NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4206 8.3049 120.3162 55.0417 33.6983 174.9047 2 K 4.2201 7.9429 119.0051 55.1027 34.1720 176.7242 3 T 3.8729 8.3081 118.3722 67.1479 68.8944 176.7332 4 F 4.2931 8.2955 115.5656 59.7953 38.0033 177.1933 5 E 3.5602 7.0047 118.8791 59.0050 29.2653 179.0167 6 I 3.7166 7.5234 119.8249 64.1616 37.0357 178.4222 7 L 3.9801 8.0206 119.9269 57.8491 41.4961 179.7931 8 K 3.9976 8.1139 118.3660 59.6790 31.9357 179.2524 9 H 4.1829 8.1083 116.1884 58.8173 28.6594 177.8558 10 L 4.0124 8.1010 120.9090 57.7666 41.2593 179.3543 11 Q 4.1411 8.4427 119.6894 59.0375 29.0959 178.1616 12 A 4.0921 8.0976 121.8739 55.4239 18.4861 179.4024 13 D 4.3530 8.4227 117.2074 57.2247 40.7770 178.8649 14 A 4.0324 8.2488 121.4313 55.3789 18.6203 179.6127 15 I 3.2368 7.5293 117.2213 63.8362 37.8855 178.3111 16 V 3.5461 7.6205 118.9308 65.8719 31.2723 178.1045 17 L 3.7308 8.2041 119.2267 57.2616 41.2420 179.1178 18 F 4.1460 8.1803 120.9525 61.5603 39.4506 176.9377 19 M 3.8510 7.9437 117.4372 58.3119 31.9390 178.0414 20 K 3.4699 7.7908 119.8139 59.4440 32.3099 178.9721 21 V 3.5336 7.7207 111.8081 63.4647 31.4249 178.2722 22 H 3.3205 6.9647 115.4508 58.0965 28.2169 176.9043 23 N 4.0963 7.0140 118.3514 56.8178 38.8069 176.8738 24 F 4.1722 6.9603 118.6709 60.6953 38.6726 177.0466 25 H 4.2605 7.7804 118.4715 58.5366 29.6938 176.9464 26 W 4.7638 8.0476 119.5252 58.8270 29.4041 176.8394 27 N 5.1656 8.5339 114.8687 53.0533 39.3576 175.4226 28 V 4.3201 7.7140 118.1710 63.1660 32.1606 175.5636 29 K 4.7842 9.1503 125.5666 55.5177 35.8930 175.4860 30 G 4.1795 9.1559 108.7938 44.3066 0.0000 174.9504 31 T 4.1188 8.4799 108.5278 63.0536 68.9579 174.4651 32 D 4.6207 8.1982 121.6163 55.5686 41.7180 177.6640 33 F 3.5907 8.0794 120.4017 61.4677 40.4759 176.8951 34 F 4.0590 8.8735 121.5729 61.5868 39.1227 177.2606 35 N 4.2064 8.2751 115.4635 56.3996 38.4631 177.7559 36 V 3.6077 7.5759 119.9533 64.7128 31.4156 177.8784 37 H 3.7814 8.0761 119.5454 58.7735 29.2695 177.2320 38 K 3.7265 7.5665 121.2276 59.1889 31.9880 178.7629 39 A 3.8902 8.0870 121.6923 55.3641 18.2275 179.7372 40 T 3.7663 8.0417 108.6440 64.7330 68.7336 176.3260 41 E 2.5400 7.3783 120.7285 58.5847 29.6868 178.6349 42 E 3.7815 7.4679 118.2956 59.2125 29.4268 179.4936 43 I 3.6196 7.5353 120.1012 64.5145 37.2765 178.0870 44 Y 4.6132 7.8422 118.1907 59.7055 37.7811 177.8424 45 E 4.2653 7.9046 121.0467 59.3057 29.4260 178.7311 46 E 3.9149 7.9558 119.0026 59.3596 29.6794 178.9383 47 F 4.4235 8.2870 117.6471 60.4576 39.0386 177.5444 48 A 4.0799 8.5549 120.7604 55.2581 18.1003 179.4830 49 D 4.3974 8.1054 117.1182 57.6597 40.8501 178.6168 50 M 4.2098 8.5588 119.1034 58.6076 32.2872 177.8540 51 F 4.3337 8.8792 121.3028 61.6300 39.5570 176.6986 52 D 4.0929 8.1395 117.0034 57.2519 41.0063 177.9306 53 D 4.2430 8.4169 119.7216 57.1771 40.8394 178.6133 54 L 3.8435 8.2354 119.5828 57.8110 41.8079 179.4382 55 A 3.8866 7.5350 120.0254 55.3406 18.3034 179.6020 56 E 3.9224 8.1268 116.8822 59.1579 29.4874 179.5448 57 R 3.8358 8.0204 119.2115 59.2471 30.0456 178.5757 58 I 3.7613 7.7657 119.7187 64.5585 37.0370 178.8883 59 V 3.9136 7.6076 114.2591 63.8813 31.1217 178.6845 60 Q 3.9642 7.9790 117.1171 58.5952 28.6136 177.9534 61 L 4.3209 7.6915 117.5669 54.8815 41.8392 177.6370 62 G 3.6788 8.0798 107.4817 45.8169 0.0000 172.5041 63 H 4.6302 8.0688 116.6648 53.7035 32.0200 171.9766 64 H 4.8633 8.4068 117.3538 53.9238 29.6595 173.9094 65 P 4.6582 0.0000 0.0000 61.3679 32.5519 175.7381 66 L 4.3183 8.7405 119.7923 55.2625 41.7964 177.8877 67 V 4.4921 8.5264 114.0600 60.7759 33.3184 176.1378 68 T 4.7789 7.4445 110.1467 59.0596 73.0955 174.6413 69 L 4.0331 8.4905 122.3341 57.8559 41.1637 179.7802 70 S 4.0875 8.0139 112.8241 61.5282 62.4765 175.9624 71 E 4.0212 8.2520 121.0484 59.0898 29.1521 179.1458 72 A 4.0058 7.8490 120.7836 55.2198 18.3935 179.5439 73 I 3.9817 7.6113 110.1751 62.2941 37.8140 177.5077 74 K 4.1215 7.5050 120.3106 58.5502 32.2133 177.6025 75 L 4.4795 7.5573 117.4733 54.5240 42.5151 177.1152 76 T 4.3006 7.3552 109.5530 62.0602 69.1036 174.7273 77 R 4.4691 8.7146 119.6943 55.7476 31.2869 175.8399 78 V 3.9521 7.2928 118.4293 60.7539 32.7618 175.0428 79 K 4.1528 8.2730 128.4795 55.6574 32.9324 175.7996 80 E 4.0797 8.5036 126.5825 55.7965 30.3671 175.5297 81 E 4.5106 8.4834 125.1902 55.4272 30.1141 176.2899 82 T 4.2865 8.4395 114.1423 62.4959 69.8301 175.5448 83 K 4.2160 8.7254 122.5152 56.7883 32.4790 176.4650 84 T 4.6953 7.7872 109.8526 60.7946 69.2884 173.4985 85 S 4.6044 6.6044 114.1693 58.2346 65.2569 173.4843 86 F 5.0253 9.0397 124.4357 56.5868 44.3114 172.8078 87 H 5.2288 8.3673 116.4128 54.5871 31.7862 175.7735 88 S 3.5496 8.5489 116.1113 60.9563 62.9802 176.2568 89 K 3.9240 8.2551 121.9773 60.1027 31.8880 178.2919 90 D 4.3553 7.9816 118.2771 57.1797 40.6693 178.8811 91 I 2.4013 7.1917 119.8493 64.0679 37.0840 178.4063 92 F 4.3306 7.5752 118.3002 60.0782 38.5862 178.1324 93 K 4.0020 7.9505 118.4128 59.3823 31.7931 179.2121 94 E 3.9511 7.9132 118.7563 59.5395 29.3359 179.4274 95 I 3.6674 7.6247 119.7967 64.2287 37.1046 178.2392 96 L 3.8594 7.9003 121.0565 58.0908 41.9797 178.8072 97 E 4.0443 8.2761 118.5456 59.8073 29.4784 179.2516 98 D 4.6403 8.5107 118.9447 57.5425 40.7970 178.5239 99 Y 4.3937 8.6846 117.7851 61.1725 37.7969 178.5844 100 K 4.0940 8.5203 119.5177 59.5276 32.2136 178.8613 101 Y 4.1135 8.1294 119.4741 60.7272 38.7040 177.9339 102 L 3.6958 8.2396 119.9839 57.5589 41.7426 179.0852 103 E 3.9958 8.4587 119.4693 59.2506 29.5706 179.0763 104 K 3.9731 7.8239 118.2902 59.5261 32.0413 179.2270 105 E 3.8026 7.7550 118.5760 59.3666 29.2525 179.4174 106 F 4.0980 8.4223 117.7838 59.9682 38.8698 178.0352 107 K 4.0470 7.9879 118.6182 59.2369 31.8540 179.2212 108 E 3.9086 8.1383 118.9503 59.1864 29.3314 178.7928 109 L 3.8746 7.9702 120.5367 58.4324 42.2209 178.9447 110 S 4.1228 8.2792 112.7774 61.5103 62.2522 175.9383 111 N 4.3462 8.3630 119.3464 56.6866 38.3603 177.6426 112 T 3.9922 8.5068 111.2133 64.4944 68.8618 176.6212 113 A 4.1261 8.2948 125.4336 54.3365 18.3786 179.2100 114 E 3.8799 8.1500 117.6546 59.4591 29.5313 179.2363 115 K 4.0375 7.7062 117.0761 59.2742 32.1901 178.4785 116 E 4.2993 7.9583 116.3571 56.6034 29.6330 177.6788 117 G 3.8956 7.8509 107.1696 46.2760 0.0000 175.0742 118 D 4.6299 8.1387 121.4794 52.2845 38.9225 176.3634 119 K 3.8934 8.1901 123.9165 59.4302 32.6489 178.7287 120 V 3.7877 7.7582 111.6239 64.4455 31.4719 178.6384 121 T 4.1114 8.1622 115.3181 66.1946 68.1588 177.1170 122 V 3.6457 7.7254 120.4397 66.2682 31.6135 178.2826 123 T 3.8894 7.8670 109.1350 64.6875 68.6466 176.0161 124 Y 4.0031 8.0889 122.0736 60.4808 38.9088 177.7431 125 A 4.0242 8.4025 121.9287 55.4897 18.6276 179.4267 126 D 4.2844 8.3469 117.4600 57.4222 40.7880 178.8290 127 D 4.2347 7.9190 119.6686 57.3280 40.7115 178.7857 128 Q 3.5383 7.3432 118.4057 58.4399 28.3367 178.6185 129 L 3.7560 7.5432 119.8759 57.5841 41.6062 179.3491 130 A 3.9183 7.6811 120.3719 55.1788 18.3447 179.9031 131 K 3.8712 7.6425 116.4755 59.4824 31.9954 179.6708 132 L 3.7824 7.9229 119.4956 57.9388 41.4777 179.6862 133 Q 4.0401 8.3950 118.2810 58.5858 28.5781 178.7441 134 K 4.2584 7.9791 120.6123 59.6987 32.3100 179.1942 135 S 4.1648 8.1683 115.5122 61.5420 62.6643 176.6753 136 I 3.8610 8.2997 123.0023 63.9751 36.7585 178.1626 137 W 4.2790 8.1258 128.8182 60.9861 30.6207 177.9001 138 M 3.1762 7.5603 118.3763 57.9681 31.2909 178.8248 139 L 3.6683 8.1786 119.4032 57.8836 41.5897 179.6441 140 Q 3.9864 8.0759 116.6412 58.8288 29.0351 178.3392 141 A 4.1336 8.2694 122.2858 55.3840 18.1665 179.1463 142 H 3.9327 7.8934 115.8044 58.9965 29.9594 176.5782 143 L 4.3627 7.4985 117.4384 54.8041 41.6748 176.6998 144 A 4.3040 7.5731 127.7989 52.2216 19.1206 177.1636 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 M 8.30 4.42 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 2 K 7.94 4.22 0.00 1.53 1.80 0.00 1.52 0.00 0.00 1.84 0.00 0.00 3.11 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.62 7.81 3 T 8.31 3.87 4.37 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 1.27 0.00 0.00 4 F 8.30 4.29 0.00 3.17 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 5 E 7.00 3.56 0.00 1.78 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 1.77 1.47 0.00 6 I 7.52 3.72 1.94 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 1.43 0.74 0.79 0.00 0.00 7 L 8.02 3.98 0.00 1.93 1.74 0.98 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.11 4.00 0.00 1.73 1.83 0.00 1.75 0.00 0.00 1.95 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.74 7.81 9 H 8.11 4.18 0.00 3.34 3.36 0.00 5.62 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 10 L 8.10 4.01 0.00 1.94 1.69 0.59 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.44 4.14 0.00 2.26 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.53 2.25 0.00 12 A 8.10 4.09 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 13 D 8.42 4.35 0.00 2.99 2.87 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 14 A 8.25 4.03 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 0.00 0.00 0.00 0.00 0.00 15 I 7.53 3.24 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 0.00 0.00 0.00 1.06 0.95 0.94 0.00 0.00 16 V 7.62 3.55 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 0.89 0.00 0.00 0.91 0.00 0.00 17 L 8.20 3.73 0.00 1.32 0.28 0.81 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 18 F 8.18 4.15 0.00 3.12 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 19 M 7.94 3.85 0.00 2.26 2.02 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.55 0.00 20 K 7.79 3.47 0.00 1.76 1.62 0.00 1.54 0.00 0.00 1.67 0.00 0.00 3.22 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.66 1.09 7.81 21 V 7.72 3.53 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 0.90 0.00 0.00 1.08 0.00 0.00 22 H 6.96 3.32 0.00 2.51 1.31 0.00 5.63 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 N 7.01 4.10 0.00 2.63 2.45 0.00 0.00 7.24 6.98 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 24 F 6.96 4.17 0.00 2.95 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 25 H 7.78 4.26 0.00 3.05 3.04 0.00 5.79 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 W 8.05 4.76 0.00 3.56 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 27 N 8.53 5.17 0.00 3.22 3.12 0.00 0.00 6.62 8.45 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 28 V 7.71 4.32 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 0.68 0.00 0.00 0.86 0.00 0.00 29 K 9.15 4.78 0.00 1.62 1.64 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.43 7.81 30 G 9.16 4.18 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 0.00 31 T 8.48 4.12 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 1.25 0.00 0.00 32 D 8.20 4.62 0.00 2.82 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.08 3.59 0.00 3.40 3.09 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 34 F 8.87 4.06 0.00 3.31 3.18 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 35 N 8.28 4.21 0.00 3.00 2.90 0.00 0.00 6.86 7.68 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 36 V 7.58 3.61 1.82 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 0.90 0.00 0.00 0.65 0.00 0.00 37 H 8.08 3.78 0.00 2.16 2.92 0.00 5.78 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.57 3.73 0.00 1.25 1.55 0.00 1.38 0.00 0.00 1.42 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.19 1.30 7.81 39 A 8.09 3.89 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 40 T 8.04 3.77 4.33 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 0.00 0.00 0.00 1.18 0.00 0.00 41 E 7.38 2.54 0.00 1.68 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 1.87 1.83 0.00 42 E 7.47 3.78 0.00 2.05 1.86 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 2.21 2.30 0.00 43 I 7.54 3.62 2.04 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 1.61 0.76 1.17 0.00 0.00 44 Y 7.84 4.61 0.00 2.81 3.03 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 45 E 7.90 4.27 0.00 2.17 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 0.00 2.29 2.28 0.00 46 E 7.96 3.91 0.00 2.15 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 2.08 2.23 0.00 47 F 8.29 4.42 0.00 3.45 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.55 4.08 1.57 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 0.00 0.00 49 D 8.11 4.40 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 50 M 8.56 4.21 0.00 2.50 2.22 0.00 0.00 0.00 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.90 0.00 51 F 8.88 4.33 0.00 3.22 3.34 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 52 D 8.14 4.09 0.00 2.98 2.78 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 53 D 8.42 4.24 0.00 2.76 2.43 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 0.00 0.00 0.00 54 L 8.24 3.84 0.00 1.71 1.73 1.11 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.54 3.89 1.08 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 0.00 0.00 0.00 56 E 8.13 3.92 0.00 1.95 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 2.25 2.48 0.00 57 R 8.02 3.84 0.00 1.78 1.95 0.00 3.08 0.00 0.00 3.07 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.67 0.00 58 I 7.77 3.76 2.04 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 1.59 0.58 1.04 0.00 0.00 59 V 7.61 3.91 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 1.07 0.00 0.00 0.94 0.00 0.00 60 Q 7.98 3.96 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.97 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 61 L 7.69 4.32 0.00 1.93 1.76 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.08 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 0.00 0.00 0.00 63 H 8.07 4.63 0.00 3.03 2.98 0.00 5.60 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 H 8.41 4.86 0.00 3.18 3.21 0.00 5.69 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 65 P 0.00 4.66 0.00 2.09 2.16 0.00 3.80 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 1.95 1.93 0.00 66 L 8.74 4.32 0.00 1.72 1.70 1.01 1.11 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 67 V 8.53 4.49 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 0.78 0.00 0.00 0.99 0.00 0.00 68 T 7.44 4.78 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 1.27 0.00 0.00 69 L 8.49 4.03 0.00 1.76 1.76 0.89 0.75 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 70 S 8.01 4.09 0.00 3.89 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 71 E 8.25 4.02 0.00 2.22 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 2.34 2.34 0.00 72 A 7.85 4.01 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 73 I 7.61 3.98 1.86 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 1.65 1.42 0.93 0.00 0.00 74 K 7.50 4.12 0.00 1.89 2.06 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.48 7.81 75 L 7.56 4.48 0.00 1.75 1.65 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 76 T 7.36 4.30 4.42 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 1.25 0.00 0.00 77 R 8.71 4.47 0.00 1.43 1.77 0.00 3.35 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.89 0.00 78 V 7.29 3.95 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 0.75 0.00 0.00 0.90 0.00 0.00 79 K 8.27 4.15 0.00 1.70 1.66 0.00 1.83 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.35 7.81 80 E 8.50 4.08 0.00 1.94 1.80 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 2.26 2.26 0.00 81 E 8.48 4.51 0.00 1.88 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 2.49 2.47 0.00 82 T 8.44 4.29 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 1.23 0.00 0.00 83 K 8.73 4.22 0.00 1.93 1.46 0.00 1.69 0.00 0.00 2.16 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.40 7.81 84 T 7.79 4.70 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 1.25 0.00 0.00 85 S 6.60 4.60 0.00 3.72 3.50 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 86 F 9.04 5.03 0.00 2.99 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 87 H 8.37 5.23 0.00 3.09 3.17 0.00 5.65 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 88 S 8.55 3.55 0.00 3.96 3.89 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 0.00 0.00 0.00 89 K 8.26 3.92 0.00 1.91 1.85 0.00 1.81 0.00 0.00 1.84 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.59 7.81 90 D 7.98 4.36 0.00 2.91 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 91 I 7.19 2.40 1.18 0.00 0.00 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 0.46 0.44 -0.15 0.00 0.00 92 F 7.58 4.33 0.00 3.02 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 93 K 7.95 4.00 0.00 1.96 1.85 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.68 7.81 94 E 7.91 3.95 0.00 2.05 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 0.00 2.37 2.36 0.00 95 I 7.62 3.67 1.71 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.67 0.30 0.00 0.00 96 L 7.90 3.86 0.00 1.96 1.81 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 97 E 8.28 4.04 0.00 2.13 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 0.00 2.59 2.53 0.00 98 D 8.51 4.64 0.00 3.01 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 99 Y 8.68 4.39 0.00 3.25 3.09 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 0.00 100 K 8.52 4.09 0.00 2.10 1.96 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.69 7.81 101 Y 8.13 4.11 0.00 3.18 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 0.00 102 L 8.24 3.70 0.00 2.04 1.92 1.26 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 103 E 8.46 4.00 0.00 2.07 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 2.33 2.37 0.00 104 K 7.82 3.97 0.00 1.87 1.80 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.67 7.81 105 E 7.75 3.80 0.00 1.72 1.63 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 1.67 1.81 0.00 106 F 8.42 4.10 0.00 3.12 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 0.00 107 K 7.99 4.05 0.00 2.02 1.86 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.71 7.81 108 E 8.14 3.91 0.00 2.08 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 0.00 2.57 2.40 0.00 109 L 7.97 3.87 0.00 1.85 1.91 1.16 0.93 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 0.00 110 S 8.28 4.12 0.00 4.06 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 0.00 111 N 8.36 4.35 0.00 3.00 2.85 0.00 0.00 6.83 6.69 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 0.00 112 T 8.51 3.99 4.24 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 1.30 0.00 0.00 113 A 8.29 4.13 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.15 3.88 0.00 2.22 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 2.31 2.36 0.00 115 K 7.71 4.04 0.00 1.90 1.87 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.63 7.81 116 E 7.96 4.30 0.00 2.09 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 2.36 2.53 0.00 117 G 7.85 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 0.00 118 D 8.14 4.63 0.00 2.74 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 0.00 119 K 8.19 3.89 0.00 1.82 1.88 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.76 1.50 7.81 120 V 7.76 3.79 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 1.00 0.00 0.00 0.95 0.00 0.00 121 T 8.16 4.11 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 1.33 0.00 0.00 122 V 7.73 3.65 2.30 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 1.16 0.00 0.00 1.02 0.00 0.00 123 T 7.87 3.89 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 1.32 0.00 0.00 124 Y 8.09 4.00 0.00 3.17 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 0.00 125 A 8.40 4.02 1.56 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 0.00 126 D 8.35 4.28 0.00 2.73 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 0.00 127 D 7.92 4.23 0.00 2.61 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 7.34 3.54 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 1.30 1.40 0.00 129 L 7.54 3.76 0.00 1.88 1.62 0.97 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 130 A 7.68 3.92 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 0.00 131 K 7.64 3.87 0.00 1.72 1.71 0.00 1.47 0.00 0.00 1.51 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.51 7.81 132 L 7.92 3.78 0.00 1.75 1.63 0.80 0.99 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 Q 8.40 4.04 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.82 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 134 K 7.98 4.26 0.00 1.90 1.99 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.57 1.87 7.81 135 S 8.17 4.16 0.00 4.25 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 0.00 136 I 8.30 3.86 1.99 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.01 1.01 0.00 0.00 137 W 8.13 4.28 0.00 3.34 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.56 3.18 0.00 1.63 1.85 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.04 0.00 139 L 8.18 3.67 0.00 1.80 1.61 0.62 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 140 Q 8.08 3.99 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 141 A 8.27 4.13 1.27 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 0.00 0.00 0.00 142 H 7.89 3.93 0.00 2.89 3.24 0.00 5.94 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 L 7.50 4.36 0.00 1.68 1.69 0.93 0.89 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 0.00 144 A 7.57 4.30 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