NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2713 8.2649 123.5838 51.8767 20.0830 176.8011 2 D 4.6011 8.0947 120.1309 53.7813 42.3763 172.2618 3 E 4.5578 8.9607 119.7909 55.9280 31.8189 174.2076 4 S 5.2633 8.4030 112.5714 56.0825 64.6838 174.8156 5 L 3.9983 8.6872 126.6669 57.9071 42.1424 178.9631 6 K 3.9604 8.1080 118.7628 58.8331 32.3243 176.8105 7 D 4.7331 7.9064 115.9247 53.8783 41.2324 176.5423 8 A 4.5734 7.4621 123.8872 52.8641 21.0864 178.9194 9 I 3.4367 7.1500 107.8269 62.7566 37.9193 177.1449 10 K 4.3236 6.9779 122.0255 55.2214 30.2799 175.8031 11 D 4.9528 7.4157 119.9545 51.6541 45.3002 175.5873 12 P 4.5879 0.0000 0.0000 65.5042 31.8597 177.6408 13 A 4.1875 8.0386 120.8469 53.9906 18.7792 177.6494 14 L 4.7659 7.4908 115.5541 54.7636 41.8606 178.0383 15 E 4.8010 8.0943 121.6166 57.8057 30.7104 176.4411 16 N 5.0041 7.6635 113.7344 51.8949 40.3679 173.9063 17 K 4.3828 7.6304 118.2591 55.0444 33.9595 176.8202 18 E 4.1563 8.3543 126.0779 56.2292 27.9942 176.6283 19 H 4.4477 7.9412 125.1510 53.3796 27.8293 177.9074 20 D 4.8724 6.9214 116.8421 54.4062 42.9345 173.6312 21 I 4.5168 7.6597 120.9675 60.3524 41.2146 177.1278 22 G 3.8003 8.7116 111.0869 43.6571 0.0000 170.5373 23 P 4.7084 0.0000 0.0000 62.4872 32.6439 175.7511 24 R 4.4970 7.5177 113.4356 56.3799 31.1272 173.5351 25 E 4.6524 7.3863 118.6213 55.2466 34.5017 173.2451 26 Q 4.5572 8.5749 118.1719 54.6304 32.0275 175.4890 27 V 4.3192 9.4833 124.9402 61.0030 34.7830 175.0632 28 N 4.9066 8.6911 127.2330 53.3010 41.0965 172.8247 29 F 5.4898 6.9881 113.0437 55.6832 41.1746 173.9386 30 Q 4.5367 9.2800 121.7832 54.7474 30.3721 174.7411 31 L 4.6039 8.5380 125.2824 54.0031 43.0870 176.0814 32 L 5.2759 8.7511 123.3273 51.5212 45.9605 175.7755 33 D 5.0200 8.3867 121.1984 52.4328 38.4118 175.6398 34 K 4.1222 8.4892 118.7182 57.8454 31.0405 175.2721 35 N 4.8830 8.2668 109.3457 52.9309 40.7720 174.5498 36 N 4.0511 8.4048 112.8112 53.9796 36.0511 173.6727 37 E 4.2426 7.8768 118.6715 55.2372 29.4558 175.5674 38 T 4.9429 8.2496 123.9899 61.8408 68.6613 175.4784 39 Q 4.3100 8.3602 127.5050 55.2989 27.6088 175.4716 40 Y 4.1566 8.6254 122.1757 57.7894 38.8728 175.0283 41 Y 4.6666 7.7492 113.7137 58.4223 38.7497 175.3864 42 H 4.6310 7.5969 115.1889 55.6091 30.1474 175.4754 43 F 4.4137 7.7152 117.4623 57.1359 36.5770 174.7914 44 F 4.9093 7.9359 120.2928 58.1079 40.5281 176.4793 45 S 4.7631 7.2886 114.9672 59.2504 64.0721 174.6891 46 I 4.7327 7.5133 123.2904 61.2914 37.9325 174.8717 47 K 4.4608 8.2833 120.3399 57.7135 34.0445 176.8842 48 D 4.8340 7.8676 117.4503 52.0526 42.6004 174.1715 49 P 4.6803 0.0000 0.0000 62.4899 32.0332 176.2722 50 A 4.4680 9.2866 123.8121 53.3846 19.6389 176.9536 51 D 5.1878 9.3089 121.0142 52.5084 44.1277 176.1217 52 V 3.9948 7.3399 118.0903 61.6044 33.6817 173.1054 53 Y 4.3290 9.3669 128.4106 56.4205 37.1922 172.9520 54 Y 4.4528 7.8069 119.6576 58.1834 38.6149 175.7866 55 T 4.7162 7.8164 116.8276 60.1249 71.3391 173.8378 56 K 4.1172 8.5604 120.5111 58.8307 32.0838 178.2501 57 K 4.2230 7.4929 117.8551 57.1368 32.6324 176.3616 58 K 4.6610 8.0845 116.1494 54.1716 36.2768 175.6990 59 A 4.4778 8.3963 123.2497 52.1333 20.0332 176.5185 60 E 4.3298 8.4096 120.1428 54.1522 32.1194 175.4345 61 V 3.9829 7.7853 127.0503 62.6293 33.2687 174.1408 62 E 5.1973 8.9590 124.0661 54.7888 33.4026 173.9210 63 L 5.0947 8.7992 124.5135 53.2511 46.2600 174.9474 64 D 4.7364 8.9869 123.7367 53.7752 43.1506 174.9414 65 I 4.2995 8.2380 126.8717 59.6057 38.5561 175.7627 66 N 4.1914 9.4965 127.4030 55.3328 39.1091 176.5227 67 T 5.1097 7.8463 108.3171 59.9826 68.6980 175.7433 68 A 4.0099 7.9026 125.8640 56.1642 18.9889 179.7495 69 S 4.3774 8.2353 108.6478 60.1928 62.8604 174.3714 70 T 4.3929 8.4807 109.6610 62.2679 69.6800 174.8079 71 W 4.3758 8.0241 123.0733 56.5159 30.2005 174.9241 72 K 4.4888 8.4836 122.8643 57.4963 34.2809 175.1179 73 K 5.2239 7.5629 117.0819 55.0809 36.1535 174.3698 74 F 5.0955 8.3732 117.5648 58.1270 41.6659 173.9547 75 E 4.7132 9.7045 126.5806 54.4265 31.0061 174.3342 76 V 4.2732 7.6829 123.3680 62.9462 33.5662 173.9294 77 Y 5.4975 8.5299 123.7711 55.3107 41.5716 173.2455 78 E 3.8760 8.4560 123.2586 55.3359 32.6222 173.0818 79 N 4.5750 9.2887 126.1464 52.9444 38.7213 174.4350 80 N 4.8048 7.6140 113.0228 52.0703 41.1820 175.1689 81 Q 4.2610 8.1682 121.0057 54.5982 31.2703 173.4694 82 K 4.6343 8.6843 127.9716 55.8815 31.9789 176.2559 83 L 4.2099 8.5448 128.3688 53.8138 42.0230 176.7054 84 P 4.4908 0.0000 0.0000 61.8490 29.5967 174.6672 85 V 3.7594 7.8139 125.9637 63.8012 32.4285 174.8834 86 R 4.7644 8.3628 124.2716 54.5509 32.8456 174.1715 87 L 5.1753 8.3997 117.6664 53.4950 43.5537 177.2885 88 V 4.2251 8.6599 115.5686 62.3796 33.9441 176.0016 89 S 4.7880 7.6967 110.9594 57.8236 65.9793 173.5870 90 Y 5.1101 8.9690 126.4531 56.3240 42.1114 174.2348 91 S 4.7430 8.8823 122.5966 56.5149 63.4496 171.8362 92 P 4.4735 0.0000 0.0000 62.8576 32.3013 177.7274 93 V 3.8550 8.5285 120.4262 65.5981 31.7716 175.4565 94 P 4.3946 0.0000 0.0000 65.5433 31.2094 177.0530 95 E 4.0563 8.0630 117.0145 56.7046 30.0935 175.2546 96 D 4.1063 8.6695 115.9695 54.7133 39.3905 170.0053 97 H 4.6172 7.3120 115.6247 54.4329 33.3575 171.9219 98 A 4.9845 8.6221 126.0800 50.1836 21.9974 174.5186 99 Y 5.0493 9.1877 120.0073 56.1677 40.5171 175.0221 100 I 5.5008 8.2152 117.2392 58.4158 40.8542 174.8255 101 R 5.4829 8.6378 121.0219 53.8521 34.9235 173.9208 102 F 5.0528 7.2229 115.6294 54.5951 41.4436 172.0224 103 P 5.2054 0.0000 0.0000 62.9863 32.4412 176.9446 104 V 4.4852 8.1564 114.6859 60.6873 34.2155 174.5916 105 S 4.4892 8.5972 120.7864 57.5124 64.8291 173.9539 106 D 4.5465 9.1900 116.4278 54.9558 39.1169 173.3645 107 G 2.8581 7.2026 102.7481 45.5177 0.0000 173.5637 108 T 3.9137 7.0880 114.8661 63.3475 69.0405 174.0125 109 Q 4.9827 9.1219 125.2947 55.5988 31.5205 173.9225 110 E 5.1055 8.1516 118.7658 55.1821 32.7533 174.1432 111 L 4.5253 8.3317 125.8820 53.9137 44.6439 175.9959 112 K 4.2453 8.6161 122.2419 55.1662 32.3791 175.9030 113 I 4.2238 8.2661 127.2985 61.1290 38.6445 175.5370 114 V 4.8770 8.1251 126.2750 61.6843 33.9971 174.4050 115 S 4.8189 8.2455 120.6903 58.0646 66.6056 174.4551 116 S 4.7624 8.1037 114.4169 57.1277 65.3539 172.5299 117 T 5.3477 8.3351 117.3857 59.5118 71.6625 173.2296 118 Q 4.5869 8.2751 122.9136 54.4329 32.0418 174.4142 119 I 4.3389 8.1476 125.5386 60.6086 37.9710 175.1117 120 D 4.5053 7.3682 117.9016 55.4249 40.1160 174.7862 121 D 4.4129 7.7007 117.4027 55.7653 40.8648 176.0313 122 G 4.2607 7.0715 107.3338 44.7276 0.0000 175.7966 123 E 4.6343 7.6217 124.5403 54.1948 31.6755 174.2334 124 E 4.4583 8.3719 118.9588 54.9963 32.4262 177.5715 125 T 3.7964 8.3728 123.7127 63.1982 68.4540 172.4450 126 N 4.6597 8.0004 124.9864 51.7988 39.9651 174.3694 127 Y 4.3835 8.3127 127.6089 56.5206 35.8305 175.9258 128 D 4.2629 8.2824 121.7918 57.1125 41.9169 175.6742 129 Y 4.6057 7.8060 119.9289 57.0255 41.0370 174.6009 130 T 4.0478 8.0227 125.1551 61.3715 70.6686 174.3031 131 K 3.8405 7.8489 129.8760 55.7370 32.7272 175.2459 132 L 4.7411 8.2699 130.8578 53.3697 43.0728 175.1509 133 V 4.2903 8.2777 127.8867 61.4103 32.5060 175.3731 134 F 4.9679 9.0823 127.8240 58.0388 39.7398 176.7303 135 A 4.1460 8.9980 122.0479 54.7446 18.7001 177.8059 136 K 4.6269 7.5408 110.6563 54.2354 36.6159 173.6822 137 P 4.6194 0.0000 0.0000 62.5781 32.2790 176.5649 138 I 4.1776 7.9463 124.6057 60.6249 37.4501 173.6037 139 Y 4.7715 8.1361 124.6302 55.6665 39.1774 175.7359 140 N 4.1622 8.9989 122.9572 53.8882 38.6337 174.2975 141 D 4.7194 7.9754 122.2187 51.6923 40.6744 175.1864 142 P 4.3700 0.0000 0.0000 64.2824 32.0539 178.0510 143 S 4.3885 7.2210 113.7486 57.4828 65.3400 173.7333 144 L 4.8443 7.8985 124.5138 54.8446 42.7636 173.6655 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 4.27 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 2 D 8.09 4.60 0.00 2.76 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.96 4.56 0.00 2.01 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 0.00 2.17 2.30 0.00 4 S 8.40 5.26 0.00 3.91 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 5 L 8.69 4.00 0.00 1.86 1.83 0.88 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 6 K 8.11 3.96 0.00 1.94 1.82 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.42 7.81 7 D 7.91 4.73 0.00 2.72 2.65 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 8 A 7.46 4.57 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 9 I 7.15 3.44 0.56 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.20 0.58 0.00 0.00 10 K 6.98 4.32 0.00 1.79 1.79 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.52 7.81 11 D 7.42 4.95 0.00 2.84 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.59 0.00 2.20 2.20 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 13 A 8.04 4.19 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 14 L 7.49 4.77 0.00 1.83 1.76 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.09 4.80 0.00 2.32 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 2.38 2.40 0.00 16 N 7.66 5.00 0.00 2.73 2.72 0.00 0.00 6.81 7.61 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 17 K 7.63 4.38 0.00 1.98 1.71 0.00 1.78 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.51 7.81 18 E 8.35 4.16 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 2.20 2.24 0.00 19 H 7.94 4.45 0.00 2.96 3.10 0.00 5.81 0.00 0.00 0.00 0.00 8.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 6.92 4.87 0.00 2.38 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 21 I 7.66 4.52 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 1.40 0.87 0.90 0.00 0.00 22 G 8.71 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 23 P 0.00 4.71 0.00 2.13 2.12 0.00 3.88 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.02 0.00 24 R 7.52 4.50 0.00 1.20 1.35 0.00 2.46 0.00 0.00 3.80 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.17 0.00 25 E 7.39 4.65 0.00 1.70 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 2.27 2.41 0.00 26 Q 8.57 4.56 0.00 1.84 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.35 6.82 0.00 0.00 0.00 0.00 0.00 2.17 2.21 0.00 27 V 9.48 4.32 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 0.83 0.00 0.00 0.81 0.00 0.00 28 N 8.69 4.91 0.00 2.80 2.61 0.00 0.00 6.40 7.40 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 29 F 6.99 5.49 0.00 2.98 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 9.28 4.54 0.00 2.30 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 7.03 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 31 L 8.54 4.60 0.00 1.56 1.50 0.83 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.75 5.28 0.00 1.62 1.52 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.39 5.02 0.00 2.83 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 34 K 8.49 4.12 0.00 2.18 1.97 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.07 7.81 35 N 8.27 4.88 0.00 3.19 2.75 0.00 0.00 7.40 6.82 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 36 N 8.40 4.05 0.00 2.85 2.89 0.00 0.00 7.02 7.70 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 37 E 7.88 4.24 0.00 2.13 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 2.27 2.34 0.00 38 T 8.25 4.94 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 1.43 0.00 0.00 39 Q 8.36 4.31 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 7.07 0.00 0.00 0.00 0.00 0.00 2.43 2.23 0.00 40 Y 8.63 4.16 0.00 3.10 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 41 Y 7.75 4.67 0.00 3.11 3.01 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 42 H 7.60 4.63 0.00 2.96 3.21 0.00 5.70 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 F 7.72 4.41 0.00 2.86 2.88 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 0.00 44 F 7.94 4.91 0.00 3.14 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 45 S 7.29 4.76 0.00 4.06 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 46 I 7.51 4.73 1.90 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 1.30 1.58 0.83 0.00 0.00 47 K 8.28 4.46 0.00 1.73 1.79 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.43 7.81 48 D 7.87 4.83 0.00 2.78 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.68 0.00 2.09 2.12 0.00 3.83 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 2.16 1.95 0.00 50 A 9.29 4.47 1.77 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 51 D 9.31 5.19 0.00 2.81 2.39 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 52 V 7.34 3.99 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 0.56 0.00 0.00 0.70 0.00 0.00 53 Y 9.37 4.33 0.00 2.92 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 54 Y 7.81 4.45 0.00 3.02 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 55 T 7.82 4.72 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 1.37 0.00 0.00 56 K 8.56 4.12 0.00 1.75 1.88 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.46 7.81 57 K 7.49 4.22 0.00 1.80 1.77 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.43 7.81 58 K 8.08 4.66 0.00 1.84 1.62 0.00 1.56 0.00 0.00 1.69 0.00 0.00 3.18 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.45 7.81 59 A 8.40 4.48 1.53 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 0.00 0.00 60 E 8.41 4.33 0.00 2.15 1.77 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 2.09 2.16 0.00 61 V 7.79 3.98 0.67 0.00 0.00 0.00 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 0.55 0.00 0.00 62 E 8.96 5.20 0.00 2.19 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 2.48 2.47 0.00 63 L 8.80 5.09 0.00 1.87 1.53 1.44 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.99 4.74 0.00 3.13 2.65 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 65 I 8.24 4.30 1.59 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 -0.30 -0.05 0.50 0.00 0.00 66 N 9.50 4.19 0.00 2.95 3.03 0.00 0.00 7.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 T 7.85 5.11 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 1.38 0.00 0.00 68 A 7.90 4.01 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 69 S 8.24 4.38 0.00 3.92 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 70 T 8.48 4.39 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 1.26 0.00 0.00 71 W 8.02 4.38 0.00 3.38 3.26 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 72 K 8.48 4.49 0.00 1.96 1.77 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.78 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.48 7.81 73 K 7.56 5.22 0.00 1.79 1.72 0.00 1.92 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.49 7.81 74 F 8.37 5.10 0.00 3.24 2.88 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 0.00 75 E 9.70 4.71 0.00 1.95 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 2.32 2.52 0.00 76 V 7.68 4.27 1.71 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 0.84 0.00 0.00 0.36 0.00 0.00 77 Y 8.53 5.50 0.00 3.19 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 78 E 8.46 3.88 0.00 1.85 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 2.15 2.24 0.00 79 N 9.29 4.58 0.00 2.90 2.89 0.00 0.00 6.96 7.82 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 80 N 7.61 4.80 0.00 2.77 2.81 0.00 0.00 6.60 7.72 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 81 Q 8.17 4.26 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 7.04 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 82 K 8.68 4.63 0.00 1.77 1.77 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.81 7.81 83 L 8.54 4.21 0.00 1.64 1.63 1.06 1.32 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 84 P 0.00 4.49 0.00 2.18 2.10 0.00 3.79 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 2.00 1.96 0.00 85 V 7.81 3.76 1.53 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 0.49 0.00 0.00 0.34 0.00 0.00 86 R 8.36 4.76 0.00 1.87 2.05 0.00 2.94 0.00 0.00 3.35 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 87 L 8.40 5.18 0.00 1.50 1.61 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 88 V 8.66 4.23 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 0.59 0.00 0.00 0.97 0.00 0.00 89 S 7.70 4.79 0.00 3.88 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 90 Y 8.97 5.11 0.00 3.08 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 91 S 8.88 4.74 0.00 3.73 3.48 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 92 P 0.00 4.47 0.00 2.16 2.20 0.00 3.67 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 2.03 1.95 0.00 93 V 8.53 3.85 2.12 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 0.85 0.00 0.00 1.01 0.00 0.00 94 P 0.00 4.39 0.00 2.21 2.18 0.00 3.76 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 95 E 8.06 4.06 0.00 2.00 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 2.27 2.20 0.00 96 D 8.67 4.11 0.00 2.84 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 97 H 7.31 4.62 0.00 2.86 2.68 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 98 A 8.62 4.98 1.16 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 0.00 0.00 99 Y 9.19 5.05 0.00 3.13 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 0.00 100 I 8.22 5.50 1.96 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 1.25 1.63 0.87 0.00 0.00 101 R 8.64 5.48 0.00 1.65 1.64 0.00 3.19 0.00 0.00 2.79 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.34 0.00 102 F 7.22 5.05 0.00 3.05 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 0.00 103 P 0.00 5.21 0.00 2.15 2.12 0.00 3.50 0.00 0.00 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.88 0.00 104 V 8.16 4.49 2.12 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 1.11 0.00 0.00 0.87 0.00 0.00 105 S 8.60 4.49 0.00 4.03 4.03 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 0.00 106 D 9.19 4.55 0.00 2.84 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 0.00 107 G 7.20 2.86 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 0.00 108 T 7.09 3.91 4.32 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 1.35 0.00 0.00 109 Q 9.12 4.98 0.00 2.29 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.93 0.00 0.00 0.00 0.00 0.00 2.61 2.51 0.00 110 E 8.15 5.11 0.00 1.95 1.73 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 2.09 2.25 0.00 111 L 8.33 4.53 0.00 1.48 1.53 0.66 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.62 4.25 0.00 1.61 2.10 0.00 1.69 0.00 0.00 1.46 0.00 0.00 2.73 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.90 1.32 7.81 113 I 8.27 4.22 1.75 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.78 0.87 0.00 0.00 114 V 8.13 4.88 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 1.03 0.00 0.00 1.17 0.00 0.00 115 S 8.25 4.82 0.00 3.87 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 0.00 116 S 8.10 4.76 0.00 3.92 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 0.00 117 T 8.34 5.35 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 0.39 0.00 0.00 118 Q 8.28 4.59 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 7.38 0.00 0.00 0.00 0.00 0.00 2.16 2.30 0.00 119 I 8.15 4.34 1.77 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 1.22 0.63 0.84 0.00 0.00 120 D 7.37 4.51 0.00 2.88 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.70 4.41 0.00 2.65 2.59 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 0.00 122 G 7.07 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 0.00 0.00 0.00 0.00 123 E 7.62 4.63 0.00 2.01 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 2.12 2.18 0.00 124 E 8.37 4.46 0.00 1.87 1.74 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 2.05 2.16 0.00 125 T 8.37 3.80 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 0.61 0.00 0.00 126 N 8.00 4.66 0.00 2.55 2.60 0.00 0.00 7.22 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Y 8.31 4.38 0.00 3.07 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 0.00 128 D 8.28 4.26 0.00 2.66 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 0.00 129 Y 7.81 4.61 0.00 3.02 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 0.00 130 T 8.02 4.05 4.19 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 0.88 0.00 0.00 131 K 7.85 3.84 0.00 1.62 1.73 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.41 1.31 7.81 132 L 8.27 4.74 0.00 1.57 1.40 0.66 0.03 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 0.00 133 V 8.28 4.29 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 0.99 0.00 0.00 0.92 0.00 0.00 134 F 9.08 4.97 0.00 3.23 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 0.00 135 A 9.00 4.15 1.34 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 0.00 0.00 0.00 136 K 7.54 4.63 0.00 1.81 1.72 0.00 1.74 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.42 7.81 137 P 0.00 4.62 0.00 1.94 2.10 0.00 3.44 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.01 0.00 138 I 7.95 4.18 1.74 0.00 0.00 0.51 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 0.39 0.93 0.00 0.00 139 Y 8.14 4.77 0.00 2.84 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 N 9.00 4.16 0.00 2.86 2.76 0.00 0.00 7.04 8.60 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 0.00 141 D 7.98 4.72 0.00 2.58 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 0.00 142 P 0.00 4.37 0.00 2.16 2.17 0.00 3.63 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 1.95 1.96 0.00 143 S 7.22 4.39 0.00 3.95 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 0.00 144 L 7.90 4.84 0.00 1.74 1.60 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00