NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7960 8.3393 109.7267 45.6093 0.0000 172.4482 2 I 4.0038 7.6254 113.6138 59.1592 39.3443 172.8223 3 S 4.5225 8.5894 116.1211 56.4267 67.5525 174.9682 4 Y 4.2819 8.4177 120.1625 58.4132 37.5676 176.9303 5 S 4.3672 8.9357 119.6737 59.4043 63.6919 174.4025 6 V 4.4352 7.3561 120.1682 60.6425 34.1396 174.7457 7 E 4.1392 8.6088 125.0597 56.4116 30.0361 176.4336 8 A 4.4186 8.0166 123.9551 50.4815 22.1462 175.4303 9 D 4.5033 8.6790 123.3335 52.8144 41.0498 174.7985 10 P 4.3349 0.0000 0.0000 65.8926 31.1111 177.3346 11 D 4.6517 7.8340 116.5762 56.3843 41.0929 176.8628 12 T 4.8439 8.3039 108.5393 61.2243 70.2286 173.3173 13 T 4.9350 8.0165 114.2107 60.9409 71.1744 172.6047 14 A 4.7661 8.8470 126.5211 50.1728 22.2953 175.4580 15 K 5.1181 8.4865 120.6762 55.0102 35.4062 175.3449 16 A 4.7320 8.6524 121.0891 51.8575 22.9201 175.3872 17 M 5.3133 8.5811 118.2105 53.8772 36.6695 174.3448 18 L 4.8079 8.6103 120.4075 53.0103 45.1749 175.7855 19 R 4.8217 8.4317 121.2287 55.1054 33.1667 175.4258 20 E 3.7372 9.1479 121.9783 57.0325 28.1366 175.7376 21 R 3.9564 8.2699 118.4633 56.6205 31.1795 177.1124 22 Q 5.2115 9.0037 124.4438 54.4240 27.5384 174.6629 23 M 4.8516 7.8691 119.5124 53.3967 35.1519 174.6933 24 S 4.1666 8.5872 114.1731 58.1418 63.2585 174.6228 25 F 4.4234 8.9269 129.7276 61.3574 39.4067 177.2924 26 K 3.4336 7.8462 117.6827 59.6122 31.7642 178.8006 27 H 4.1491 8.0089 116.4315 58.6080 28.6583 178.0182 28 S 4.2545 7.7635 117.1839 61.3473 62.6598 176.8306 29 K 3.8112 7.6812 121.0916 59.2727 31.6028 179.2435 30 A 3.8456 7.2571 119.7096 55.0462 18.1844 179.8734 31 I 3.5195 7.5286 118.0553 64.2114 37.2637 178.2562 32 A 3.9768 7.5983 121.5715 55.3252 18.0136 179.3561 33 R 3.7528 7.6077 115.4791 59.8867 30.1367 177.9829 34 E 3.9632 7.6917 117.7789 58.5698 29.9089 177.8921 35 I 3.9462 7.8212 111.7906 60.4721 38.1627 175.6256 36 K 4.1148 7.2170 123.0774 57.7451 32.4616 175.8350 37 G 4.0555 8.5553 114.0601 45.5633 0.0000 174.2152 38 K 4.2735 7.5308 118.1385 56.1219 32.8745 176.3468 39 T 4.5581 8.7506 114.8852 61.4851 69.4802 175.3437 40 A 4.1052 8.8048 128.5324 55.6123 18.3856 180.7093 41 G 3.6102 8.2433 103.9846 47.8295 0.0000 175.9417 42 E 4.0437 8.1046 120.2466 59.2055 29.4617 179.1040 43 A 4.1395 8.3799 121.1658 54.9589 18.4031 179.9636 44 V 3.5808 7.7512 116.6281 66.4229 31.2255 178.1105 45 D 4.4237 8.3001 118.6621 57.2957 40.4703 178.2880 46 Y 4.0854 8.2525 120.1285 60.8759 39.0554 178.0445 47 L 3.8238 8.2958 120.0140 57.5958 41.6781 179.3627 48 E 4.0228 8.2764 118.5301 58.9548 29.3109 178.8969 49 A 4.0726 7.5388 120.1547 54.4536 18.5876 179.8984 50 V 4.1020 7.1155 118.3927 65.7417 31.3845 178.3592 51 I 3.7455 7.3988 118.2813 64.1609 36.9963 177.5805 52 E 4.1228 7.8804 118.4195 56.9633 29.5161 177.4489 53 G 3.3228 7.6062 105.9031 45.7702 0.0000 173.8261 54 D 4.5735 8.1691 120.3240 54.5012 41.9449 176.5647 55 Q 4.5346 7.8640 120.1748 53.3841 31.4297 171.8918 56 P 4.5037 0.0000 0.0000 62.0840 33.1824 175.4784 57 V 4.5571 8.2049 122.6060 60.3791 32.8945 173.4326 58 P 4.8873 0.0000 0.0000 63.0425 31.9655 176.5124 59 F 4.8016 9.2794 124.5847 56.2045 38.3651 175.4330 60 K 3.2543 8.3274 123.1978 57.5913 32.7716 178.0611 61 Q 4.1522 7.8546 117.7183 57.9146 30.1112 176.0744 62 H 4.7064 7.5814 115.8045 54.2812 27.3977 174.3018 63 N 5.1416 7.8584 115.1389 51.9845 38.3887 175.0477 64 S 4.3450 8.1223 114.1898 60.7005 62.8678 174.5588 65 G 3.9507 8.9642 114.6112 44.8908 0.0000 173.1049 66 V 3.7129 7.6431 120.4865 62.4295 31.7518 175.9091 67 G 3.8254 8.4649 114.3639 46.2909 0.0000 172.5474 68 H 4.9312 8.6783 119.7828 55.5946 29.7613 174.9170 69 K 4.6767 8.7899 121.2430 54.4424 34.6704 177.7775 70 S 4.0901 8.9348 119.3514 61.3336 63.1328 175.4149 71 K 4.1386 7.9231 117.4317 56.9397 32.1591 176.7506 72 V 3.8576 7.3663 120.6434 62.0667 31.3446 174.5312 73 D 4.6040 8.7456 127.5026 54.1461 42.0599 176.9565 74 G 4.0139 9.8765 113.7667 45.5663 0.0000 172.0018 75 W 5.0772 7.5762 127.8088 56.5466 34.3606 173.0534 76 D 4.3742 6.6288 116.5484 54.5008 40.4802 175.9790 77 A 4.4348 7.0930 122.9705 51.1074 19.6643 176.0481 78 G 4.0916 7.8312 106.8623 45.7712 0.0000 172.4412 79 R 4.0291 7.4420 118.5723 54.3652 34.9844 174.2766 80 Y 4.4722 7.7340 113.8344 56.1747 37.8892 175.3067 81 P 4.5444 0.0000 0.0000 62.3625 30.5594 177.6819 82 E 4.0036 8.6371 125.8162 59.5876 29.6103 178.8084 83 K 3.9158 8.0765 119.8781 59.4241 32.5079 178.6215 84 A 4.1871 8.0700 120.3437 55.0893 18.3742 179.6461 85 S 4.2014 8.0569 113.7731 61.6865 62.4358 176.9374 86 K 4.1068 8.4937 121.0792 59.1165 31.6722 179.2228 87 A 4.1624 7.8552 121.4447 54.9514 18.4565 179.6184 88 F 4.0129 8.4359 116.1373 60.2991 38.9699 177.9442 89 L 4.1672 8.2466 118.9487 57.6336 41.3773 179.0755 90 D 4.4190 7.7874 118.0760 57.0237 40.6911 178.4841 91 L 3.9587 7.6867 120.7345 57.9620 42.1025 178.7226 92 L 4.1700 8.2026 118.3369 56.7793 41.7672 178.8059 93 E 4.0286 8.0794 120.0361 58.8509 29.5242 178.1447 94 N 4.2810 8.2178 116.9590 56.5273 39.1301 176.6562 95 A 3.9973 8.0974 122.2200 55.4592 18.5452 179.9060 96 V 3.7417 7.7748 116.3056 65.8143 31.5025 178.5749 97 G 3.5897 7.9496 105.3301 47.9223 0.0000 175.5822 98 N 4.4509 8.6272 119.4721 55.7823 38.4762 177.4881 99 A 4.3176 8.1959 122.3324 55.4772 18.5872 179.5104 100 D 4.6410 8.2384 118.7964 57.1298 40.6508 178.4496 101 H 4.2974 8.0337 117.6359 58.6779 29.9590 176.4699 102 Q 4.1690 7.5648 117.4267 56.0153 28.9644 176.5925 103 G 3.7663 7.7361 108.5022 44.9564 0.0000 173.6700 104 F 4.6693 8.0259 119.2334 56.7159 40.1916 174.7166 105 D 4.9591 8.4654 121.8205 52.2630 39.9846 176.3808 106 G 3.8747 9.2192 115.0210 48.4539 0.0000 173.5636 107 E 3.9055 8.3539 119.3896 59.0463 29.5642 178.5689 108 A 4.2623 7.4275 118.3140 53.4341 18.8135 177.1840 109 M 4.4183 7.6879 117.7088 55.0920 33.4060 176.2379 110 T 4.3880 8.5241 120.4436 63.6014 70.4824 174.4248 111 I 4.3263 8.4939 126.9823 60.5827 36.5745 176.5093 112 K 4.0447 8.7077 129.5324 59.1973 32.9372 176.7229 113 H 5.1206 8.0488 118.7866 54.6777 33.6066 172.7643 114 V 5.4293 8.3484 123.9801 61.1525 33.9759 173.2397 115 A 4.7605 8.6138 125.8747 50.3082 22.7303 174.1764 116 A 5.2362 8.6029 122.5033 50.7621 21.5035 176.1319 117 H 4.8471 9.4537 117.8455 53.7885 33.1000 172.8057 118 K 3.9501 7.8116 124.7079 55.7367 31.5535 176.4620 119 V 3.7572 8.5920 128.4026 63.0254 32.4182 176.1936 120 G 3.9116 6.6421 106.2130 45.9332 0.0000 170.2735 121 E 5.0120 7.9752 117.5045 54.5396 33.6316 175.9149 122 Q 4.3599 9.1938 125.4131 54.6159 29.8655 174.7736 123 Q 4.6841 8.7195 126.2872 56.4448 29.4826 176.3697 124 G 4.8075 9.5810 109.3914 44.0135 0.0000 171.1734 125 R 5.2033 8.5495 119.6389 54.2028 33.4572 173.9809 126 K 4.3582 8.9956 127.3127 53.6992 34.8324 173.2822 127 P 4.6199 0.0000 0.0000 62.8122 31.9314 175.9997 128 R 4.6878 8.5935 123.4432 53.8263 33.4869 175.3651 129 A 4.1138 8.3409 122.4226 53.3244 18.9645 177.5616 130 M 3.1009 9.2561 115.7571 56.2565 29.2939 177.9240 131 G 3.8534 8.3504 104.6300 46.0213 0.0000 173.5366 132 R 4.8116 7.4917 117.6031 54.0819 33.2550 174.4795 133 A 5.2579 8.4753 124.2124 50.1472 22.1310 175.3096 134 S 4.9209 8.6459 115.2869 55.8079 66.8345 173.2577 135 A 4.5796 8.5428 121.7894 52.0135 19.1066 178.0843 136 W 5.1397 8.9359 129.8629 56.2400 31.0806 173.4634 137 N 5.3534 8.0594 119.7967 51.8610 41.0076 174.8308 138 S 4.7459 8.4305 116.4247 56.1172 66.0238 172.2807 139 P 4.6043 0.0000 0.0000 62.5672 32.9243 175.1752 140 Q 4.9240 9.2349 123.1292 54.3298 30.9420 174.7071 141 V 4.8691 8.9207 124.7281 61.0826 34.6939 173.9339 142 D 5.7514 9.1876 126.4006 51.5795 44.3291 175.4476 143 V 4.9883 8.0738 121.2545 59.9871 34.9185 173.8713 144 E 5.0996 8.8921 122.7373 54.7872 32.4939 174.6988 145 L 5.2292 9.0032 123.0352 53.7614 46.1999 174.6793 146 I 4.7839 9.1663 127.1030 59.6317 40.1322 174.4144 147 L 4.9551 9.2595 128.2320 53.4126 43.6869 175.5605 148 E 4.9698 9.1064 123.2743 53.9198 33.5521 174.6066 149 E 4.3838 8.1943 124.6043 55.3338 30.2153 175.5162 150 P 4.3673 0.0000 0.0000 63.1083 31.3433 176.0899 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 G 8.34 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 0.00 0.00 0.00 2 I 7.63 4.00 1.67 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 1.38 0.59 0.74 0.00 0.00 3 S 8.59 4.52 0.00 3.78 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 4 Y 8.42 4.28 0.00 2.98 2.95 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 0.00 0.00 0.00 5 S 8.94 4.37 0.00 4.03 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 6 V 7.36 4.44 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 0.80 0.00 0.00 0.65 0.00 0.00 7 E 8.61 4.14 0.00 1.98 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 2.31 2.30 0.00 8 A 8.02 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 D 8.68 4.50 0.00 2.68 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.33 0.00 2.23 2.19 0.00 3.81 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 11 D 7.83 4.65 0.00 2.96 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 12 T 8.30 4.84 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 1.33 0.00 0.00 13 T 8.02 4.94 4.36 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 1.15 0.00 0.00 14 A 8.85 4.77 1.14 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 15 K 8.49 5.12 0.00 1.49 1.53 0.00 1.46 0.00 0.00 0.77 0.00 0.00 2.13 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.60 1.10 7.81 16 A 8.65 4.73 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 17 M 8.58 5.31 0.00 1.75 1.88 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 2.12 2.46 0.00 18 L 8.61 4.81 0.00 1.43 1.42 0.74 0.63 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 19 R 8.43 4.82 0.00 1.61 1.75 0.00 3.45 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 20 E 9.15 3.74 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 2.23 2.22 0.00 21 R 8.27 3.96 0.00 1.81 1.87 0.00 3.28 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 22 Q 9.00 5.21 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.19 0.00 23 M 7.87 4.85 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.74 0.00 24 S 8.59 4.17 0.00 3.71 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 25 F 8.93 4.42 0.00 3.05 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 26 K 7.85 3.43 0.00 1.56 1.45 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.95 1.34 7.81 27 H 8.01 4.15 0.00 3.33 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 7.76 4.25 0.00 4.10 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 0.00 29 K 7.68 3.81 0.00 1.51 1.61 0.00 1.39 0.00 0.00 1.37 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.82 0.68 7.81 30 A 7.26 3.85 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 31 I 7.53 3.52 1.04 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.54 -0.04 0.00 0.00 32 A 7.60 3.98 1.49 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 33 R 7.61 3.75 0.00 1.79 2.11 0.00 3.10 0.00 0.00 2.97 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 34 E 7.69 3.96 0.00 1.96 2.02 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 2.28 1.82 0.00 35 I 7.82 3.95 1.89 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.60 1.00 0.00 0.00 36 K 7.22 4.11 0.00 1.88 1.72 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.44 1.39 7.81 37 G 8.56 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 38 K 7.53 4.27 0.00 1.98 1.72 0.00 1.46 0.00 0.00 1.50 0.00 0.00 2.45 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.36 1.24 7.81 39 T 8.75 4.56 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 1.36 0.00 0.00 40 A 8.80 4.11 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 41 G 8.24 3.61 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 0.00 42 E 8.10 4.04 0.00 2.31 2.02 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 2.42 2.39 0.00 43 A 8.38 4.14 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 44 V 7.75 3.58 2.26 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 1.06 0.00 0.00 1.03 0.00 0.00 45 D 8.30 4.42 0.00 2.94 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 46 Y 8.25 4.09 0.00 3.18 3.22 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 47 L 8.30 3.82 0.00 1.76 1.71 1.08 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.28 4.02 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 2.34 2.49 0.00 49 A 7.54 4.07 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 50 V 7.12 4.10 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 1.38 0.00 0.00 0.36 0.00 0.00 51 I 7.40 3.75 2.00 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 1.41 0.76 0.90 0.00 0.00 52 E 7.88 4.12 0.00 2.12 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 2.28 2.31 0.00 53 G 7.61 3.32 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 54 D 8.17 4.57 0.00 2.64 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 55 Q 7.86 4.53 0.00 2.04 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 7.03 0.00 0.00 0.00 0.00 0.00 2.53 2.56 0.00 56 P 0.00 4.50 0.00 1.83 1.55 0.00 3.88 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 1.95 1.93 0.00 57 V 8.20 4.56 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 1.47 0.00 0.00 0.98 0.00 0.00 58 P 0.00 4.89 0.00 1.98 2.10 0.00 3.76 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 59 F 9.28 4.80 0.00 2.83 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 60 K 8.33 3.25 0.00 1.24 0.80 0.00 1.40 0.00 0.00 1.21 0.00 0.00 2.13 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.30 0.94 7.81 61 Q 7.85 4.15 0.00 1.77 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.36 0.00 0.00 0.00 0.00 0.00 1.93 2.18 0.00 62 H 7.58 4.71 0.00 2.95 3.15 0.00 5.69 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 7.86 5.14 0.00 3.06 3.51 0.00 0.00 5.86 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 64 S 8.12 4.35 0.00 4.04 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 65 G 8.96 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.64 3.71 2.26 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 0.66 0.00 0.00 1.09 0.00 0.00 67 G 8.46 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 0.00 0.00 0.00 68 H 8.68 4.93 0.00 2.96 3.14 0.00 5.66 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 8.79 4.68 0.00 1.55 1.62 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.68 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.35 1.29 7.81 70 S 8.93 4.09 0.00 3.98 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 71 K 7.92 4.14 0.00 1.81 1.94 0.00 1.89 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.46 7.81 72 V 7.37 3.86 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 0.88 0.00 0.00 0.93 0.00 0.00 73 D 8.75 4.60 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 74 G 9.88 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 75 W 7.58 5.08 0.00 3.27 2.93 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 76 D 6.63 4.37 0.00 2.03 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 77 A 7.09 4.43 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 78 G 7.83 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 0.00 0.00 0.00 79 R 7.44 4.03 0.00 0.67 1.32 0.00 2.87 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.20 0.00 80 Y 7.73 4.47 0.00 2.85 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 81 P 0.00 4.54 0.00 2.26 2.12 0.00 3.74 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 82 E 8.64 4.00 0.00 2.24 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 2.39 2.40 0.00 83 K 8.08 3.92 0.00 1.90 1.92 0.00 1.76 0.00 0.00 1.87 0.00 0.00 3.12 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.55 7.81 84 A 8.07 4.19 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 85 S 8.06 4.20 0.00 4.07 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 86 K 8.49 4.11 0.00 2.03 1.90 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.68 7.81 87 A 7.86 4.16 1.45 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 88 F 8.44 4.01 0.00 3.33 3.21 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 89 L 8.25 4.17 0.00 1.96 1.76 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 90 D 7.79 4.42 0.00 3.04 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 91 L 7.69 3.96 0.00 1.58 1.72 0.84 0.66 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 92 L 8.20 4.17 0.00 1.81 1.75 1.08 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 93 E 8.08 4.03 0.00 2.21 2.14 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 2.32 2.33 0.00 94 N 8.22 4.28 0.00 3.01 2.95 0.00 0.00 7.07 8.57 0.00 0.00 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 A 8.10 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 96 V 7.77 3.74 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 1.05 0.00 0.00 1.03 0.00 0.00 97 G 7.95 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.63 4.45 0.00 2.97 2.94 0.00 0.00 6.96 7.30 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 99 A 8.20 4.32 1.54 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 0.00 100 D 8.24 4.64 0.00 2.77 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 0.00 101 H 8.03 4.30 0.00 3.21 3.53 0.00 5.94 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.56 4.17 0.00 2.28 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.23 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 103 G 7.74 3.77 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 0.00 0.00 0.00 104 F 8.03 4.67 0.00 3.32 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 0.00 105 D 8.47 4.96 0.00 2.80 2.62 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 0.00 106 G 9.22 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 0.00 107 E 8.35 3.91 0.00 2.07 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 2.34 0.00 108 A 7.43 4.26 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 0.00 109 M 7.69 4.42 0.00 1.86 2.14 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.38 0.00 110 T 8.52 4.39 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 1.24 0.00 0.00 111 I 8.49 4.33 1.95 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 1.14 1.07 0.94 0.00 0.00 112 K 8.71 4.04 0.00 1.78 1.96 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.37 7.81 113 H 8.05 5.12 0.00 3.19 3.12 0.00 5.73 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.35 5.43 2.15 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 0.64 0.00 0.00 1.19 0.00 0.00 115 A 8.61 4.76 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 0.00 116 A 8.60 5.24 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 0.00 117 H 9.45 4.85 0.00 3.00 3.10 0.00 5.81 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.81 3.95 0.00 0.79 1.12 0.00 1.53 0.00 0.00 1.43 0.00 0.00 2.61 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.11 1.01 7.81 119 V 8.59 3.76 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 0.71 0.00 0.00 0.88 0.00 0.00 120 G 6.64 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 0.00 121 E 7.98 5.01 0.00 1.78 1.78 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 2.15 2.22 0.00 122 Q 9.19 4.36 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.98 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 123 Q 8.72 4.68 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 124 G 9.58 4.81 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 0.00 125 R 8.55 5.20 0.00 1.78 1.76 0.00 3.28 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 126 K 9.00 4.36 0.00 1.15 1.49 0.00 1.12 0.00 0.00 1.15 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.44 1.08 7.81 127 P 0.00 4.62 0.00 1.89 1.92 0.00 3.51 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.05 0.00 128 R 8.59 4.69 0.00 1.77 1.85 0.00 3.32 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 129 A 8.34 4.11 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 0.00 130 M 9.26 3.10 0.00 2.19 2.19 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 2.50 2.46 0.00 131 G 8.35 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 0.00 132 R 7.49 4.81 0.00 1.93 1.92 0.00 3.05 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 133 A 8.48 5.26 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 0.00 134 S 8.65 4.92 0.00 3.97 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 0.00 135 A 8.54 4.58 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 0.00 136 W 8.94 5.14 0.00 3.37 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 0.00 137 N 8.06 5.35 0.00 2.71 2.71 0.00 0.00 7.05 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 S 8.43 4.75 0.00 3.75 3.72 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 0.00 139 P 0.00 4.60 0.00 2.27 1.94 0.00 3.53 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 140 Q 9.23 4.92 0.00 1.90 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 141 V 8.92 4.87 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 1.10 0.00 0.00 1.07 0.00 0.00 142 D 9.19 5.75 0.00 2.62 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 0.00 143 V 8.07 4.99 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 0.44 0.00 0.00 0.72 0.00 0.00 144 E 8.89 5.10 0.00 2.13 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 2.37 2.29 0.00 145 L 9.00 5.23 0.00 1.77 1.54 1.05 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 146 I 9.17 4.78 1.92 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 1.16 1.03 0.84 0.00 0.00 147 L 9.26 4.96 0.00 1.58 1.46 0.91 0.75 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 0.00 148 E 9.11 4.97 0.00 1.87 1.66 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 2.11 2.17 0.00 149 E 8.19 4.38 0.00 1.80 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 2.23 1.93 0.00 150 P 0.00 4.37 0.00 2.17 2.02 0.00 3.77 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 1.99 2.06 0.00