NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 H 4.7904 8.4293 116.3469 55.6748 29.6986 170.2766 4 R 4.2653 8.0879 114.5681 53.0674 32.1650 172.3369 5 K 3.8172 8.4121 117.7486 57.3172 33.3858 177.5101 6 S 4.5523 8.4671 113.9738 57.3073 63.3566 174.0719 7 G 4.1208 8.1501 122.3772 45.1096 0.0000 171.9675 8 R 4.2462 8.3095 120.6396 55.9288 30.8894 176.4292 9 Q 4.3127 8.3460 117.1228 55.0107 30.3794 174.4685 10 L 4.4605 8.1875 124.5665 53.4428 39.4289 176.0851 11 N 4.4337 8.5587 124.9437 55.6541 38.9765 176.6045 12 R 4.2411 8.2524 114.8820 55.8210 31.0399 176.4945 13 N 5.0646 9.0122 112.8625 53.4439 38.4370 176.3213 14 S 4.4318 8.6736 109.2173 60.7207 63.8233 175.9999 15 S 4.0661 8.0753 113.0461 61.6931 62.2834 174.7981 16 H 4.0647 8.3220 118.3371 58.9559 28.9822 175.1171 17 R 4.1660 7.5950 119.9147 56.3423 30.7042 178.6005 18 Q 3.0895 6.9077 116.6880 58.4410 31.4585 177.6237 19 A 4.3934 7.6070 117.7724 53.0827 19.2698 176.5403 20 M 3.5567 8.8966 123.8313 56.9166 31.9683 177.9853 21 F 4.1043 8.7658 114.8493 60.6159 39.2137 176.3361 22 R 4.0427 7.6002 117.7393 57.1205 30.5186 174.7494 23 N 4.3831 8.9306 120.4924 54.2335 38.1072 174.8770 24 M 3.2639 8.8162 117.5664 55.9837 30.3794 177.1660 25 A 4.5092 7.8942 122.0522 53.1787 21.1999 178.3751 26 G 3.9042 7.8997 102.0733 45.8720 0.0000 175.0887 27 S 4.3542 7.9879 115.4195 59.7995 62.7877 174.3297 28 L 4.9714 7.2567 119.1880 55.2524 40.6291 177.5804 29 V 4.5265 7.6487 116.8196 62.5558 35.0625 175.2457 30 R 4.3220 7.6922 115.1639 57.6184 30.5928 176.6951 31 H 4.7695 8.2537 115.9859 53.8816 32.3061 174.7405 32 E 4.4153 8.8222 122.9291 55.9241 28.8701 176.2511 33 I 4.8280 8.2732 120.9455 61.3747 41.0572 174.5390 34 I 4.7893 8.4958 126.6872 59.6395 42.0524 175.1195 35 K 4.7708 8.5775 123.3476 55.5870 34.8828 176.1703 36 T 4.5454 8.7916 115.7313 61.6174 69.2496 175.7887 37 T 4.7345 8.3438 112.7974 61.0630 68.7337 174.7687 38 L 4.2176 8.4547 116.8598 56.8162 41.8384 176.7796 39 P 4.3824 0.0000 0.0000 65.1239 32.7103 178.3892 40 K 4.8846 6.9844 109.5712 57.7937 36.7292 175.5104 41 A 4.7010 8.7671 119.8792 50.7998 18.6009 179.3908 42 K 4.0229 7.5672 118.7024 60.0476 32.4398 177.7117 43 E 4.4297 7.9209 115.3775 56.2478 30.5449 177.0402 44 L 4.1734 7.3055 119.1034 56.1138 42.2518 178.4998 45 R 4.2231 8.2667 117.5969 58.0326 30.2269 177.3917 46 R 4.4296 7.4152 117.5184 57.9679 30.7782 177.8827 47 V 3.7412 7.8513 110.2278 63.0839 31.6867 175.9703 48 V 4.1169 7.2764 119.0796 60.4300 31.8941 173.2195 49 E 3.3269 8.8002 128.7418 54.6891 27.3692 171.5634 50 P 4.2034 0.0000 0.0000 63.3344 32.5293 175.6868 51 L 4.1432 8.5154 124.8188 55.1194 38.2346 174.5482 52 I 4.0795 7.3170 110.2361 60.6295 39.1274 172.8214 53 T 3.4068 8.4997 121.8616 64.3113 68.2269 172.7358 54 L 3.7131 9.0973 120.9613 54.9668 39.3501 176.0198 55 A 4.7229 7.5135 116.8268 52.9571 21.9843 178.0195 56 K 3.8681 7.6252 118.5599 59.1144 32.8763 176.4830 57 T 4.2276 7.5362 109.7398 60.6002 69.9069 174.3080 58 D 4.6711 8.8939 126.2349 53.6022 40.0570 175.8197 59 S 4.5857 8.0057 116.0531 58.3978 64.6061 176.8208 60 V 3.5899 8.0452 118.2836 64.6458 31.7237 176.8523 61 A 4.5147 7.7155 122.1178 51.7499 19.0491 177.1362 62 N 5.6004 8.0649 116.4730 55.3337 45.7800 177.4749 63 R 3.9631 7.6928 117.4719 59.4379 29.5101 178.8243 64 R 3.9660 7.5090 115.7465 59.1114 29.9100 178.5708 65 L 4.1759 7.6313 118.7995 58.2397 42.1053 178.4111 66 A 4.1746 7.6012 121.4051 54.5856 19.4851 177.5093 67 F 4.6515 8.1939 119.2198 55.9707 37.9866 174.5407 68 A 4.8038 7.5725 121.6973 52.7287 24.6167 177.6007 69 R 4.2447 7.8655 113.9069 57.0273 31.0059 176.3453 70 T 4.2695 7.4244 108.9046 59.7226 69.0779 173.6572 71 R 3.3856 8.0208 127.1514 54.2579 28.5203 175.2033 72 D 4.4113 6.1539 116.6055 52.6392 41.3655 176.2838 73 N 4.8874 8.5125 119.6779 55.0909 40.0470 176.8651 74 E 3.8787 8.3585 118.0235 59.1997 29.6912 179.2726 75 I 4.7880 6.9916 111.1857 61.0672 38.2520 176.8090 76 V 4.3309 7.9888 121.4986 63.0591 33.5999 176.6888 77 A 4.3465 7.5820 122.1868 53.8656 18.8931 179.3583 78 K 4.1162 7.5721 116.1727 59.0544 32.1727 178.9201 79 L 4.1350 8.2343 119.4595 56.1427 42.4730 176.2470 80 F 5.3182 7.8363 116.4037 55.6753 41.5612 176.2354 81 N 4.4021 9.2613 118.0093 54.5545 38.7390 173.7546 82 E 4.6853 8.3656 115.2830 56.9944 33.8190 174.8515 83 L 3.4733 9.4671 119.8515 54.5455 39.6650 172.8059 84 G 3.0695 7.3165 103.9532 43.3261 0.0000 172.1947 85 P 4.3927 0.0000 0.0000 63.3076 29.7923 176.2636 86 R 4.6790 8.0341 120.2191 57.1158 35.6979 175.4489 87 F 4.9467 7.9656 120.0137 57.5263 41.2972 176.1469 88 A 3.5755 8.6403 114.9336 56.1583 17.8028 180.4492 89 S 4.3981 8.6638 115.2463 56.7464 62.7752 175.9807 90 R 4.0599 7.3325 117.3449 54.4901 33.0430 175.1266 91 A 4.4703 8.5023 126.5372 51.2428 20.1457 177.7929 92 G 4.0097 9.2635 112.7958 45.5068 0.0000 174.0503 93 G 4.3214 8.8510 104.2955 46.1417 0.0000 174.5125 94 Y 3.1237 7.1081 115.7563 60.1563 38.3771 176.6814 95 T 4.5505 5.7900 112.0961 59.1710 69.3582 173.4023 96 R 3.9799 7.1250 124.0477 56.8389 31.9911 176.1745 97 I 3.7233 7.3248 113.6883 60.6811 40.2445 173.0782 98 L 4.4560 8.0481 126.1980 52.6522 42.8434 176.4294 99 K 3.9770 8.5435 124.9573 57.3558 33.0094 174.8924 100 C 4.9778 8.5464 123.7669 56.9123 35.4061 173.2275 101 G 3.9482 8.7036 110.3755 46.2278 0.0000 173.3017 102 F 4.7133 8.0057 116.9901 56.6416 38.8256 174.9409 103 R 4.5813 8.3883 119.0338 54.3670 32.4992 175.1573 104 A 4.3373 8.3353 121.7117 53.1094 20.6709 179.3479 105 G 3.7288 8.5176 110.9783 47.0861 0.0000 176.8598 106 D 4.3573 9.0756 129.0828 52.6495 40.5221 174.2765 107 N 3.9149 8.4936 124.8919 54.3478 37.9199 175.1736 108 A 4.4447 8.2505 123.6881 50.1718 21.8782 173.4237 109 P 4.6070 0.0000 0.0000 64.2429 32.0137 175.8503 110 M 4.9372 8.5167 121.7076 53.4580 35.1649 174.0517 111 A 4.9736 8.7883 135.0000 51.8627 18.0052 180.0087 112 Y 5.6429 8.3596 104.6144 63.3880 38.2737 178.0577 113 I 2.6401 7.2253 122.5390 61.2843 39.5425 174.4362 114 E 4.3394 7.9174 122.1985 54.8331 30.7456 174.1783 115 L 4.5453 8.2249 117.8873 53.0538 44.1235 177.2553 116 V 3.9659 7.6443 120.1339 61.6418 31.4693 175.7196 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 3 H 8.43 4.79 0.00 3.30 3.42 0.00 5.46 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 R 8.09 4.27 0.00 1.93 1.90 0.00 3.23 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 5 K 8.41 3.82 0.00 1.86 1.91 0.00 1.46 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.51 7.81 6 S 8.47 4.55 0.00 4.02 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 7 G 8.15 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.31 4.25 0.00 2.03 2.05 0.00 3.18 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 9 Q 8.35 4.31 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 7.34 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 10 L 8.19 4.46 0.00 1.96 1.75 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.56 4.43 0.00 2.82 3.03 0.00 0.00 6.08 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 8.25 4.24 0.00 1.48 1.50 0.00 3.33 0.00 0.00 3.25 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.46 0.00 13 N 9.01 5.06 0.00 2.84 2.46 0.00 0.00 5.90 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 14 S 8.67 4.43 0.00 3.91 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 15 S 8.08 4.07 0.00 3.84 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 16 H 8.32 4.06 0.00 3.24 3.44 0.00 5.78 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.60 4.17 0.00 1.94 2.01 0.00 3.51 0.00 0.00 3.17 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.80 0.00 18 Q 6.91 3.09 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 19 A 7.61 4.39 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 20 M 8.90 3.56 0.00 2.32 2.45 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 21 F 8.77 4.10 0.00 3.22 3.15 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 0.00 0.00 0.00 0.00 22 R 7.60 4.04 0.00 1.81 1.93 0.00 3.60 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.82 0.00 23 N 8.93 4.38 0.00 2.96 2.84 0.00 0.00 6.98 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 M 8.82 3.26 0.00 2.11 2.14 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 2.48 2.56 0.00 25 A 7.89 4.51 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 26 G 7.90 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.99 4.35 0.00 3.86 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 28 L 7.26 4.97 0.00 1.90 1.73 0.94 0.82 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 29 V 7.65 4.53 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 0.83 0.00 0.00 1.01 0.00 0.00 30 R 7.69 4.32 0.00 2.08 2.20 0.00 3.03 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.82 0.00 31 H 8.25 4.77 0.00 3.24 3.22 0.00 5.81 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.82 4.42 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 33 I 8.27 4.83 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.51 0.97 0.00 0.00 34 I 8.50 4.79 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.74 0.91 0.00 0.00 35 K 8.58 4.77 0.00 1.59 1.73 0.00 1.71 0.00 0.00 1.77 0.00 0.00 2.80 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.59 1.47 7.81 36 T 8.79 4.55 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 1.19 0.00 0.00 37 T 8.34 4.73 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 38 L 8.45 4.22 0.00 1.78 1.72 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.38 0.00 2.15 2.07 0.00 3.59 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 40 K 6.98 4.88 0.00 1.86 1.36 0.00 1.57 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.62 1.43 7.81 41 A 8.77 4.70 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 42 K 7.57 4.02 0.00 1.90 1.94 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.52 7.81 43 E 7.92 4.43 0.00 2.06 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 0.00 2.06 2.36 0.00 44 L 7.31 4.17 0.00 1.73 1.69 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.27 4.22 0.00 1.98 2.20 0.00 3.22 0.00 0.00 3.04 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.71 0.00 46 R 7.42 4.43 0.00 1.80 2.26 0.00 3.39 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 47 V 7.85 3.74 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 1.03 0.00 0.00 1.06 0.00 0.00 48 V 7.28 4.12 2.11 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 1.01 0.00 0.00 0.99 0.00 0.00 49 E 8.80 3.33 0.00 1.49 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.71 0.00 50 P 0.00 4.20 0.00 2.19 1.95 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 51 L 8.52 4.14 0.00 1.82 1.97 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.32 4.08 1.76 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.48 0.79 0.00 0.00 53 T 8.50 3.41 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 1.20 0.00 0.00 54 L 9.10 3.71 0.00 1.85 1.79 0.93 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.51 4.72 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 56 K 7.63 3.87 0.00 1.68 1.75 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.48 7.81 57 T 7.54 4.23 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 1.23 0.00 0.00 58 D 8.89 4.67 0.00 2.91 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 59 S 8.01 4.59 0.00 3.99 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.05 3.59 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.92 0.00 0.00 61 A 7.72 4.51 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 62 N 8.06 5.60 0.00 2.85 3.02 0.00 0.00 7.23 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 R 7.69 3.96 0.00 1.60 1.92 0.00 3.19 0.00 0.00 3.05 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.54 0.00 64 R 7.51 3.97 0.00 1.85 1.98 0.00 3.31 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 65 L 7.63 4.18 0.00 1.63 1.92 0.94 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 66 A 7.60 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 67 F 8.19 4.65 0.00 3.05 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 68 A 7.57 4.80 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 69 R 7.87 4.24 0.00 1.76 1.98 0.00 3.28 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 70 T 7.42 4.27 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 1.19 0.00 0.00 71 R 8.02 3.39 0.00 1.68 1.80 0.00 3.23 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.49 0.00 72 D 6.15 4.41 0.00 2.68 2.50 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 73 N 8.51 4.89 0.00 2.93 2.94 0.00 0.00 7.19 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 74 E 8.36 3.88 0.00 2.15 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 2.43 2.39 0.00 75 I 6.99 4.79 1.90 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 1.56 1.02 1.00 0.00 0.00 76 V 7.99 4.33 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 0.94 0.00 0.00 1.09 0.00 0.00 77 A 7.58 4.35 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.57 4.12 0.00 1.73 1.93 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.75 1.60 7.81 79 L 8.23 4.13 0.00 1.74 2.20 0.87 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 80 F 7.84 5.32 0.00 3.26 2.97 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 81 N 9.26 4.40 0.00 2.91 3.00 0.00 0.00 6.82 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 82 E 8.37 4.69 0.00 2.25 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 2.45 0.00 83 L 9.47 3.47 0.00 1.73 1.68 0.98 0.92 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 84 G 7.32 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 0.00 0.00 0.00 85 P 0.00 4.39 0.00 2.21 2.15 0.00 3.97 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 86 R 8.03 4.68 0.00 1.84 2.01 0.00 3.30 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 87 F 7.97 4.95 0.00 2.97 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 88 A 8.64 3.58 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.66 4.40 0.00 3.79 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 90 R 7.33 4.06 0.00 0.67 0.66 0.00 3.09 0.00 0.00 3.05 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.14 0.00 91 A 8.50 4.47 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 92 G 9.26 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 93 G 8.85 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 0.00 0.00 0.00 0.00 94 Y 7.11 3.12 0.00 2.76 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 95 T 5.79 4.55 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 1.10 0.00 0.00 96 R 7.13 3.98 0.00 1.75 1.72 0.00 3.14 0.00 0.00 2.98 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.43 0.00 97 I 7.32 3.72 1.79 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.46 0.74 0.00 0.00 98 L 8.05 4.46 0.00 1.59 1.55 0.82 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.54 3.98 0.00 1.75 1.74 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.49 7.81 100 C 8.55 4.98 0.00 3.15 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 0.00 101 G 8.70 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 0.00 102 F 8.01 4.71 0.00 3.03 3.17 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 0.00 103 R 8.39 4.58 0.00 1.87 1.97 0.00 3.23 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 104 A 8.34 4.34 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 0.00 105 G 8.52 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 D 9.08 4.36 0.00 2.64 2.61 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 0.00 107 N 8.49 3.91 0.00 2.50 2.28 0.00 0.00 6.94 7.35 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 0.00 108 A 8.25 4.44 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 P 0.00 4.61 0.00 2.18 2.21 0.00 3.84 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.08 0.00 110 M 8.52 4.94 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.59 0.00 111 A 8.79 4.97 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 0.00 112 Y 8.36 5.64 0.00 3.10 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 0.00 113 I 7.23 2.64 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.31 0.86 0.00 0.00 114 E 7.92 4.34 0.00 2.17 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 0.00 2.02 2.08 0.00 115 L 8.22 4.55 0.00 1.55 1.53 0.93 0.94 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 0.00 116 V 7.64 3.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.95 0.00 0.00