NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 4.4804 8.0385 120.6276 54.6127 43.5097 177.9136 23 A 3.7781 7.9796 124.1660 55.1463 18.7577 177.7744 24 D 4.3059 9.0262 118.1460 57.4979 41.3853 177.2075 25 S 4.1714 8.8391 116.0677 61.8446 62.9171 177.0575 26 K 3.9862 8.1082 120.6486 59.3794 31.7691 179.3203 27 A 4.0283 8.0406 121.3319 55.1581 18.3704 180.0914 28 V 3.7544 8.3275 117.9992 64.5528 31.5409 178.7402 29 L 4.2597 8.1928 120.0296 57.8922 41.5083 178.9040 30 N 4.3074 8.3732 117.0530 56.4713 38.7418 176.6064 31 Q 4.2543 8.3799 120.9643 59.3840 29.1044 178.3040 32 A 4.2631 8.4262 121.7256 55.1303 18.5366 179.6758 33 V 3.5397 7.9841 116.6756 66.1042 31.6383 178.2041 34 A 4.1260 8.4229 120.3475 55.5226 18.3509 179.4192 35 D 4.4031 8.6757 117.8765 57.5700 40.9131 179.1012 36 L 4.2509 8.7696 120.0616 57.8367 41.4496 179.7697 37 S 3.9712 7.8116 114.8979 61.3051 62.5252 176.8729 38 V 3.6281 7.8137 120.7738 65.8190 31.2425 177.8306 39 A 4.0108 8.5035 121.0312 55.5608 18.1375 179.1330 40 H 4.0483 8.3523 116.7066 59.3612 29.9647 177.4758 41 S 4.1202 7.8406 115.1488 61.4447 62.2230 176.2441 42 I 3.7270 8.0283 122.6708 64.3879 36.7980 178.3628 43 L 3.9722 8.1744 120.1134 58.1110 41.3426 179.1193 44 H 3.6820 8.1930 118.1764 58.8453 29.5904 177.0863 45 Q 4.2924 8.0094 121.4194 59.3996 28.8411 178.3799 46 V 3.6791 7.9416 119.2541 66.2446 31.2723 177.2618 47 H 4.1369 8.0952 116.9432 59.2812 29.7658 177.0247 48 W 4.6665 8.3305 119.3433 59.9458 29.2053 177.6198 49 Y 4.1954 8.7675 114.9992 57.5780 37.7391 175.3164 50 M 4.3610 7.5083 120.5858 56.1765 32.9385 175.6706 51 R 4.5427 8.5160 122.7605 55.3056 34.6571 173.9355 52 G 4.2029 8.8646 107.1841 42.7923 0.0000 172.9646 53 R 4.2602 8.2413 119.8692 56.9714 30.2966 176.9708 54 G 4.1875 9.5542 109.8851 45.6257 0.0000 175.1402 55 F 4.1333 8.6667 122.5754 62.0018 39.0784 176.6946 56 M 4.1658 8.3785 115.3879 58.2496 31.8896 177.3344 57 I 3.7576 7.4888 117.9587 63.2855 38.6269 177.5320 58 W 4.0628 8.2873 119.8945 59.2291 28.6435 178.1213 59 H 3.9345 8.0966 118.2708 58.9457 29.6262 175.3399 60 P 4.2319 0.0000 0.0000 65.1511 31.0758 178.5044 61 K 3.5583 7.3998 118.4683 59.6230 31.9001 178.7632 62 M 4.0335 7.9990 118.9029 58.2418 31.7827 178.2280 63 D 4.0651 7.7169 118.1735 57.0306 41.3069 178.1562 64 E 3.8890 7.7106 118.7814 59.5459 29.4751 178.6912 65 Y 4.5125 7.9732 116.9381 61.5189 37.9003 178.5410 66 M 4.0596 8.3739 119.8181 58.4545 31.9216 178.7018 67 E 3.9644 8.1850 118.7653 59.2777 29.5776 179.0256 68 E 3.6747 8.2355 119.4209 59.1585 29.6504 178.8937 69 I 3.8540 8.0015 119.9820 64.5764 37.2023 177.9830 70 D 4.4256 8.5741 120.2460 57.3798 40.6563 179.2603 71 G 3.4099 8.0206 106.1705 48.0437 0.0000 175.3854 72 Y 4.3123 7.5501 119.4690 60.6206 37.8279 178.4354 73 L 3.9757 8.2461 121.5057 58.0770 42.1507 178.8147 74 D 4.3121 8.1130 118.8195 57.4220 40.8252 178.4929 75 E 3.9056 8.1432 118.8727 59.8334 29.5089 179.5530 76 M 3.9309 8.2216 119.0175 58.1747 31.9736 179.0333 77 S 4.1287 8.1793 114.4922 61.5442 63.1429 176.3906 78 E 3.9125 8.1777 122.4585 58.9996 29.2014 179.3223 79 R 3.8353 7.9571 118.7677 59.1847 30.0193 178.2876 80 L 3.9277 8.0073 120.1506 58.2816 42.1277 179.0590 81 I 3.8444 7.9407 119.8237 64.7912 36.8030 178.6003 82 T 3.9262 7.9804 115.9463 66.2680 68.3363 175.8180 83 L 4.3477 7.7220 118.3010 54.9260 41.9069 177.6657 84 G 3.8703 8.0989 107.9788 45.0994 0.0000 174.0003 85 G 3.7635 7.8644 109.0487 44.1995 0.0000 173.3437 86 A 4.4929 7.9965 121.1689 49.1950 20.2907 174.1972 87 P 4.5202 0.0000 0.0000 62.8345 32.2591 176.7228 88 F 4.5762 8.5285 120.5674 58.6718 39.3479 176.3925 89 S 4.8676 8.7220 120.0206 56.0691 63.2543 174.6337 90 T 4.4910 6.7128 109.5157 60.1150 72.9674 173.2825 91 L 3.9958 8.2739 122.5063 57.6621 41.6846 179.6947 92 K 3.8235 7.8215 119.1134 59.6325 32.2104 178.4400 93 E 3.7142 7.7796 118.6449 59.2524 29.3393 179.3422 94 F 4.3962 7.5749 117.6210 60.7502 38.8300 177.5845 95 S 4.1203 8.0704 111.2296 61.6976 62.3198 175.9006 96 E 4.0601 8.0861 119.7134 58.9450 29.2233 178.3547 97 N 4.5061 7.7764 115.1604 53.6861 39.3945 175.8397 98 S 4.4780 7.4937 114.7561 58.4275 62.9349 173.7852 99 Q 4.3068 8.7839 124.4360 56.0084 29.0472 176.0158 100 L 4.1105 7.6505 121.3788 54.0822 42.7281 176.7814 101 K 4.5986 8.2543 123.1165 52.7259 34.3630 174.7497 102 E 4.8008 8.4802 121.8686 54.0895 31.9474 175.6074 103 V 4.5401 7.7105 112.7722 59.0269 35.7660 175.6613 104 L 3.9801 8.3661 121.4020 54.6569 41.9899 177.9511 105 G 2.5203 7.9706 110.9775 45.5595 0.0000 172.8919 106 D 4.3066 7.1565 120.1439 53.0333 43.3344 175.6896 107 Y 4.8346 8.6410 124.2008 59.7861 38.0883 176.5534 108 N 4.6780 8.2855 116.2601 53.8074 39.1642 175.7653 109 V 3.8185 7.2910 119.5777 62.6838 32.3157 176.4154 110 T 4.2830 9.1849 118.0244 61.1240 70.8847 175.9308 111 I 3.7068 8.2288 122.1645 64.8579 37.1893 178.6497 112 E 3.8834 8.0835 118.5296 59.1116 29.1907 179.1292 113 E 3.9606 8.0340 118.9942 59.1195 29.5475 179.1120 114 Q 3.9272 8.0888 118.1060 59.1175 28.7847 179.0110 115 L 3.7173 7.8398 119.6046 57.5756 41.5268 179.4867 116 A 3.8549 7.8209 120.7909 54.9766 18.2615 179.6416 117 R 3.7521 8.0241 117.5134 59.5453 30.0950 178.9783 118 V 3.2771 7.5865 118.0600 65.6831 31.3687 178.1359 119 V 3.4051 7.7010 118.1750 66.0146 31.3356 177.8827 120 E 3.9821 8.1132 118.3061 59.3375 29.2825 179.5238 121 V 3.6531 7.7106 118.2817 66.1505 31.5433 178.1844 122 F 4.4127 8.4732 117.6782 60.6548 38.6800 177.9455 123 R 3.9285 8.6042 118.3390 59.1506 29.7271 178.4626 124 Y 3.9035 8.0660 119.4001 60.7090 38.8795 178.0809 125 L 3.3111 8.0172 119.6134 57.5033 41.6203 179.3714 126 A 3.8292 7.9274 120.5914 54.9293 18.2253 179.6195 127 A 3.7647 7.5624 119.2819 55.1226 18.3955 179.5950 128 L 3.6359 7.4677 119.1577 58.2750 41.9760 179.2864 129 F 4.5993 8.2332 118.1497 60.4598 38.6984 177.5372 130 Q 3.9283 8.0092 119.5073 59.0085 28.7993 178.3183 131 K 3.9875 8.1535 119.7610 59.4044 32.0804 179.5369 132 G 2.3509 7.9443 106.3442 47.0834 0.0000 175.4935 133 F 4.0620 8.1149 123.1496 61.1746 39.4982 176.8879 134 D 4.4568 8.4967 118.7354 57.4178 40.6949 178.9756 135 V 3.5539 8.0358 119.1631 66.1033 31.6805 178.1816 136 S 4.3913 8.0174 115.3030 60.9251 62.7593 175.8769 137 D 4.1731 8.2492 124.2703 57.6994 40.7247 178.7624 138 E 4.0107 7.9535 117.6396 60.9657 29.8580 179.9896 139 E 4.4943 8.1414 116.5161 56.0404 29.7195 177.4680 140 G 3.8231 7.5607 107.0478 46.7818 0.0000 175.1257 141 D 4.6103 8.0260 122.2115 52.4427 39.2666 176.4957 142 S 4.0458 8.0678 120.0236 60.6628 63.3127 176.7478 143 V 3.4907 7.6421 121.4329 66.1925 31.4326 177.9274 144 T 3.7389 7.8608 115.0871 66.5668 68.2879 175.9191 145 N 4.6410 8.1784 120.3005 56.2771 38.8586 176.3963 146 D 4.3860 8.0803 119.2500 57.1518 41.3423 178.1071 147 I 3.5434 7.5906 120.4129 64.5258 37.0652 178.3850 148 F 3.8736 7.8027 118.3990 60.3669 38.6886 177.3019 149 N 4.3872 8.4769 116.7957 56.7788 38.9562 177.1928 150 V 3.5882 8.0137 119.5275 65.8627 31.6194 177.9041 151 A 3.3758 7.6415 120.4854 54.5596 17.8734 179.5556 152 K 4.0424 8.1998 118.0939 59.5418 32.2812 178.6126 153 A 4.0049 8.0671 121.3920 55.4557 18.2644 179.8631 154 S 4.1098 7.9787 112.0513 61.7412 63.2104 176.6543 155 I 3.6077 7.9143 123.5625 64.0584 36.8756 178.3048 156 E 4.0908 8.5501 119.7648 59.0716 29.3579 179.2460 157 K 4.2898 7.9571 119.5974 59.9150 32.2687 178.6232 158 H 4.4510 8.3359 116.6090 58.9964 28.5233 177.8060 159 I 3.8896 7.9787 121.7602 64.0085 36.9341 178.2494 160 W 4.3084 8.3401 128.9249 60.8454 30.6053 177.9306 161 M 3.3412 7.7081 118.1909 58.1335 31.4838 178.6982 162 L 4.0241 8.3840 119.4331 58.0324 41.8170 179.6871 163 Q 3.9792 8.4126 117.8531 58.7830 28.6298 178.5377 164 A 4.0449 8.5129 122.1702 55.3876 18.2016 179.2147 165 E 4.0657 8.1071 116.3047 59.2663 29.7232 178.0897 166 L 4.4268 7.5188 115.9986 53.9537 41.7237 176.9429 167 G 3.9426 8.3272 106.9265 46.6189 0.0000 173.6003 168 Q 4.6379 8.2474 117.1532 53.1949 32.2501 175.1691 169 A 4.4904 8.2356 121.9096 50.9221 19.5369 176.0319 170 P 4.4008 0.0000 0.0000 64.5314 31.7362 177.6520 171 K 3.8369 8.1081 114.7125 57.1924 29.5945 174.9461 172 L 4.1785 7.9027 121.6200 55.2250 41.4908 177.7037 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 22 L 8.04 4.48 0.00 1.72 1.72 0.98 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.98 3.78 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 24 D 9.03 4.31 0.00 2.81 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 25 S 8.84 4.17 0.00 3.99 3.97 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 K 8.11 3.99 0.00 1.97 1.84 0.00 1.65 0.00 0.00 1.79 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.67 7.81 27 A 8.04 4.03 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 0.00 0.00 0.00 0.00 0.00 28 V 8.33 3.75 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.80 0.00 0.00 29 L 8.19 4.26 0.00 1.98 1.79 0.92 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.37 4.31 0.00 2.82 2.59 0.00 0.00 6.88 6.51 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 31 Q 8.38 4.25 0.00 2.48 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.48 2.76 0.00 32 A 8.43 4.26 1.73 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 33 V 7.98 3.54 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 1.23 0.00 0.00 1.07 0.00 0.00 34 A 8.42 4.13 1.53 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 0.00 0.00 0.00 35 D 8.68 4.40 0.00 2.88 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.77 4.25 0.00 1.79 1.79 1.13 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.81 3.97 0.00 3.43 3.27 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 38 V 7.81 3.63 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 1.08 0.00 0.00 1.00 0.00 0.00 39 A 8.50 4.01 1.49 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 40 H 8.35 4.05 0.00 3.43 3.47 0.00 5.79 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 41 S 7.84 4.12 0.00 3.95 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 42 I 8.03 3.73 2.02 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.61 0.88 0.00 0.00 43 L 8.17 3.97 0.00 1.77 1.69 1.12 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 44 H 8.19 3.68 0.00 3.06 2.74 0.00 5.59 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.01 4.29 0.00 2.27 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 46 V 7.94 3.68 2.26 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 0.97 0.00 0.00 1.04 0.00 0.00 47 H 8.10 4.14 0.00 3.07 3.26 0.00 6.00 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 48 W 8.33 4.67 0.00 3.67 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 49 Y 8.77 4.20 0.00 3.15 2.86 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 50 M 7.51 4.36 0.00 2.30 2.39 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.96 0.00 51 R 8.52 4.54 0.00 1.92 1.80 0.00 3.32 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.78 0.00 52 G 8.86 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 0.00 0.00 0.00 53 R 8.24 4.26 0.00 1.87 1.96 0.00 3.39 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 54 G 9.55 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 0.00 0.00 0.00 55 F 8.67 4.13 0.00 3.39 3.14 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 56 M 8.38 4.17 0.00 2.07 2.22 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 2.58 2.70 0.00 57 I 7.49 3.76 1.65 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 0.96 -0.02 0.82 0.00 0.00 58 W 8.29 4.06 0.00 3.49 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 59 H 8.10 3.93 0.00 1.73 2.65 0.00 5.95 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 60 P 0.00 4.23 0.00 2.02 1.97 0.00 3.56 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.06 0.00 61 K 7.40 3.56 0.00 1.45 1.77 0.00 0.97 0.00 0.00 1.02 0.00 0.00 2.59 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.96 0.52 7.81 62 M 8.00 4.03 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.98 0.00 63 D 7.72 4.07 0.00 2.59 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 64 E 7.71 3.89 0.00 1.97 1.89 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 2.30 2.24 0.00 65 Y 7.97 4.51 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 66 M 8.37 4.06 0.00 1.88 2.08 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.16 0.00 67 E 8.19 3.96 0.00 2.15 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 2.46 2.42 0.00 68 E 8.24 3.67 0.00 2.09 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 0.00 2.05 2.04 0.00 69 I 8.00 3.85 2.14 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 1.88 0.84 1.05 0.00 0.00 70 D 8.57 4.43 0.00 2.91 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 71 G 8.02 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 0.00 0.00 0.00 72 Y 7.55 4.31 0.00 3.20 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 73 L 8.25 3.98 0.00 1.76 1.88 0.90 1.09 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 74 D 8.11 4.31 0.00 2.87 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 75 E 8.14 3.91 0.00 2.13 1.90 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 2.29 2.45 0.00 76 M 8.22 3.93 0.00 1.97 2.14 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 1.98 0.00 77 S 8.18 4.13 0.00 4.08 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 0.00 78 E 8.18 3.91 0.00 2.10 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 2.32 2.39 0.00 79 R 7.96 3.84 0.00 1.94 1.97 0.00 3.10 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 80 L 8.01 3.93 0.00 1.86 1.83 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.94 3.84 2.00 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 0.87 0.90 0.00 0.00 82 T 7.98 3.93 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 1.19 0.00 0.00 83 L 7.72 4.35 0.00 1.76 1.69 0.96 0.86 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 84 G 8.10 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 85 G 7.86 3.76 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 0.00 0.00 0.00 86 A 8.00 4.49 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 87 P 0.00 4.52 0.00 2.26 2.06 0.00 3.78 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 88 F 8.53 4.58 0.00 3.47 3.04 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 89 S 8.72 4.87 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 90 T 6.71 4.49 4.09 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 1.18 0.00 0.00 91 L 8.27 4.00 0.00 1.70 1.81 1.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 92 K 7.82 3.82 0.00 1.76 1.71 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.49 7.81 93 E 7.78 3.71 0.00 1.89 1.60 0.00 0.00 0.00 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 2.25 0.00 94 F 7.57 4.40 0.00 3.22 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.07 4.12 0.00 3.89 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 96 E 8.09 4.06 0.00 1.94 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 2.31 2.41 0.00 97 N 7.78 4.51 0.00 2.35 2.69 0.00 0.00 6.97 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 98 S 7.49 4.48 0.00 4.08 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 99 Q 8.78 4.31 0.00 1.89 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.56 0.00 0.00 0.00 0.00 0.00 2.42 2.66 0.00 100 L 7.65 4.11 0.00 1.50 1.44 0.94 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.25 4.60 0.00 1.74 1.55 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.25 0.99 7.81 102 E 8.48 4.80 0.00 1.92 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 2.29 0.00 103 V 7.71 4.54 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 0.70 0.00 0.00 0.85 0.00 0.00 104 L 8.37 3.98 0.00 1.54 1.50 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 105 G 7.97 2.52 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 0.00 106 D 7.16 4.31 0.00 2.57 2.35 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 0.00 107 Y 8.64 4.83 0.00 3.12 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.29 4.68 0.00 3.03 2.90 0.00 0.00 6.90 7.70 0.00 0.00 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 V 7.29 3.82 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 0.82 0.00 0.00 0.98 0.00 0.00 110 T 9.18 4.28 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 0.00 111 I 8.23 3.71 1.89 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.12 0.86 0.00 0.00 112 E 8.08 3.88 0.00 1.97 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 2.31 2.34 0.00 113 E 8.03 3.96 0.00 2.16 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 2.30 2.32 0.00 114 Q 8.09 3.93 0.00 2.23 2.12 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 2.63 2.61 0.00 115 L 7.84 3.72 0.00 1.36 1.26 -0.34 -0.18 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 0.00 116 A 7.82 3.85 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 0.00 117 R 8.02 3.75 0.00 1.85 2.10 0.00 3.09 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 118 V 7.59 3.28 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 0.04 0.00 0.00 0.86 0.00 0.00 119 V 7.70 3.41 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 1.02 0.00 0.00 0.83 0.00 0.00 120 E 8.11 3.98 0.00 2.15 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 2.30 2.43 0.00 121 V 7.71 3.65 2.22 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 1.19 0.00 0.00 0.95 0.00 0.00 122 F 8.47 4.41 0.00 3.15 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 0.00 123 R 8.60 3.93 0.00 2.00 1.99 0.00 3.31 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.91 0.00 124 Y 8.07 3.90 0.00 3.11 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 0.00 125 L 8.02 3.31 0.00 1.52 0.77 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 126 A 7.93 3.83 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 0.00 127 A 7.56 3.76 1.20 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 0.00 0.00 128 L 7.47 3.64 0.00 1.06 1.29 0.90 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.23 4.60 0.00 3.11 3.23 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 0.00 130 Q 8.01 3.93 0.00 2.11 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 131 K 8.15 3.99 0.00 1.88 1.73 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.49 7.81 132 G 7.94 2.35 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 0.00 133 F 8.11 4.06 0.00 3.29 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 0.00 134 D 8.50 4.46 0.00 2.88 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 0.00 135 V 8.04 3.55 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 1.05 0.00 0.00 0.95 0.00 0.00 136 S 8.02 4.39 0.00 4.27 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 0.00 137 D 8.25 4.17 0.00 2.52 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 0.00 138 E 7.95 4.01 0.00 2.12 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 2.26 2.22 0.00 139 E 8.14 4.49 0.00 1.92 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 0.00 140 G 7.56 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 0.00 0.00 0.00 141 D 8.03 4.61 0.00 2.68 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 0.00 142 S 8.07 4.05 0.00 4.04 4.06 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 0.00 143 V 7.64 3.49 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.86 3.74 4.43 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 1.35 0.00 0.00 145 N 8.18 4.64 0.00 2.64 2.85 0.00 0.00 6.41 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 0.00 146 D 8.08 4.39 0.00 2.76 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 0.00 147 I 7.59 3.54 1.66 0.00 0.00 0.70 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 0.91 0.48 0.00 0.00 148 F 7.80 3.87 0.00 3.38 3.29 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 0.00 149 N 8.48 4.39 0.00 3.33 3.04 0.00 0.00 6.84 7.52 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 0.00 150 V 8.01 3.59 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 1.00 0.00 0.00 0.98 0.00 0.00 151 A 7.64 3.38 0.02 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 0.00 0.00 152 K 8.20 4.04 0.00 2.08 2.01 0.00 1.66 0.00 0.00 1.59 0.00 0.00 3.05 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.48 7.81 153 A 8.07 4.00 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 0.00 154 S 7.98 4.11 0.00 4.30 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 0.00 155 I 7.91 3.61 1.95 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.64 0.76 0.00 0.00 156 E 8.55 4.09 0.00 2.23 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 2.34 2.42 0.00 157 K 7.96 4.29 0.00 1.93 2.03 0.00 1.76 0.00 0.00 1.91 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.78 1.97 7.81 158 H 8.34 4.45 0.00 3.50 3.46 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 7.98 3.89 2.18 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 1.59 1.06 1.00 0.00 0.00 160 W 8.34 4.31 0.00 3.42 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 M 7.71 3.34 0.00 1.97 2.16 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.16 0.00 162 L 8.38 4.02 0.00 1.72 1.60 0.67 0.62 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 0.00 163 Q 8.41 3.98 0.00 2.36 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.51 2.59 0.00 164 A 8.51 4.04 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 0.00 165 E 8.11 4.07 0.00 2.21 2.24 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 2.35 2.42 0.00 166 L 7.52 4.43 0.00 1.79 1.63 0.80 0.62 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 0.00 167 G 8.33 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 0.00 168 Q 8.25 4.64 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 169 A 8.24 4.49 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 0.00 170 P 0.00 4.40 0.00 2.11 2.27 0.00 3.89 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.39 0.00 171 K 8.11 3.84 0.00 1.89 1.86 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.65 7.81 172 L 7.90 4.18 0.00 1.63 1.58 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00