03 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 0.00 2.33 2.34 0.00 39 A 7.96 4.01 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 40 V 7.73 3.58 2.21 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 1.04 0.00 0.00 0.91 0.00 0.00 41 E 8.06 4.01 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 2.59 0.00 42 K 8.50 4.07 0.00 1.98 1.88 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.60 1.61 7.81 43 Y 8.26 3.82 0.00 3.19 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 44 K 7.80 4.05 0.00 1.96 1.90 0.00 1.79 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.71 7.81 45 E 7.96 4.09 0.00 1.98 1.96 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 2.31 2.37 0.00 46 L 8.33 4.13 0.00 1.60 1.63 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 47 K 7.57 3.47 0.00 1.78 1.71 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.37 7.81 48 P 0.00 4.44 0.00 2.29 1.94 0.00 2.81 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.79 0.00 49 D 8.77 4.65 0.00 2.78 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 50 I 7.66 5.10 1.89 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.88 0.94 0.00 0.00 51 V 8.89 5.02 2.16 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 0.93 0.00 0.00 1.21 0.00 0.00 52 T 8.80 4.98 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 1.11 0.00 0.00 53 M 9.01 4.82 0.00 2.12 1.96 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 54 D 8.72 5.05 0.00 2.97 2.60 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 55 I 8.75 4.75 1.87 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 1.44 0.79 0.97 0.00 0.00 56 T 8.55 4.07 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 1.28 0.00 0.00 57 M 7.37 4.51 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.43 0.00 58 P 0.00 4.26 0.00 2.20 2.31 0.00 3.69 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 59 E 8.11 4.03 0.00 2.10 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 2.28 2.34 0.00 60 M 8.00 4.09 0.00 2.05 2.32 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 2.64 2.62 0.00 61 N 8.26 4.16 0.00 2.97 2.82 0.00 0.00 6.90 7.47 0.00 0.00 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 G 8.01 3.65 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 63 I 7.70 3.68 1.86 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 1.71 1.19 0.92 0.00 0.00 64 D 8.06 4.31 0.00 2.95 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 65 A 7.95 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 66 I 7.58 3.59 2.05 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 1.51 0.90 0.89 0.00 0.00 67 K 7.89 3.94 0.00 1.96 1.84 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.64 7.81 68 E 8.35 3.94 0.00 2.08 1.96 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 2.51 2.48 0.00 69 I 7.92 3.48 1.84 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 1.26 0.74 nan 0.00 0.00 70 M 8.30 4.13 0.00 1.96 2.19 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 2.79 2.86 0.00 71 K 7.65 4.06 0.00 1.91 1.85 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.65 7.81 72 I 7.43 4.14 1.90 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 1.41 0.58 1.02 0.00 0.00 73 D 8.34 4.51 0.00 2.82 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 4.52 0.00 2.22 2.16 0.00 3.41 0.00 0.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.95 0.00 75 N 8.28 4.78 0.00 2.87 2.89 0.00 0.00 6.92 6.87 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 76 A 7.76 4.15 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 77 K 8.66 4.53 0.00 1.92 1.78 0.00 1.67 0.00 0.00 2.04 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.62 7.81 78 I 8.24 4.92 1.88 0.00 0.00 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 1.35 0.73 0.93 0.00 0.00 79 I 8.91 4.79 1.85 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.80 0.91 0.00 0.00 80 V 8.93 4.43 2.18 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 1.08 0.00 0.00 0.96 0.00 0.00 81 C 9.26 5.37 0.00 2.98 3.06 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 0.00 0.00 0.00 82 S 9.13 5.35 0.00 3.82 3.96 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 83 A 8.18 5.07 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 84 M 8.51 3.97 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 85 G 8.86 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 0.00 0.00 0.00 0.00 86 Q 7.50 4.59 0.00 2.12 2.03 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 2.27 2.41 0.00 87 Q 8.11 3.81 0.00 2.15 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 88 A 7.82 3.93 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 89 M 7.87 3.98 0.00 2.03 2.18 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 2.66 2.57 0.00 90 V 7.70 3.43 1.81 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 0.26 0.00 0.00 0.69 0.00 0.00 91 I 7.74 3.61 1.94 0.00 0.00 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 1.35 0.68 0.88 0.00 0.00 92 E 8.27 3.91 0.00 2.14 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 0.00 2.29 2.31 0.00 93 A 8.22 4.02 1.36 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 0.00 0.00 94 I 7.95 4.03 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.95 0.00 0.00 95 K 7.98 4.04 0.00 1.89 1.87 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.63 7.81 96 A 7.54 4.23 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 97 G 7.74 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.10 4.13 1.32 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 99 K 8.69 4.21 0.00 1.66 1.89 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.54 7.81 100 D 7.79 4.82 0.00 2.75 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.16 5.67 0.00 3.12 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 0.00 102 I 9.18 4.75 1.99 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 1.35 0.90 0.86 0.00 0.00 103 V 8.31 4.93 2.16 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 0.93 0.00 0.00 1.17 0.00 0.00 104 K 9.03 4.16 0.00 1.46 1.43 0.00 1.60 0.00 0.00 1.47 0.00 0.00 2.60 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.33 1.06 7.81 105 P 0.00 4.08 0.00 2.15 2.00 0.00 3.75 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 106 F 8.11 4.32 0.00 3.06 2.91 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 0.00 107 Q 8.73 4.56 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 108 P 0.00 4.20 0.00 2.25 2.34 0.00 3.74 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 109 S 8.09 4.12 0.00 4.06 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 0.00 110 R 7.85 3.88 0.00 1.93 1.97 0.00 3.27 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 111 V 7.76 3.49 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 0.82 0.00 0.00 0.88 0.00 0.00 112 V 8.06 3.44 2.19 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 1.03 0.00 0.00 0.96 0.00 0.00 113 E 8.22 3.88 0.00 2.14 1.87 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 2.27 2.30 0.00 114 A 8.04 4.02 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.60 3.69 0.00 1.34 0.74 0.12 0.60 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 0.00 116 N 8.13 4.86 0.00 2.90 2.91 0.00 0.00 6.57 6.93 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 0.00 117 K 8.25 4.03 0.00 1.70 1.85 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.62 7.81 118 V 7.72 3.78 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 0.79 0.00 0.00 1.01 0.00 0.00 119 S 7.66 4.41 0.00 4.06 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