NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 A 4.2358 8.1185 123.5821 52.3450 20.5328 177.9660 6 A 4.5146 7.5881 115.2325 50.8020 18.9203 177.4766 7 L 3.8885 8.1952 124.5212 59.3540 43.0852 177.3806 8 A 3.9691 8.0141 120.1587 55.1672 17.7803 179.2095 9 E 3.9310 7.7428 117.0612 59.4019 29.4755 179.5954 10 I 3.8234 7.4620 119.1994 64.2247 37.4720 178.2538 11 V 3.6763 7.8433 116.9767 65.0213 31.5505 177.0310 12 A 4.3299 7.6857 119.5313 54.8635 19.3170 179.0759 13 Q 3.7919 7.7155 117.9862 58.7632 28.7901 177.5954 14 L 4.3505 8.0301 118.7769 56.2552 41.5161 178.3076 15 N 4.5374 7.7318 117.1357 55.3371 39.1202 177.1479 16 I 3.9401 7.1718 112.7094 63.3869 37.7285 176.8853 17 Y 4.7774 7.6479 117.9821 59.8287 38.1540 176.9365 18 Q 4.1529 7.8912 119.6988 57.7345 29.4426 176.6420 19 S 4.4066 8.4472 110.8967 58.7937 62.8895 174.2649 20 Q 4.5355 7.6609 118.8162 57.2864 30.3693 177.2852 21 V 3.5793 7.8350 119.5819 66.1910 31.7242 177.9315 22 E 4.3048 7.6937 119.2061 58.5145 29.1922 179.2050 23 L 3.9867 7.8357 120.3376 58.2023 42.2747 178.8866 24 I 3.9315 7.6269 119.7495 64.4288 36.5618 178.4158 25 Q 4.0090 8.2419 119.0186 58.7421 28.4527 178.7976 26 Q 3.9537 7.8596 120.1712 59.4659 29.3763 178.1933 27 Q 4.0567 8.1807 118.9530 59.2590 28.6842 178.9106 28 M 4.1500 8.2833 119.8594 58.0423 31.8776 178.7078 29 E 3.9279 7.8267 117.8266 59.2593 29.6121 178.8345 30 A 3.9668 7.8596 120.8276 55.4171 18.4220 179.8088 31 V 3.5217 7.6571 116.0634 66.3300 31.5299 178.4689 32 R 3.9376 8.0999 117.5274 59.0037 29.8375 178.8971 33 A 3.9772 8.6036 121.0258 55.5426 18.4424 179.8100 34 T 3.8302 8.1815 114.4927 66.8364 68.5036 176.9487 35 I 3.7264 7.8886 121.6779 64.3533 37.1126 178.5559 36 S 4.3682 8.1857 117.3928 61.1371 62.7135 176.3293 37 E 3.9508 8.1552 121.7953 59.4691 29.2950 178.9225 38 L 4.0231 8.0696 118.8881 57.6767 41.1997 179.3618 39 E 4.2647 8.1716 120.1254 58.9118 29.4102 179.4102 40 I 3.8032 7.9336 119.9632 64.1157 37.1338 178.1508 41 L 3.9788 8.1126 121.3021 58.2977 41.6162 178.8748 42 E 3.9886 8.3544 118.5134 59.2992 29.3910 179.3313 43 K 4.0669 8.0276 119.6370 59.7393 32.4019 179.0435 44 T 3.8810 8.0405 115.9815 66.7367 68.1912 176.6768 45 L 4.1414 7.7964 119.5507 57.8123 42.0584 179.5506 46 S 4.3743 8.3355 115.1017 61.9518 62.6811 176.4741 47 D 4.4400 8.5259 120.4529 56.7855 40.8607 178.0860 48 I 4.1646 7.6036 111.4909 60.1177 38.3916 175.7274 49 Q 3.9796 7.3118 121.4377 57.5934 28.8612 177.4115 50 G 3.9809 8.8247 109.8376 45.9562 0.0000 173.5898 51 K 4.5148 7.8649 117.8418 55.6669 32.5024 175.7539 52 D 4.5095 8.1116 118.6306 56.3815 40.9627 177.4030 53 G 4.0004 8.8835 112.1570 45.3326 0.0000 173.9447 54 S 4.4531 8.1605 116.7450 58.2482 64.0596 173.9528 55 E 4.7250 8.6299 122.3426 56.8484 30.4142 175.7841 56 T 4.7597 8.8951 115.4772 60.7201 71.7365 172.2024 57 L 5.2109 8.5075 124.5886 52.9161 44.6716 175.9281 58 V 4.5556 8.8993 124.6419 60.1697 33.6328 173.0217 59 P 3.8966 0.0000 0.0000 62.7168 31.5258 176.5635 60 V 4.1723 8.5291 116.2794 60.3605 32.9057 174.9918 61 G 3.8982 9.0449 107.7490 44.9882 0.0000 173.9329 62 A 3.8806 9.5022 123.4272 53.0476 16.0788 177.7982 63 G 3.9507 8.0785 104.1769 46.6736 0.0000 173.3565 64 S 5.0065 7.6058 115.3654 56.5621 65.6017 173.3433 65 F 5.4184 8.8067 120.6741 55.7664 42.8014 173.9886 66 I 4.6797 8.6412 115.1471 59.0813 40.8935 174.4979 67 K 5.0114 8.5058 121.6058 55.9677 33.5118 175.8493 68 A 4.6251 8.4260 122.9403 51.3104 23.3995 174.7581 69 E 5.0025 8.4760 118.4010 54.1644 31.9938 176.5718 70 L 4.2011 8.8909 125.1508 55.1403 43.0303 176.2119 71 K 4.6738 8.2063 122.2866 55.3537 35.4822 175.6811 72 D 4.3985 8.7065 125.8797 55.4614 38.3352 175.2503 73 T 3.9006 8.3778 108.3773 64.0961 69.3706 175.5182 74 S 4.9688 7.9246 115.2486 58.0455 63.6738 172.8674 75 E 5.3923 8.2484 120.9079 54.8028 32.5882 175.8876 76 V 4.5060 8.6968 121.9127 60.2317 35.1451 174.0952 77 I 4.5385 8.5101 125.8309 61.0305 37.9692 174.9810 78 M 4.7766 8.9967 127.4388 53.1891 35.1333 175.2148 79 S 4.6334 8.7525 118.4207 58.1838 63.1265 174.0113 80 V 4.2060 9.0260 119.7070 60.9539 32.3068 176.3546 81 G 3.8726 7.5382 107.0421 45.5235 0.0000 173.1518 82 A 3.8153 9.2809 118.1202 53.0898 16.0703 178.3345 83 G 3.9026 8.4870 104.5775 47.0875 0.0000 174.0084 84 V 4.5596 7.7791 119.2605 60.7538 34.1556 174.4294 85 A 5.2279 8.5106 127.1267 50.2499 22.4359 175.2170 86 I 4.5804 8.8736 120.9364 59.1734 41.1664 174.7388 87 K 4.6519 8.7410 128.2182 56.1857 32.7811 176.0087 88 K 4.8859 9.1651 126.7253 54.3375 36.4849 175.9632 89 N 5.1940 8.6035 120.1109 51.9464 38.8147 175.7169 90 F 4.1538 8.9002 120.5078 61.6471 39.1997 176.9295 91 E 3.7285 8.2660 116.2851 59.5635 29.2921 178.5647 92 D 4.2640 8.6358 120.1015 56.7455 40.8942 178.5396 93 A 3.9193 8.0936 121.3532 55.6635 18.3956 179.6788 94 M 3.8363 7.8583 117.2470 58.1653 31.8712 178.7222 95 E 3.8414 8.1481 119.6043 59.4203 29.7828 179.0535 96 S 4.1173 8.2198 115.3873 61.5802 62.7765 176.7825 97 I 3.6492 7.8205 122.4797 64.2881 36.8406 178.3870 98 K 3.9092 8.1492 120.4654 59.4903 31.8874 178.9445 99 S 4.0986 8.1362 115.3985 61.7823 62.7833 176.7362 100 Q 3.9764 8.2896 120.8114 58.8198 28.3594 178.9960 101 K 3.9338 8.3606 119.8164 59.5112 32.0994 178.9453 102 N 4.2883 8.4785 117.0682 56.3428 38.4210 176.8705 103 E 3.8936 8.3762 120.6747 59.5098 29.6939 178.9196 104 L 3.9835 8.3466 119.2447 57.6549 41.5854 179.3754 105 E 3.9175 8.8506 119.1069 59.5541 29.5020 179.1070 106 S 4.1021 8.6292 113.3476 62.0519 62.3648 176.4927 107 T 3.9119 8.1794 118.4546 66.3906 68.0920 176.5013 108 L 3.9840 8.0735 122.6239 57.9412 41.8018 178.8688 109 Q 3.9624 8.3870 118.4997 58.9794 28.6483 179.0468 110 K 3.9720 8.0632 119.1812 59.9400 32.2684 179.3186 111 M 4.1918 8.2674 118.9154 58.2241 31.5433 179.1016 112 G 3.6183 7.8623 105.2839 47.7779 0.0000 175.2330 113 E 4.0898 7.8529 120.9156 59.2870 29.4304 178.9047 114 N 4.1945 7.8916 115.9777 56.7585 38.7017 177.2211 115 L 3.9549 7.8783 120.9098 58.0080 42.0923 178.6574 116 R 3.8184 8.4724 120.3365 58.4218 29.9630 177.8867 117 A 3.8934 7.9296 119.8342 55.5359 18.3619 179.2319 118 I 3.3381 7.3694 118.0022 64.8778 37.0040 178.7789 119 T 3.8579 7.8308 110.2426 64.7995 68.4158 176.1500 120 D 4.3495 8.4280 122.2534 57.2651 40.8924 178.7970 121 I 3.7092 7.9358 113.7845 64.2367 37.5057 178.0563 122 M 4.1178 7.9084 120.5099 58.5387 31.5113 178.5188 123 M 4.1156 7.7252 117.9744 57.9547 32.1720 178.2164 124 K 4.2480 7.6150 116.4817 57.6914 32.8374 178.2854 125 L 4.3604 7.6282 118.7961 56.7412 42.0853 178.9021 126 S 4.1459 7.9443 114.9963 61.1348 62.9303 174.8570 127 P 4.3352 0.0000 0.0000 65.1895 30.9638 178.6241 128 Q 4.0918 7.9856 116.4705 58.6589 28.9276 177.9711 129 A 4.0863 7.9746 121.5065 54.9341 18.1476 179.4908 130 E 3.9969 8.3046 117.5054 59.2856 29.6582 178.8177 131 E 4.1303 7.8659 117.1230 58.3887 29.6669 178.9558 132 L 4.0821 7.8987 119.6639 57.3839 41.2440 178.9331 133 L 3.9541 7.8075 120.1761 58.0778 41.8070 178.9196 134 A 4.0543 7.6438 119.4858 54.4932 18.2785 179.3060 135 A 4.1133 7.2500 118.6621 55.2701 18.8145 180.0442 136 V 3.7138 7.6788 115.7553 63.8926 31.3691 176.0815 137 A 4.2732 7.5418 126.0185 52.2042 19.1426 175.3733 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 5 A 8.12 4.24 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 6 A 7.59 4.51 1.33 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 0.00 0.00 0.00 7 L 8.20 3.89 0.00 1.77 1.66 0.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 8 A 8.01 3.97 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 9 E 7.74 3.93 0.00 2.01 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 2.32 2.35 0.00 10 I 7.46 3.82 1.99 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 1.54 1.07 0.93 0.00 0.00 11 V 7.84 3.68 2.08 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 0.81 0.00 0.00 1.01 0.00 0.00 12 A 7.69 4.33 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 13 Q 7.72 3.79 0.00 1.96 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 1.79 1.80 0.00 14 L 8.03 4.35 0.00 1.77 1.74 0.95 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 15 N 7.73 4.54 0.00 2.87 2.82 0.00 0.00 6.67 7.86 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 16 I 7.17 3.94 1.72 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 -0.24 0.78 0.00 0.00 17 Y 7.65 4.78 0.00 3.05 2.91 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 18 Q 7.89 4.15 0.00 2.30 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.71 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 19 S 8.45 4.41 0.00 3.86 3.88 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 20 Q 7.66 4.54 0.00 2.32 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.70 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 21 V 7.83 3.58 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 0.98 0.00 0.00 1.06 0.00 0.00 22 E 7.69 4.30 0.00 1.88 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 2.34 2.48 0.00 23 L 7.84 3.99 0.00 1.76 1.82 0.93 1.12 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 24 I 7.63 3.93 2.00 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 1.53 0.64 0.91 0.00 0.00 25 Q 8.24 4.01 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 26 Q 7.86 3.95 0.00 2.22 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 27 Q 8.18 4.06 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.64 0.00 28 M 8.28 4.15 0.00 2.06 2.25 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.57 0.00 29 E 7.83 3.93 0.00 2.23 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 0.00 2.51 2.47 0.00 30 A 7.86 3.97 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 31 V 7.66 3.52 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 1.02 0.00 0.00 0.99 0.00 0.00 32 R 8.10 3.94 0.00 2.09 1.96 0.00 3.34 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 33 A 8.60 3.98 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 34 T 8.18 3.83 4.39 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 1.21 0.00 0.00 35 I 7.89 3.73 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.84 0.96 0.00 0.00 36 S 8.19 4.37 0.00 4.06 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 37 E 8.16 3.95 0.00 2.05 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 0.00 2.31 2.37 0.00 38 L 8.07 4.02 0.00 1.91 1.69 0.91 0.71 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 39 E 8.17 4.26 0.00 2.20 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 2.33 2.46 0.00 40 I 7.93 3.80 2.02 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 1.42 0.92 0.93 0.00 0.00 41 L 8.11 3.98 0.00 1.83 1.87 0.94 0.84 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 42 E 8.35 3.99 0.00 2.26 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 2.30 2.45 0.00 43 K 8.03 4.07 0.00 1.87 1.95 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.62 1.50 7.81 44 T 8.04 3.88 4.40 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 1.24 0.00 0.00 45 L 7.80 4.14 0.00 1.83 2.06 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 46 S 8.34 4.37 0.00 4.11 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 47 D 8.53 4.44 0.00 2.81 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 48 I 7.60 4.16 1.86 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 1.84 0.81 0.94 0.00 0.00 49 Q 7.31 3.98 0.00 1.91 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.77 0.00 0.00 0.00 0.00 0.00 1.70 1.16 0.00 50 G 8.82 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 0.00 0.00 0.00 51 K 7.86 4.51 0.00 1.83 1.76 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.57 1.61 7.81 52 D 8.11 4.51 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 53 G 8.88 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 0.00 0.00 0.00 54 S 8.16 4.45 0.00 3.84 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 55 E 8.63 4.73 0.00 1.85 1.87 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 2.31 2.30 0.00 56 T 8.90 4.76 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 57 L 8.51 5.21 0.00 1.48 1.61 0.75 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 58 V 8.90 4.56 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 1.00 0.00 0.00 0.97 0.00 0.00 59 P 0.00 3.90 0.00 1.84 1.80 0.00 3.81 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.02 0.00 60 V 8.53 4.17 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 0.67 0.00 0.00 0.90 0.00 0.00 61 G 9.04 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 62 A 9.50 3.88 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 63 G 8.08 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 64 S 7.61 5.01 0.00 3.87 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 65 F 8.81 5.42 0.00 2.82 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 66 I 8.64 4.68 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 1.25 1.35 0.93 0.00 0.00 67 K 8.51 5.01 0.00 1.68 1.78 0.00 1.81 0.00 0.00 1.92 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.39 7.81 68 A 8.43 4.63 1.21 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 0.00 0.00 0.00 69 E 8.48 5.00 0.00 1.83 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 2.37 2.30 0.00 70 L 8.89 4.20 0.00 1.73 1.59 0.92 0.50 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 71 K 8.21 4.67 0.00 1.70 1.61 0.00 1.93 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.45 7.81 72 D 8.71 4.40 0.00 2.85 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 73 T 8.38 3.90 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 1.26 0.00 0.00 74 S 7.92 4.97 0.00 4.06 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 75 E 8.25 5.39 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 2.25 2.23 0.00 76 V 8.70 4.51 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 0.99 0.00 0.00 0.95 0.00 0.00 77 I 8.51 4.54 1.88 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 1.35 0.56 0.92 0.00 0.00 78 M 9.00 4.78 0.00 1.90 1.92 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.44 0.00 79 S 8.75 4.63 0.00 3.88 3.77 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 80 V 9.03 4.21 2.08 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 0.74 0.00 0.00 1.00 0.00 0.00 81 G 7.54 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 0.00 0.00 0.00 82 A 9.28 3.82 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 83 G 8.49 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 84 V 7.78 4.56 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 1.03 0.00 0.00 0.97 0.00 0.00 85 A 8.51 5.23 1.18 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 86 I 8.87 4.58 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.79 0.91 0.00 0.00 87 K 8.74 4.65 0.00 1.78 1.72 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.48 7.81 88 K 9.17 4.89 0.00 1.67 1.63 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.51 7.81 89 N 8.60 5.19 0.00 3.02 3.00 0.00 0.00 5.67 8.12 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 90 F 8.90 4.15 0.00 3.15 3.16 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 91 E 8.27 3.73 0.00 2.21 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 0.00 2.42 2.61 0.00 92 D 8.64 4.26 0.00 2.98 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 93 A 8.09 3.92 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 94 M 7.86 3.84 0.00 1.75 1.69 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.65 0.00 95 E 8.15 3.84 0.00 2.09 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 2.27 2.31 0.00 96 S 8.22 4.12 0.00 3.98 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 97 I 7.82 3.65 1.95 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 1.38 0.81 0.89 0.00 0.00 98 K 8.15 3.91 0.00 1.91 1.77 0.00 1.51 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.51 7.81 99 S 8.14 4.10 0.00 4.06 3.88 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 0.00 100 Q 8.29 3.98 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 101 K 8.36 3.93 0.00 1.91 1.85 0.00 1.67 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.70 7.81 102 N 8.48 4.29 0.00 2.92 2.87 0.00 0.00 6.70 7.30 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 0.00 103 E 8.38 3.89 0.00 2.16 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 2.30 2.35 0.00 104 L 8.35 3.98 0.00 1.83 1.70 0.92 0.90 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 0.00 105 E 8.85 3.92 0.00 2.11 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 2.53 2.46 0.00 106 S 8.63 4.10 0.00 3.83 4.13 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 0.00 0.00 0.00 0.00 107 T 8.18 3.91 4.41 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 1.21 0.00 0.00 108 L 8.07 3.98 0.00 1.97 1.80 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 109 Q 8.39 3.96 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 110 K 8.06 3.97 0.00 1.95 1.85 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.61 7.81 111 M 8.27 4.19 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.56 0.00 112 G 7.86 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 0.00 0.00 0.00 113 E 7.85 4.09 0.00 2.14 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 2.47 2.49 0.00 114 N 7.89 4.19 0.00 2.85 2.89 0.00 0.00 6.77 8.04 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 0.00 115 L 7.88 3.95 0.00 1.79 1.83 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 116 R 8.47 3.82 0.00 2.03 2.00 0.00 3.21 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.49 0.00 117 A 7.93 3.89 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 0.00 118 I 7.37 3.34 1.93 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.87 0.77 0.00 0.00 119 T 7.83 3.86 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 1.22 0.00 0.00 120 D 8.43 4.35 0.00 2.87 2.71 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 0.00 0.00 0.00 0.00 121 I 7.94 3.71 1.77 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.36 0.87 0.00 0.00 122 M 7.91 4.12 0.00 2.13 2.30 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.66 0.00 123 M 7.73 4.12 0.00 2.01 2.34 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.86 0.00 124 K 7.62 4.25 0.00 1.82 1.86 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.46 7.81 125 L 7.63 4.36 0.00 1.74 1.75 1.10 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 126 S 7.94 4.15 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 0.00 127 P 0.00 4.34 0.00 2.16 2.11 0.00 3.57 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 128 Q 7.99 4.09 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.67 0.00 129 A 7.97 4.09 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 0.00 130 E 8.30 4.00 0.00 2.01 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 2.53 2.49 0.00 131 E 7.87 4.13 0.00 2.13 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 2.32 2.52 0.00 132 L 7.90 4.08 0.00 1.71 1.71 0.92 0.47 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 0.00 133 L 7.81 3.95 0.00 1.82 1.85 0.92 1.39 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 0.00 134 A 7.64 4.05 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 0.00 135 A 7.25 4.11 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 0.00 136 V 7.68 3.71 2.08 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 0.84 0.00 0.00 0.93 0.00 0.00 137 A 7.54 4.27 1.22 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 0.00 0.00