NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.3259 8.3049 120.3262 55.1538 33.3332 174.9903 1 I 3.9995 8.1807 123.7706 58.6055 37.0701 173.4499 2 Q 5.0668 9.3091 124.9834 54.3605 32.0342 174.9090 3 R 4.8378 8.8438 120.1570 54.5754 34.0433 174.7156 4 T 5.0323 8.7992 117.1006 60.2454 68.3900 172.4344 5 P 4.8058 0.0000 0.0000 63.0028 32.2024 175.9858 6 K 4.4980 9.4768 123.4243 56.0694 33.8168 175.9780 7 I 5.2902 8.2375 123.0148 59.8720 40.9433 174.6434 8 Q 4.8410 9.4200 125.0733 54.0895 32.6342 174.3911 9 V 5.1375 8.4569 122.9979 61.5167 34.1168 173.8472 10 Y 5.4327 8.6329 124.4338 56.8735 41.6708 172.9202 11 S 5.1642 9.1925 114.4613 57.0109 64.6828 174.3713 12 R 4.1188 9.0108 123.1887 59.4109 30.1487 176.3543 13 H 5.1207 8.0441 112.8949 52.6861 31.8098 172.0012 14 P 4.3210 0.0000 0.0000 62.7899 31.5608 176.4951 15 A 4.1819 8.7777 126.1913 52.2598 19.0067 176.6096 16 E 4.5406 8.5452 121.7619 54.1421 32.2467 174.9589 17 N 4.5174 8.9139 121.4382 55.4547 38.8202 175.6283 18 G 3.9387 9.2873 112.7280 44.8679 0.0000 173.0508 19 K 4.4004 7.5175 119.4119 54.1604 33.5505 176.4927 20 S 4.0338 8.2671 117.5244 58.5275 63.0325 172.7664 21 N 4.7470 8.1527 122.0744 53.3252 42.9725 172.2050 22 F 5.2257 8.7334 115.8049 55.7861 43.2071 173.8296 23 L 3.9692 9.0048 126.0959 53.7289 43.2498 174.9571 24 N 5.4953 8.9710 123.8055 51.5897 42.1648 173.2375 25 C 5.2872 9.4004 121.5928 55.3504 48.1134 172.0447 26 Y 5.5602 9.4642 129.5459 56.4840 40.1713 174.4679 27 V 5.1058 8.8058 121.0751 59.7371 34.5176 175.3552 28 S 5.2660 8.3354 118.6521 56.9874 67.1626 174.2548 29 G 4.4873 8.8374 105.1173 47.2738 0.0000 173.1580 30 F 5.6558 7.3888 113.3184 54.6849 41.4791 173.6286 31 H 5.3704 8.6628 117.4074 54.7465 33.2253 171.7405 32 P 4.8346 0.0000 0.0000 62.4042 32.1330 176.1451 33 S 3.8646 8.4767 113.4003 60.6842 63.1517 174.3613 34 D 4.3226 7.9302 120.4842 54.7196 41.1452 174.8640 35 I 4.6161 7.9575 124.8271 59.8135 41.3767 172.9218 36 E 4.5533 8.9931 128.7638 54.3407 31.9466 174.7376 37 V 4.5869 7.9909 126.1874 61.0723 34.2743 174.0969 38 D 4.9466 8.9968 127.4446 52.4217 44.7096 174.7393 39 L 4.9368 8.3686 121.8544 53.4929 43.9563 175.4003 40 L 5.2193 9.2881 123.5993 52.7927 45.3150 175.5892 41 K 4.3408 8.7292 123.3972 54.4939 34.8426 175.8706 42 N 4.2161 10.1343 128.6817 54.3881 36.5444 176.0745 43 G 3.9536 8.3141 104.8023 45.5056 0.0000 173.6804 44 E 4.4771 7.7628 120.1518 54.2776 30.9418 175.5817 45 R 4.2677 8.4028 123.7737 56.3497 30.6296 175.8909 46 I 4.0491 8.5580 127.5504 60.8527 37.5931 175.6993 47 E 4.0085 8.7003 126.1158 59.3461 29.6140 178.6655 48 K 4.2453 7.6454 124.1092 55.1056 30.8317 174.8639 49 V 4.4643 7.8712 121.2922 60.8976 33.9993 174.3570 50 E 4.6124 8.3916 127.2998 55.2429 32.2368 174.2920 51 H 5.2992 7.8142 115.1783 54.0716 31.6670 173.0617 52 S 4.5815 8.5520 115.0979 57.7800 64.3020 173.4037 53 D 4.5285 8.4496 119.9649 53.4756 41.2750 176.4337 54 L 4.0752 8.3342 125.5644 55.8072 42.8896 175.7414 55 S 4.6503 8.1616 119.3421 57.3129 66.6952 171.7266 56 F 5.2917 7.4127 115.6191 55.8503 41.0978 173.8982 57 S 4.7010 9.1356 116.5626 56.7080 64.5620 175.2522 58 K 3.5064 8.5440 121.7545 59.7014 31.6703 176.8375 59 D 4.4372 7.7885 115.2469 52.8337 39.3951 177.1189 60 W 3.5942 7.7039 119.2587 56.7112 28.1286 174.5833 61 S 4.3632 8.1523 114.7736 58.1454 63.9231 174.2756 62 F 5.1037 8.7937 122.7444 57.5218 40.1199 173.9585 63 Y 5.4915 8.2793 117.5286 56.0167 41.6018 173.9323 64 L 5.1310 9.6651 121.0494 53.3576 47.2054 174.5562 65 L 5.4238 9.2431 124.7246 53.8526 44.5250 174.5440 66 Y 5.2833 9.5502 125.0113 56.8439 40.3838 174.4574 67 Y 5.8243 8.5602 120.1968 56.7208 42.0956 173.4422 68 T 4.9945 8.3120 113.3092 60.7876 71.0005 172.2229 69 E 3.9308 8.7695 127.9814 56.3863 30.4692 175.5581 70 F 4.7684 8.6791 119.4579 56.3561 41.6619 173.2379 71 T 4.3577 8.1062 116.1203 60.6447 70.8813 171.8410 72 P 4.6367 0.0000 0.0000 62.9179 32.9768 175.5363 73 T 5.0565 8.5135 110.0720 59.5488 72.2096 174.3162 74 E 3.9856 8.9800 122.1367 58.5252 29.7081 177.4667 75 K 4.4893 7.2993 113.6166 56.9329 34.1006 176.7575 76 D 4.4940 8.1330 118.8855 54.5900 41.2705 175.2730 77 E 4.7855 9.3708 123.8240 55.0822 31.5685 174.7272 78 Y 5.2260 8.8115 121.0223 56.5990 41.7767 174.3231 79 A 5.0860 8.7973 122.1988 51.4125 23.8790 174.1329 80 C 5.2730 9.3818 119.4312 54.8108 45.6684 172.5130 81 R 5.1218 9.1434 126.9918 54.5594 32.1000 174.6051 82 V 4.8150 9.1487 126.2482 61.0097 34.8431 173.5667 83 N 5.3093 9.1090 125.7982 52.2238 42.2168 172.3935 84 H 5.1620 8.5117 123.5779 54.6154 33.2678 174.3599 85 V 3.5887 8.1928 122.0664 64.7015 31.5500 177.4334 86 T 4.0905 7.9269 109.3246 62.5850 69.3041 173.6357 87 L 4.7431 7.7105 123.6008 53.0454 42.3466 176.6694 88 S 4.2697 8.7257 119.5678 59.9543 63.5727 174.2797 89 Q 4.5935 7.6602 120.7764 52.9071 31.2542 172.9049 90 P 4.4937 0.0000 0.0000 63.1794 32.4272 174.9102 91 C 4.6823 9.1100 123.8672 57.8619 33.5578 172.2453 92 I 4.8866 8.3879 126.5996 59.4914 39.2744 174.9014 93 V 4.4220 8.8829 127.4267 60.8907 33.7634 174.9015 94 K 4.7548 8.7477 127.4996 55.8843 33.1380 176.4002 95 W 4.6080 9.2563 135.0000 57.0736 31.6584 174.9073 96 D 4.5146 8.1735 126.4286 51.7606 42.7161 176.8691 97 R 3.3756 7.7256 122.7854 58.1589 29.5659 176.5399 98 D 4.9136 8.3643 118.0825 53.8548 41.5347 175.7624 99 M 4.3632 7.8224 122.8520 55.1461 33.1415 175.0215 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 0 M 8.30 4.33 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.65 0.00 1 I 8.18 4.00 1.81 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 1.43 0.09 0.91 0.00 0.00 2 Q 9.31 5.07 0.00 2.30 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.73 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 3 R 8.84 4.84 0.00 2.00 1.93 0.00 3.17 0.00 0.00 3.14 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 4 T 8.80 5.03 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 1.26 0.00 0.00 5 P 0.00 4.81 0.00 2.00 1.73 0.00 3.81 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.70 0.00 6 K 9.48 4.50 0.00 1.83 1.81 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.48 7.81 7 I 8.24 5.29 1.92 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 1.33 0.60 0.97 0.00 0.00 8 Q 9.42 4.84 0.00 2.32 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 9 V 8.46 5.14 2.34 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 0.95 0.00 0.00 1.13 0.00 0.00 10 Y 8.63 5.43 0.00 3.21 3.11 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 0.00 0.00 0.00 0.00 11 S 9.19 5.16 0.00 4.33 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 0.00 12 R 9.01 4.12 0.00 1.83 2.03 0.00 3.09 0.00 0.00 3.02 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.46 0.00 13 H 8.04 5.12 0.00 3.37 3.20 0.00 5.77 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.32 0.00 2.10 2.07 0.00 3.77 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 2.08 2.16 0.00 15 A 8.78 4.18 1.61 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 16 E 8.55 4.54 0.00 1.97 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 2.30 2.49 0.00 17 N 8.91 4.52 0.00 2.73 2.83 0.00 0.00 7.38 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 18 G 9.29 3.94 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 0.00 0.00 0.00 19 K 7.52 4.40 0.00 1.82 1.69 0.00 1.86 0.00 0.00 1.61 0.00 0.00 2.74 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.32 7.81 20 S 8.27 4.03 0.00 3.71 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 21 N 8.15 4.75 0.00 2.67 2.15 0.00 0.00 7.11 7.94 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 22 F 8.73 5.23 0.00 3.03 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 23 L 9.00 3.97 0.00 0.27 0.77 -0.04 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.97 5.50 0.00 1.44 2.11 0.00 0.00 5.95 8.32 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 25 C 9.40 5.29 0.00 2.91 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 26 Y 9.46 5.56 0.00 3.32 3.20 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 27 V 8.81 5.11 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 0.65 0.00 0.00 1.16 0.00 0.00 28 S 8.34 5.27 0.00 3.81 3.31 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 0.00 0.00 0.00 0.00 29 G 8.84 4.49 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 0.00 30 F 7.39 5.66 0.00 2.98 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 31 H 8.66 5.37 0.00 3.27 3.23 0.00 5.67 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 32 P 0.00 4.83 0.00 2.15 2.16 0.00 3.89 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 1.99 1.99 0.00 33 S 8.48 3.86 0.00 3.21 2.63 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 34 D 7.93 4.32 0.00 2.63 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 35 I 7.96 4.62 1.60 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.68 0.86 0.00 0.00 36 E 8.99 4.55 0.00 1.98 1.67 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 2.09 2.13 0.00 37 V 7.99 4.59 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 0.38 0.00 0.00 0.46 0.00 0.00 38 D 9.00 4.95 0.00 2.49 2.44 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 39 L 8.37 4.94 0.00 1.56 1.51 0.89 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.29 5.22 0.00 1.58 1.52 0.91 0.09 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 41 K 8.73 4.34 0.00 1.84 1.61 0.00 1.95 0.00 0.00 1.67 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.11 0.77 7.81 42 N 10.13 4.22 0.00 2.72 2.80 0.00 0.00 7.11 7.53 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 43 G 8.31 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 44 E 7.76 4.48 0.00 2.14 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 2.24 2.36 0.00 45 R 8.40 4.27 0.00 1.75 1.83 0.00 3.21 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 46 I 8.56 4.05 1.93 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 1.35 0.81 0.92 0.00 0.00 47 E 8.70 4.01 0.00 1.96 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 0.00 2.31 2.33 0.00 48 K 7.65 4.25 0.00 1.72 1.78 0.00 1.57 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.48 7.81 49 V 7.87 4.46 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 0.96 0.00 0.00 0.98 0.00 0.00 50 E 8.39 4.61 0.00 1.16 1.43 0.00 0.00 0.00 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 2.05 0.00 51 H 7.81 5.30 0.00 2.22 2.07 0.00 5.53 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.55 4.58 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 53 D 8.45 4.53 0.00 2.69 2.63 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 54 L 8.33 4.08 0.00 1.61 1.59 0.79 0.51 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 55 S 8.16 4.65 0.00 3.57 2.66 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 0.00 0.00 0.00 56 F 7.41 5.29 0.00 2.95 2.63 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 57 S 9.14 4.70 0.00 4.08 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 58 K 8.54 3.51 0.00 1.59 1.74 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.26 1.28 7.81 59 D 7.79 4.44 0.00 2.79 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 60 W 7.70 3.59 0.00 3.28 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 61 S 8.15 4.36 0.00 3.86 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 62 F 8.79 5.10 0.00 1.60 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 63 Y 8.28 5.49 0.00 2.99 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 64 L 9.67 5.13 0.00 1.91 1.66 1.16 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 65 L 9.24 5.42 0.00 2.04 1.70 1.12 1.10 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 66 Y 9.55 5.28 0.00 2.95 2.85 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 67 Y 8.56 5.82 0.00 3.00 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 68 T 8.31 4.99 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 1.10 0.00 0.00 69 E 8.77 3.93 0.00 1.62 1.68 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 2.05 1.89 0.00 70 F 8.68 4.77 0.00 2.67 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 71 T 8.11 4.36 4.16 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 1.14 0.00 0.00 72 P 0.00 4.64 0.00 2.26 2.02 0.00 3.34 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.56 0.00 73 T 8.51 5.06 4.31 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 0.00 0.00 0.00 1.30 0.00 0.00 74 E 8.98 3.99 0.00 1.99 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 2.32 2.37 0.00 75 K 7.30 4.49 0.00 1.86 1.84 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.40 7.81 76 D 8.13 4.49 0.00 2.85 2.38 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 77 E 9.37 4.79 0.00 1.94 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 2.30 2.45 0.00 78 Y 8.81 5.23 0.00 3.01 2.68 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 79 A 8.80 5.09 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 80 C 9.38 5.27 0.00 2.96 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 81 R 9.14 5.12 0.00 1.82 1.69 0.00 3.05 0.00 0.00 3.05 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.50 0.00 82 V 9.15 4.81 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 0.73 0.00 0.00 0.81 0.00 0.00 83 N 9.11 5.31 0.00 2.75 2.53 0.00 0.00 6.33 7.43 0.00 0.00 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 H 8.51 5.16 0.00 3.08 3.02 0.00 5.93 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.19 3.59 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 0.69 0.00 0.00 0.91 0.00 0.00 86 T 7.93 4.09 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 1.38 0.00 0.00 87 L 7.71 4.74 0.00 1.78 1.87 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.73 4.27 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 89 Q 7.66 4.59 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.97 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 90 P 0.00 4.49 0.00 1.95 1.94 0.00 3.69 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 91 C 9.11 4.68 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 92 I 8.39 4.89 1.88 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 1.22 1.04 0.93 0.00 0.00 93 V 8.88 4.42 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 1.14 0.00 0.00 0.97 0.00 0.00 94 K 8.75 4.75 0.00 1.74 1.81 0.00 1.82 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.49 1.48 7.81 95 W 9.26 4.61 0.00 3.31 3.49 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 96 D 8.17 4.51 0.00 2.55 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 0.00 0.00 0.00 0.00 97 R 7.73 3.38 0.00 1.86 1.46 0.00 3.00 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.49 0.00 98 D 8.36 4.91 0.00 2.53 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 99 M 7.82 4.36 0.00 2.02 1.83 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00