NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4570 8.3349 116.7921 57.5940 65.0795 173.7167 2 L 4.7165 7.5067 117.6104 50.7839 44.7267 175.1059 3 T 4.2721 8.8016 113.0260 60.6831 72.0801 175.5654 4 K 3.8590 8.4427 121.5010 59.9439 32.2136 178.6148 5 T 3.8763 7.8045 109.4924 64.7792 68.6011 176.2655 6 E 3.8661 7.8466 120.6044 59.1176 29.5161 179.2927 7 R 3.6980 8.2351 118.4846 59.6185 30.1571 179.1459 8 T 3.8262 8.1550 115.6728 66.7820 68.4532 176.7564 9 I 3.7584 7.5537 121.0806 64.3024 37.0285 178.5334 10 I 3.2854 7.6970 120.8898 64.2054 36.8019 178.6925 11 V 3.6511 7.7628 119.2414 66.0368 31.3973 178.2522 12 S 4.1574 8.1669 114.1249 61.6781 62.8926 176.1297 13 M 3.9335 8.3951 121.9370 58.0428 31.9951 178.0041 14 W 4.2850 8.8619 128.6502 60.3066 30.6097 177.6738 15 A 3.9021 7.7646 120.2402 55.0165 17.5416 179.4323 16 K 3.9074 7.2413 116.1474 59.3046 32.1002 179.5697 17 I 3.6807 7.2914 120.2953 64.2150 36.4215 178.2677 18 S 3.4835 7.2716 115.6555 61.6703 62.2664 176.5316 19 T 4.1378 7.1705 109.6310 62.9824 68.8782 174.9289 20 Q 4.4802 8.0151 119.8536 54.8912 30.8438 176.5565 21 A 3.9424 7.6864 121.9468 55.7185 18.2127 180.3063 22 D 4.3342 8.0909 116.6093 57.8730 40.9265 179.1616 23 T 3.9361 7.8109 109.6935 64.6961 68.8089 176.6484 24 I 3.7529 8.0371 122.9482 64.0342 37.1456 178.5703 25 G 3.6102 8.4131 106.9704 48.1565 0.0000 175.9609 26 T 3.9078 7.9550 118.3416 66.2698 68.5060 176.5519 27 E 3.9040 8.4947 121.6654 59.4351 29.6126 178.9912 28 T 3.7715 8.0326 115.9376 66.6552 68.5026 176.6488 29 L 3.4939 7.5663 120.3466 57.6319 41.3665 179.4823 30 E 4.1085 8.1300 118.5767 59.3669 29.3635 179.6279 31 R 3.8883 8.0079 118.2863 58.8993 30.0099 178.8845 32 L 3.9330 7.6274 120.1554 58.2783 42.0139 179.1029 33 F 4.5392 8.0744 118.1492 60.5859 38.5616 177.7048 34 L 4.1100 7.7977 117.7189 57.6517 41.6363 179.1168 35 S 4.3749 8.0531 113.7682 59.9861 64.4594 174.4674 36 H 4.9909 8.3293 118.4835 51.9870 29.3465 171.9157 37 P 4.6542 0.0000 0.0000 65.3180 31.0393 178.2229 38 Q 4.0986 8.3778 117.0921 59.7208 28.0976 178.9216 39 T 4.3969 8.5132 111.2791 64.3649 68.7036 176.5921 40 K 3.8917 8.6452 122.4421 59.3096 31.7437 178.9339 41 T 3.8875 7.5680 109.1796 64.6077 68.4536 175.1789 42 Y 4.2051 7.7474 117.4183 58.5836 39.2466 175.1617 43 F 4.7644 8.4965 119.6403 55.8331 39.5807 175.0102 44 P 4.3104 0.0000 0.0000 65.8341 31.6510 177.1290 45 H 4.7066 8.5281 111.9700 55.7252 28.9198 174.6512 46 F 4.7924 8.0094 119.2065 56.2332 40.4477 175.5906 47 D 4.6579 8.2562 123.9113 53.2680 39.9346 175.2635 48 L 4.5104 8.2159 127.4242 55.0026 42.3192 176.8467 49 H 4.7463 7.7847 114.6315 53.3706 29.8496 172.9377 50 P 4.5533 0.0000 0.0000 63.8439 31.2524 176.8161 51 G 3.8468 8.7427 107.8637 45.8359 0.0000 174.2441 52 S 4.0602 7.5033 114.3525 58.6147 63.7803 174.8759 53 A 3.9757 8.5782 130.1405 54.8869 18.2985 179.7365 54 Q 3.6907 7.8293 118.0359 59.1661 29.2036 177.8842 55 L 4.1684 7.8556 121.4238 58.2153 42.1797 178.8422 56 R 4.1816 8.5983 120.1306 58.8741 29.8751 178.3229 57 A 4.0430 8.0710 120.6779 55.4770 18.3752 179.1387 58 H 4.4695 8.5245 116.9122 59.3541 29.9929 177.7544 59 G 3.6519 8.4018 107.8026 47.9372 0.0000 175.9122 60 S 4.2604 8.2247 117.4645 61.2640 62.7138 176.9602 61 K 4.0962 7.8963 121.4000 59.1693 31.8257 179.5822 62 V 3.5898 7.8041 118.5851 66.2003 31.4664 178.3726 63 V 3.8126 7.9246 117.7150 65.8273 31.2455 177.7774 64 A 4.2026 8.3781 120.5470 55.2043 18.3901 179.4511 65 A 3.9291 8.3686 119.5107 55.2608 18.4419 180.0160 66 V 3.6791 8.0683 116.9557 66.0704 31.6235 178.4845 67 G 2.0557 8.2008 105.7743 47.3620 0.0000 175.3326 68 D 4.3667 8.2288 121.3188 57.0432 40.2613 178.8475 69 A 4.0319 7.7471 120.9062 54.7554 18.1094 179.9707 70 V 3.3045 7.3067 116.2671 65.9621 31.6483 177.9214 71 K 4.0090 7.9004 117.5755 58.2930 33.4390 177.7900 72 S 4.7137 7.5122 112.6120 56.7545 62.1881 174.5794 73 I 4.0005 7.3545 122.4930 63.8562 38.5399 176.3609 74 D 4.5305 7.9500 118.3448 56.2820 40.7786 176.4969 75 D 4.7538 7.7023 117.8050 52.1183 43.1442 175.2023 76 I 3.7966 8.0382 125.3738 64.1466 37.6583 177.7410 77 G 3.7783 8.1896 106.0662 47.9627 0.0000 175.6909 78 G 3.6710 7.8986 106.9315 46.5271 0.0000 175.1411 79 A 4.3275 7.7450 121.6831 53.2359 19.1101 177.8304 80 L 4.6427 7.3249 114.6618 53.8491 43.1899 177.7861 81 S 4.0657 8.3350 115.7809 61.4638 61.8120 176.3270 82 K 3.9363 7.9661 119.6905 60.2752 32.6332 178.8085 83 L 4.1810 7.8126 119.5244 56.5564 41.3044 179.4881 84 S 4.1750 7.6693 115.4497 61.6324 62.8362 176.0054 85 E 3.8965 8.1317 121.1153 59.2949 29.3010 178.0962 86 L 3.9286 8.0222 119.6381 58.9502 42.0344 178.6832 87 H 4.0680 8.1952 115.0131 58.7364 28.5461 177.5605 88 A 3.5182 8.2059 122.9096 54.9330 18.2433 178.9878 89 Y 4.1133 8.0342 117.3318 60.0423 39.3727 177.0531 90 I 4.0041 7.7372 119.3711 63.7683 37.7926 177.1479 91 L 4.1041 8.6721 119.9185 55.5837 42.0527 177.3722 92 R 4.7786 7.4105 115.5960 55.9780 28.0826 177.0148 93 V 3.6841 8.0973 116.7102 62.2498 32.4967 174.9562 94 D 4.5078 8.8319 126.9887 53.9902 41.7881 175.2538 95 P 4.6406 0.0000 0.0000 65.7727 31.1308 178.9129 96 V 3.7903 8.2244 117.9525 64.7272 31.1845 178.1711 97 N 4.3612 8.5240 117.2455 56.0146 38.2677 177.2869 98 F 3.9989 8.3874 119.2051 60.2135 38.8521 177.8545 99 K 4.1141 8.1660 117.9242 59.2575 31.9365 179.2198 100 L 3.9082 7.6915 119.4141 57.7572 41.5892 179.3623 101 L 3.9022 8.0069 120.2857 58.1478 42.0185 179.1055 102 S 4.2003 8.2330 115.1626 61.8526 62.8142 176.0962 103 H 4.2136 8.5451 121.0813 59.6721 29.6407 177.1096 104 C 4.0554 8.2113 118.4342 62.6481 27.8068 175.9142 105 L 3.9364 8.0961 122.0555 57.9625 41.5731 179.0069 106 L 3.9032 8.0372 119.1211 57.6073 41.4816 179.6083 107 V 3.2939 7.6705 118.1681 66.1083 31.3510 178.1606 108 T 3.8079 7.6642 115.3693 66.6673 68.3213 176.5829 109 L 3.8969 7.8376 120.6878 57.6420 41.3657 179.4520 110 A 3.3144 7.0266 119.5439 54.8170 18.2386 179.2832 111 A 3.9297 7.5879 118.3483 55.0698 18.4751 179.8894 112 R 3.6114 7.7051 116.0001 57.9587 31.7360 177.4676 113 F 5.0309 8.0861 115.9831 54.7593 39.1886 173.8226 114 P 4.2905 0.0000 0.0000 65.9213 31.5382 178.5842 115 A 4.1859 8.0625 120.3914 54.6975 18.5095 178.0136 116 D 4.5682 8.1219 114.3065 56.4049 41.8452 177.1588 117 F 4.3621 7.9475 123.4601 57.1955 37.7399 174.6324 118 T 4.3342 7.3091 115.9527 60.4702 71.8457 175.4265 119 A 3.9090 8.3250 121.9764 55.1277 18.2771 179.3643 120 E 3.8019 8.0688 117.1803 59.4138 29.8014 178.7634 121 A 4.0356 7.9782 120.8533 55.2263 18.2998 179.1013 122 H 3.7398 8.0420 116.6365 59.2677 29.9493 177.2876 123 A 3.9664 8.2192 122.5992 55.1546 18.1403 179.4905 124 A 3.9198 8.1709 119.1877 55.2019 18.5022 179.9868 125 W 3.9230 8.5317 117.6508 59.6849 29.1231 178.2237 126 D 4.5088 8.7785 118.5326 57.3905 40.7229 178.3462 127 K 3.9713 8.2102 120.0410 59.3602 32.1559 178.4582 128 F 4.1728 8.3998 121.0132 61.5220 39.2383 177.2112 129 L 3.8496 8.6767 118.8110 57.6552 41.3790 179.4857 130 S 4.0940 8.1985 113.4304 61.0919 62.3776 176.4326 131 V 3.4937 7.6702 121.1692 65.8683 31.3975 178.1454 132 V 3.3989 7.5737 118.0933 66.1026 31.3960 178.2070 133 S 4.0146 8.3278 115.4687 61.4043 62.6322 176.7794 134 S 4.0548 7.9412 118.3821 60.7877 62.4485 176.7052 135 V 3.5972 7.2245 120.4118 65.7879 31.3743 177.8668 136 L 4.0460 7.4743 116.7480 56.5555 41.6143 178.3545 137 T 3.9892 6.9506 107.7896 60.9179 68.9827 175.6983 138 E 3.9802 7.6449 120.6329 59.4318 29.5316 178.0118 139 K 4.2881 7.7453 116.7616 56.8524 31.5321 176.0588 140 Y 4.9296 7.4335 115.2783 59.7700 40.5474 176.3046 141 R 4.1458 7.9064 123.6100 56.6855 30.1590 176.8195 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 S 8.33 4.46 0.00 3.88 3.99 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 2 L 7.51 4.72 0.00 1.60 1.46 0.80 0.64 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 3 T 8.80 4.27 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 4 K 8.44 3.86 0.00 1.81 1.82 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.47 7.81 5 T 7.80 3.88 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 6 E 7.85 3.87 0.00 2.11 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 0.00 2.28 2.30 0.00 7 R 8.24 3.70 0.00 2.00 1.89 0.00 3.05 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 8 T 8.16 3.83 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 1.19 0.00 0.00 9 I 7.55 3.76 1.96 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 1.53 0.88 1.02 0.00 0.00 10 I 7.70 3.29 1.44 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.11 -0.49 0.00 0.00 11 V 7.76 3.65 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 1.09 0.00 0.00 0.89 0.00 0.00 12 S 8.17 4.16 0.00 4.11 4.11 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 13 M 8.40 3.93 0.00 2.80 2.40 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.32 0.00 14 W 8.86 4.28 0.00 3.71 3.35 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 15 A 7.76 3.90 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 16 K 7.24 3.91 0.00 1.20 1.24 0.00 1.26 0.00 0.00 1.53 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.28 1.38 7.81 17 I 7.29 3.68 1.49 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 1.54 0.59 0.73 0.00 0.00 18 S 7.27 3.48 0.00 3.74 3.28 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 19 T 7.17 4.14 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 1.14 0.00 0.00 20 Q 8.02 4.48 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.70 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 21 A 7.69 3.94 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 22 D 8.09 4.33 0.00 2.70 2.74 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 0.00 0.00 0.00 23 T 7.81 3.94 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 1.18 0.00 0.00 24 I 8.04 3.75 2.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.64 0.90 0.00 0.00 25 G 8.41 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 26 T 7.96 3.91 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 1.21 0.00 0.00 27 E 8.49 3.90 0.00 2.02 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 2.21 2.28 0.00 28 T 8.03 3.77 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 1.16 0.00 0.00 29 L 7.57 3.49 0.00 1.54 1.21 0.96 0.89 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 30 E 8.13 4.11 0.00 2.08 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 2.39 2.39 0.00 31 R 8.01 3.89 0.00 1.94 1.91 0.00 3.02 0.00 0.00 3.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 32 L 7.63 3.93 0.00 1.65 1.34 0.90 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.07 4.54 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 34 L 7.80 4.11 0.00 1.75 1.73 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.05 4.37 0.00 3.79 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 36 H 8.33 4.99 0.00 3.28 3.22 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.65 0.00 2.29 2.38 0.00 4.01 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.94 0.00 38 Q 8.38 4.10 0.00 2.39 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.51 2.67 0.00 39 T 8.51 4.40 4.53 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 1.33 0.00 0.00 40 K 8.65 3.89 0.00 1.91 1.75 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.81 1.48 7.81 41 T 7.57 3.89 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 1.17 0.00 0.00 42 Y 7.75 4.21 0.00 3.11 2.72 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 43 F 8.50 4.76 0.00 2.66 2.36 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 44 P 0.00 4.31 0.00 2.20 2.18 0.00 3.91 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 45 H 8.53 4.71 0.00 3.42 3.50 0.00 5.51 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 46 F 8.01 4.79 0.00 3.13 2.98 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 47 D 8.26 4.66 0.00 2.60 2.58 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 48 L 8.22 4.51 0.00 1.57 1.50 0.29 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 49 H 7.78 4.75 0.00 3.13 3.39 0.00 5.28 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.55 0.00 2.17 2.10 0.00 3.47 0.00 0.00 2.18 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 51 G 8.74 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 52 S 7.50 4.06 0.00 4.01 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 53 A 8.58 3.98 1.31 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 0.00 0.00 54 Q 7.83 3.69 0.00 1.93 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.86 0.00 0.00 0.00 0.00 0.00 1.18 1.95 0.00 55 L 7.86 4.17 0.00 1.86 1.83 1.04 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 56 R 8.60 4.18 0.00 1.98 1.94 0.00 3.19 0.00 0.00 3.27 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.51 0.00 57 A 8.07 4.04 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 58 H 8.52 4.47 0.00 3.83 3.83 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 G 8.40 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 60 S 8.22 4.26 0.00 4.11 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 61 K 7.90 4.10 0.00 1.99 1.94 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.54 1.81 7.81 62 V 7.80 3.59 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 1.02 0.00 0.00 0.89 0.00 0.00 63 V 7.92 3.81 2.23 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 1.37 0.00 0.00 1.09 0.00 0.00 64 A 8.38 4.20 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 A 8.37 3.93 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 66 V 8.07 3.68 2.49 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 1.49 0.00 0.00 1.08 0.00 0.00 67 G 8.20 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 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.23 4.37 0.00 2.86 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 69 A 7.75 4.03 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 70 V 7.31 3.30 1.51 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 0.58 0.00 0.00 0.66 0.00 0.00 71 K 7.90 4.01 0.00 1.74 1.82 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.53 7.81 72 S 7.51 4.71 0.00 3.93 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 73 I 7.35 4.00 1.97 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.48 0.84 0.00 0.00 74 D 7.95 4.53 0.00 2.68 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 75 D 7.70 4.75 0.00 2.64 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 76 I 8.04 3.80 1.82 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.54 0.78 0.00 0.00 77 G 8.19 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 78 G 7.90 3.67 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 0.00 0.00 0.00 79 A 7.75 4.33 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 80 L 7.32 4.64 0.00 1.61 1.59 0.81 0.69 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 81 S 8.33 4.07 0.00 4.04 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 82 K 7.97 3.94 0.00 1.96 1.94 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.23 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.55 7.81 83 L 7.81 4.18 0.00 1.74 1.86 0.96 1.01 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 84 S 7.67 4.18 0.00 3.87 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 85 E 8.13 3.90 0.00 2.02 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 2.45 2.45 0.00 86 L 8.02 3.93 0.00 1.76 1.79 0.90 0.97 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 87 H 8.20 4.07 0.00 3.33 3.55 0.00 5.86 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.21 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Y 8.03 4.11 0.00 2.89 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 90 I 7.74 4.00 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.93 0.90 0.00 0.00 91 L 8.67 4.10 0.00 1.77 1.73 0.68 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 92 R 7.41 4.78 0.00 2.14 2.09 0.00 3.13 0.00 0.00 2.92 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.52 0.00 93 V 8.10 3.68 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 0.26 0.00 0.00 0.66 0.00 0.00 94 D 8.83 4.51 0.00 2.93 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 95 P 0.00 4.64 0.00 2.28 2.20 0.00 3.69 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.50 0.00 96 V 8.22 3.79 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 1.06 0.00 0.00 0.97 0.00 0.00 97 N 8.52 4.36 0.00 2.74 2.70 0.00 0.00 6.89 7.69 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 98 F 8.39 4.00 0.00 3.30 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 99 K 8.17 4.11 0.00 1.99 1.90 0.00 1.71 0.00 0.00 1.86 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.59 1.60 7.81 100 L 7.69 3.91 0.00 1.73 1.54 0.86 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 101 L 8.01 3.90 0.00 1.57 1.57 0.81 0.84 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 0.00 102 S 8.23 4.20 0.00 4.18 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 0.00 103 H 8.55 4.21 0.00 3.33 3.58 0.00 5.78 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 0.00 104 C 8.21 4.06 0.00 3.11 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 0.00 105 L 8.10 3.94 0.00 1.77 1.88 0.88 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.04 3.90 0.00 1.93 1.77 1.14 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.67 3.29 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 0.97 0.00 0.00 0.78 0.00 0.00 108 T 7.66 3.81 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 1.13 0.00 0.00 109 L 7.84 3.90 0.00 1.47 1.63 0.10 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 110 A 7.03 3.31 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.59 3.93 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 0.00 112 R 7.71 3.61 0.00 0.99 0.66 0.00 2.76 0.00 0.00 2.91 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.38 0.00 113 F 8.09 5.03 0.00 3.07 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 0.00 114 P 0.00 4.29 0.00 2.20 2.20 0.00 3.84 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 2.01 1.96 0.00 115 A 8.06 4.19 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 0.00 116 D 8.12 4.57 0.00 2.93 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 0.00 117 F 7.95 4.36 0.00 3.17 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 0.00 118 T 7.31 4.33 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 1.23 0.00 0.00 119 A 8.32 3.91 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 0.00 120 E 8.07 3.80 0.00 2.03 1.93 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 2.36 2.36 0.00 121 A 7.98 4.04 1.31 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 0.00 0.00 122 H 8.04 3.74 0.00 2.49 3.28 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.22 3.97 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 0.00 124 A 8.17 3.92 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 0.00 125 W 8.53 3.92 0.00 3.68 3.54 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 0.00 126 D 8.78 4.51 0.00 3.05 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 0.00 127 K 8.21 3.97 0.00 1.91 1.96 0.00 1.69 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.46 7.81 128 F 8.40 4.17 0.00 2.88 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 0.00 129 L 8.68 3.85 0.00 1.87 1.81 1.22 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.20 4.09 0.00 3.93 4.14 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 0.00 131 V 7.67 3.49 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 0.85 0.00 0.00 0.93 0.00 0.00 132 V 7.57 3.40 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 0.88 0.00 0.00 0.33 0.00 0.00 133 S 8.33 4.01 0.00 4.02 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 0.00 134 S 7.94 4.05 0.00 3.98 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 0.00 135 V 7.22 3.60 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 0.77 0.00 0.00 0.84 0.00 0.00 136 L 7.47 4.05 0.00 1.50 1.45 0.84 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 137 T 6.95 3.99 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 0.29 0.00 0.00 138 E 7.64 3.98 0.00 2.05 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 2.20 2.22 0.00 139 K 7.75 4.29 0.00 1.57 1.82 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.32 7.81 140 Y 7.43 4.93 0.00 3.21 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 0.00 141 R 7.91 4.15 0.00 1.79 1.86 0.00 3.35 0.00 0.00 3.47 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00