NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5199 8.3044 120.2865 55.2950 33.8818 174.1505 3 V 4.0396 8.0906 121.9109 59.7048 32.7244 173.2192 4 W 4.5645 9.0787 135.0000 57.3105 31.7338 174.8894 5 T 3.9700 8.0230 122.1546 61.5523 67.1627 172.2479 6 P 4.6173 0.0000 0.0000 62.8421 32.2968 175.3578 7 V 4.0451 7.3931 119.7333 62.8297 33.0403 175.3236 8 N 4.2830 8.6119 124.8049 54.9996 36.0870 173.7113 9 N 4.9562 7.6071 108.6122 52.8013 40.1432 174.1920 10 K 4.0907 8.3232 116.0605 56.6887 32.7537 176.4821 11 M 4.9834 8.4137 120.6250 53.8702 35.4369 175.2679 12 F 4.5420 8.0349 115.8018 57.2247 40.7457 175.9388 13 E 3.5334 8.0533 121.8755 56.9874 28.0110 174.6194 14 T 3.7034 8.3872 119.2590 66.5582 68.7309 173.9755 15 F 4.5067 9.0962 124.1650 57.6348 36.8178 176.6659 16 S 4.4269 8.4132 115.0885 60.6409 62.9062 174.5486 17 Y 4.4231 8.3042 117.0855 57.9829 38.1186 175.0351 18 L 4.7058 7.5575 120.4580 52.2397 43.6692 174.5114 19 P 4.5031 0.0000 0.0000 61.5586 31.8370 174.9670 20 P 4.2267 0.0000 0.0000 63.0124 31.6304 176.5548 21 L 4.1767 8.4059 123.5096 54.7380 42.1470 177.9313 22 S 4.4900 8.9993 119.1890 57.6866 65.3669 175.1739 23 D 4.3482 8.4960 121.4758 57.3874 40.4154 178.7265 24 E 3.9104 8.0625 119.3899 59.4063 29.8501 178.7491 25 Q 3.8967 8.0265 118.1127 58.9154 28.7147 178.8349 26 I 3.6894 8.1196 121.0073 64.3577 37.1572 178.3144 27 A 4.0614 8.4144 121.7371 55.1243 18.2938 179.5239 28 A 4.1123 8.1487 119.4060 55.5012 18.4169 179.9430 29 Q 4.1321 8.0265 116.4602 59.0509 28.8044 179.0531 30 V 3.7775 8.0168 119.5010 66.1279 31.5926 177.8305 31 D 4.4416 8.4644 118.8165 57.3638 40.5953 178.1153 32 Y 4.2181 8.0204 119.7400 60.7628 38.8398 178.0693 33 I 3.9252 7.9947 120.6874 64.6480 37.3293 178.5915 34 V 3.5309 7.9302 118.5594 66.0163 31.1789 177.9084 35 A 3.9623 8.2685 119.5714 54.4965 18.2411 178.3019 36 N 4.1231 7.1784 112.0160 52.0550 38.7333 175.5737 37 G 3.7458 7.3555 108.3132 46.1449 0.0000 174.0675 38 W 4.9988 7.5465 118.8750 55.8070 30.9071 176.3084 39 I 4.3588 8.9240 123.1487 59.6030 37.7892 174.1303 40 P 4.8424 0.0000 0.0000 62.9520 32.7810 175.1877 41 C 4.9333 8.6259 120.1714 58.6402 35.6559 172.4680 42 L 5.2966 8.6289 124.5554 53.2712 44.4944 175.1678 43 E 5.6391 9.0272 120.4742 54.9985 34.3000 174.4498 44 F 5.6115 9.2906 116.5977 56.0135 42.2571 172.8126 45 A 4.3707 8.0811 118.5350 50.6571 22.6266 176.2675 46 E 4.4031 8.3938 118.1708 55.6492 31.1816 177.9731 47 S 4.4294 9.0207 116.3148 62.3311 62.8596 177.0648 48 D 4.5795 8.1995 116.8883 56.2787 40.6458 177.1754 49 K 4.6156 8.0333 117.4682 56.0139 32.7310 177.0237 50 A 3.8974 7.9580 124.5930 54.4140 18.4402 178.3693 51 Y 4.6767 7.5007 111.1078 55.6451 40.4208 176.1039 52 V 4.4565 8.4744 115.3932 61.5923 32.2608 175.5243 53 S 4.7446 8.3562 115.6926 57.6457 66.2535 173.7933 54 N 5.1143 8.6023 114.2044 52.6721 39.5761 176.1719 55 E 3.9269 8.5480 119.7349 60.2081 29.1440 179.4772 56 S 4.0101 8.8103 115.5418 60.5476 62.8214 176.1593 57 A 2.5897 7.6788 123.3838 53.9763 17.7248 179.1852 58 I 3.6012 7.0671 116.1278 63.5150 38.0825 177.1441 59 R 4.3110 7.5490 116.5485 55.6290 30.4809 176.2878 60 F 4.9850 7.2622 118.1213 56.3144 41.1546 176.5106 61 G 4.0801 8.1557 114.1016 45.9541 0.0000 175.4126 62 S 4.6215 8.4061 113.7701 58.2996 61.9837 174.3105 63 V 4.4905 7.1115 106.8899 61.1898 33.2279 177.6060 64 S 4.4865 8.2624 114.6322 59.4049 63.6770 173.3724 65 C 3.8998 8.0994 118.8464 61.6415 27.9546 173.2951 66 L 3.4903 8.4630 123.5656 55.6584 38.9618 173.2944 67 Y 4.4027 7.4572 118.7549 55.7760 40.6391 174.4909 68 Y 4.9194 7.0137 122.9153 56.7514 42.3642 174.4679 69 D 4.5347 9.1000 124.0295 55.0638 41.9063 176.9420 70 N 4.4641 8.8555 116.1103 54.2010 35.9169 175.9477 71 R 4.0233 7.9334 119.0000 59.0238 30.5190 177.0251 72 Y 4.4559 7.7135 114.4141 57.6221 38.5875 174.4636 73 W 5.1259 8.6666 122.9168 55.2888 33.2375 174.1998 74 T 4.3310 8.2470 117.2442 62.5832 69.4696 174.6089 75 M 4.7163 8.5817 126.5951 55.3038 33.2587 175.1666 76 W 4.8566 9.5441 135.0000 55.9480 31.3993 176.9425 77 K 3.4394 8.5614 128.8973 57.4567 30.6355 178.2422 78 L 4.9174 8.2710 125.0721 52.7548 45.4016 173.8912 79 P 4.3181 0.0000 0.0000 63.2715 32.3084 177.7840 80 M 4.3395 8.7902 123.5195 53.9084 30.3240 175.7838 81 F 4.5124 7.3749 118.4291 58.8813 40.0108 176.6249 82 G 4.0034 9.1424 112.6151 45.5021 0.0000 173.2036 83 C 4.2246 7.8509 120.4712 59.8703 31.7732 173.2255 84 R 4.5502 8.6271 123.3789 55.4588 31.5722 174.3519 85 D 4.8115 7.8648 118.5434 51.1784 42.8245 174.2640 86 P 4.3323 0.0000 0.0000 66.4815 31.0093 178.1367 87 M 4.1084 8.4680 118.2816 58.2572 31.9231 178.5848 88 Q 4.0438 8.1157 118.3512 58.9550 28.8914 179.1739 89 V 3.6294 7.7201 118.6609 66.0719 31.7070 177.9116 90 L 4.0486 7.9517 118.7374 57.9099 41.3079 179.8232 91 R 3.9981 8.1881 118.1062 59.1900 30.0095 178.8995 92 E 4.0986 8.2158 118.1532 59.3226 29.4054 179.3645 93 I 3.5366 7.7850 120.0364 64.2333 37.1547 178.6233 94 V 3.4628 7.5026 118.3946 65.8854 31.3802 177.9574 95 A 3.9609 8.1223 120.8481 55.1625 18.2259 179.2092 96 C 2.0000 7.8675 117.5775 62.0208 31.1490 176.0106 97 T 3.7052 7.5517 111.2033 64.3096 67.9766 176.4312 98 K 3.8827 7.6438 121.8982 59.3005 32.3136 178.4331 99 A 4.0121 7.6011 120.0598 53.5574 19.7214 177.6552 100 F 4.6688 7.8765 115.6744 54.9415 39.2274 173.8292 101 P 4.4020 0.0000 0.0000 64.1179 31.8053 177.8663 102 D 4.7028 8.0910 116.8540 53.8274 41.3018 175.1806 103 A 4.8110 7.3656 121.0795 50.1590 21.9663 176.5351 104 Y 4.2290 8.7173 117.5642 57.7271 39.4523 175.3158 105 V 5.3374 8.8132 122.7988 61.2428 35.5142 174.2684 106 R 5.0042 9.2663 123.0565 54.3125 33.2236 173.5308 107 L 4.7325 8.3345 123.4572 53.7222 44.1112 175.6639 108 V 4.8855 8.5911 118.1403 59.6013 36.5520 174.0767 109 A 4.9418 7.9439 121.9239 50.6510 22.7826 175.3182 110 F 5.2755 9.0443 119.7237 55.6852 42.8640 174.2458 111 D 5.4713 8.7560 121.7823 52.5986 42.7720 176.3309 112 N 4.7477 9.2007 123.0993 54.1514 38.2217 176.2555 113 Q 4.1892 9.1453 119.0509 58.8847 29.0526 177.3584 114 K 4.1365 8.3197 113.6457 56.2982 32.9345 176.5369 115 Q 3.4165 7.6613 118.0041 55.4434 27.4087 172.4972 116 V 4.3440 6.8288 116.9049 60.2403 34.1352 173.0485 117 Q 4.5342 8.8140 123.2746 56.3879 29.3112 175.6826 118 I 4.2081 7.6190 118.0842 60.3084 38.3900 174.6537 119 M 4.1736 6.7296 119.1864 54.5337 33.6477 173.9189 120 G 4.8868 8.3492 111.0775 47.6541 0.0000 171.6885 121 F 5.0452 6.9667 115.1874 55.2961 41.1813 172.7883 122 L 4.5272 8.7930 122.4997 55.4959 42.0838 176.7808 123 V 4.5131 8.9953 117.9623 61.3731 34.0340 175.6093 124 Q 4.4742 7.6477 121.0330 54.6391 32.4552 172.8221 125 R 4.2094 8.0334 125.3834 53.2380 33.2795 173.1796 126 P 4.1450 0.0000 0.0000 62.4130 31.8964 177.6948 127 K 4.0630 8.5299 121.6097 59.7148 32.6458 178.0860 128 S 4.3126 7.9705 111.7747 59.0120 63.5523 174.1844 129 A 4.3084 7.7677 125.6724 52.9385 18.4254 177.4702 130 R 4.7887 8.7230 120.7071 56.1175 32.0038 175.2548 131 D 4.9501 8.6973 115.8296 52.5907 39.6674 175.2171 132 W 5.6350 7.8736 114.6768 53.9869 31.4335 174.0209 133 Q 4.2268 8.3726 116.8496 52.9288 31.6068 174.1351 134 P 4.3932 0.0000 0.0000 62.1740 32.3187 177.0817 135 A 3.9556 8.7925 123.4287 55.6815 18.2076 178.7674 136 N 4.5755 8.0423 109.6315 54.0885 37.8150 175.5424 137 K 4.4637 8.1543 117.9097 56.3423 32.9611 177.2325 138 R 3.7716 7.6791 120.4958 57.9122 30.9038 176.3698 139 S 4.9779 7.6193 111.9399 56.3541 66.3764 174.5953 140 V 4.0744 8.5553 114.6147 61.6223 31.6485 175.5263 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 2 M 8.30 4.52 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.09 4.04 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 1.07 0.00 0.00 0.97 0.00 0.00 4 W 9.08 4.56 0.00 3.42 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 5 T 8.02 3.97 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 0.98 0.00 0.00 6 P 0.00 4.62 0.00 2.24 2.19 0.00 3.79 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 1.93 1.96 0.00 7 V 7.39 4.05 2.03 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.61 4.28 0.00 2.99 2.87 0.00 0.00 6.53 6.92 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 9 N 7.61 4.96 0.00 2.62 2.69 0.00 0.00 7.29 6.68 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 10 K 8.32 4.09 0.00 2.03 1.76 0.00 0.77 0.00 0.00 1.42 0.00 0.00 2.27 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.39 1.39 7.81 11 M 8.41 4.98 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.65 0.00 12 F 8.03 4.54 0.00 3.06 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 13 E 8.05 3.53 0.00 2.14 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 2.20 2.14 0.00 14 T 8.39 3.70 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 0.14 0.00 0.00 15 F 9.10 4.51 0.00 3.28 3.08 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 16 S 8.41 4.43 0.00 4.12 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 0.00 17 Y 8.30 4.42 0.00 3.05 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 18 L 7.56 4.71 0.00 1.80 1.61 0.84 1.12 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 19 P 0.00 4.50 0.00 2.05 2.01 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 20 P 0.00 4.23 0.00 2.08 2.07 0.00 3.74 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.28 0.00 21 L 8.41 4.18 0.00 1.53 1.50 0.74 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 22 S 9.00 4.49 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 23 D 8.50 4.35 0.00 2.70 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 24 E 8.06 3.91 0.00 2.02 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 2.35 2.39 0.00 25 Q 8.03 3.90 0.00 2.25 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 26 I 8.12 3.69 2.07 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 0.75 1.11 0.00 0.00 27 A 8.41 4.06 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 28 A 8.15 4.11 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 29 Q 8.03 4.13 0.00 2.52 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.39 1.96 0.00 30 V 8.02 3.78 2.33 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 1.14 0.00 0.00 1.10 0.00 0.00 31 D 8.46 4.44 0.00 2.99 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 32 Y 8.02 4.22 0.00 3.24 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 33 I 7.99 3.93 2.18 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 1.69 0.98 1.07 0.00 0.00 34 V 7.93 3.53 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 1.05 0.00 0.00 1.01 0.00 0.00 35 A 8.27 3.96 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 36 N 7.18 4.12 0.00 1.44 1.42 0.00 0.00 7.02 8.54 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 37 G 7.36 3.75 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 0.00 0.00 0.00 38 W 7.55 5.00 0.00 3.36 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 39 I 8.92 4.36 2.11 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.89 0.72 0.00 0.00 40 P 0.00 4.84 0.00 2.08 1.97 0.00 3.80 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 41 C 8.63 4.93 0.00 3.05 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 42 L 8.63 5.30 0.00 1.87 1.62 0.83 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.03 5.64 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 44 F 9.29 5.61 0.00 2.93 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 45 A 8.08 4.37 -0.12 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 0.00 0.00 46 E 8.39 4.40 0.00 2.18 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 0.00 2.28 2.29 0.00 47 S 9.02 4.43 0.00 4.01 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 0.00 48 D 8.20 4.58 0.00 2.69 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 49 K 8.03 4.62 0.00 1.55 1.67 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.41 7.81 50 A 7.96 3.90 0.57 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 51 Y 7.50 4.68 0.00 2.87 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 52 V 8.47 4.46 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 0.44 0.00 0.00 0.76 0.00 0.00 53 S 8.36 4.74 0.00 4.07 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 54 N 8.60 5.11 0.00 2.78 2.87 0.00 0.00 6.52 7.66 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 55 E 8.55 3.93 0.00 2.15 2.25 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 2.59 2.40 0.00 56 S 8.81 4.01 0.00 4.03 3.69 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 57 A 7.68 2.59 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 58 I 7.07 3.60 1.79 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 1.48 0.82 0.84 0.00 0.00 59 R 7.55 4.31 0.00 1.87 1.99 0.00 3.19 0.00 0.00 3.21 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 60 F 7.26 4.98 0.00 3.03 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 61 G 8.16 4.08 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 0.00 62 S 8.41 4.62 0.00 3.86 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 63 V 7.11 4.49 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 0.66 0.00 0.00 0.50 0.00 0.00 64 S 8.26 4.49 0.00 4.13 4.29 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 65 C 8.10 3.90 0.00 2.95 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 66 L 8.46 3.49 0.00 1.74 1.71 0.93 0.95 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 67 Y 7.46 4.40 0.00 2.92 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 68 Y 7.01 4.92 0.00 2.82 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 69 D 9.10 4.53 0.00 2.77 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 70 N 8.86 4.46 0.00 3.04 3.23 0.00 0.00 6.99 7.66 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 71 R 7.93 4.02 0.00 1.55 1.71 0.00 3.10 0.00 0.00 3.34 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 72 Y 7.71 4.46 0.00 3.04 2.84 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.67 5.13 0.00 3.05 3.17 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 0.00 0.00 0.00 74 T 8.25 4.33 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 0.94 0.00 0.00 75 M 8.58 4.72 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.80 0.00 76 W 9.54 4.86 0.00 3.58 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 77 K 8.56 3.44 0.00 1.67 0.74 0.00 1.71 0.00 0.00 1.54 0.00 0.00 2.74 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.78 0.21 7.81 78 L 8.27 4.92 0.00 1.59 1.56 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.32 0.00 0.56 1.76 0.00 3.66 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.16 0.00 80 M 8.79 4.34 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 81 F 7.37 4.51 0.00 3.11 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 9.14 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 83 C 7.85 4.22 0.00 3.09 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 84 R 8.63 4.55 0.00 1.80 1.87 0.00 3.21 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.72 0.00 85 D 7.86 4.81 0.00 2.72 2.53 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 86 P 0.00 4.33 0.00 2.33 2.35 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 87 M 8.47 4.11 0.00 2.08 2.48 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.74 0.00 88 Q 8.12 4.04 0.00 2.39 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.40 0.00 89 V 7.72 3.63 2.25 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 1.09 0.00 0.00 0.97 0.00 0.00 90 L 7.95 4.05 0.00 1.91 1.72 0.94 1.03 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 91 R 8.19 4.00 0.00 2.06 2.00 0.00 3.15 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 92 E 8.22 4.10 0.00 2.25 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 2.61 2.65 0.00 93 I 7.78 3.54 2.01 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 1.34 0.85 0.84 0.00 0.00 94 V 7.50 3.46 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 0.97 0.00 0.00 0.93 0.00 0.00 95 A 8.12 3.96 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 96 C 7.87 2.00 0.00 1.23 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 T 7.55 3.71 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 1.11 0.00 0.00 98 K 7.64 3.88 0.00 1.81 1.96 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.39 7.81 99 A 7.60 4.01 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 0.00 100 F 7.88 4.67 0.00 2.81 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 P 0.00 4.40 0.00 2.12 2.10 0.00 3.29 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.09 4.70 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 0.00 103 A 7.37 4.81 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 0.00 104 Y 8.72 4.23 0.00 2.53 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 0.00 105 V 8.81 5.34 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 1.00 0.00 0.00 0.93 0.00 0.00 106 R 9.27 5.00 0.00 1.84 1.88 0.00 2.29 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.35 0.00 107 L 8.33 4.73 0.00 1.44 0.71 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.59 4.89 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.48 0.00 0.00 109 A 7.94 4.94 1.13 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 0.00 0.00 110 F 9.04 5.28 0.00 2.99 2.89 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 0.00 111 D 8.76 5.47 0.00 2.43 2.47 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 0.00 112 N 9.20 4.75 0.00 2.93 3.05 0.00 0.00 6.32 7.39 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 0.00 113 Q 9.15 4.19 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.92 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 114 K 8.32 4.14 0.00 1.76 1.86 0.00 1.91 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.47 7.81 115 Q 7.66 3.42 0.00 2.16 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.71 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 116 V 6.83 4.34 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 0.58 0.00 0.00 0.92 0.00 0.00 117 Q 8.81 4.53 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.93 0.00 0.00 0.00 0.00 0.00 2.20 1.95 0.00 118 I 7.62 4.21 0.84 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.08 0.53 0.00 0.00 119 M 6.73 4.17 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.51 0.00 120 G 8.35 4.89 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 0.00 0.00 0.00 121 F 6.97 5.05 0.00 3.22 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 0.00 122 L 8.79 4.53 0.00 1.58 1.61 0.76 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.00 4.51 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 0.65 0.00 0.00 0.89 0.00 0.00 124 Q 7.65 4.47 0.00 1.98 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.86 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 125 R 8.03 4.21 0.00 1.34 1.26 0.00 2.21 0.00 0.00 2.45 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.19 0.00 126 P 0.00 4.14 0.00 2.02 1.92 0.00 2.23 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 127 K 8.53 4.06 0.00 1.87 1.93 0.00 1.57 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.43 7.81 128 S 7.97 4.31 0.00 4.04 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 0.00 129 A 7.77 4.31 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 0.00 130 R 8.72 4.79 0.00 1.81 1.89 0.00 3.35 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.57 0.00 131 D 8.70 4.95 0.00 2.89 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 W 7.87 5.64 0.00 3.66 3.19 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 0.00 133 Q 8.37 4.23 0.00 1.95 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.06 0.00 0.00 0.00 0.00 0.00 2.36 2.03 0.00 134 P 0.00 4.39 0.00 2.12 1.94 0.00 3.40 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.73 0.00 135 A 8.79 3.96 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 0.00 136 N 8.04 4.58 0.00 2.79 2.93 0.00 0.00 5.81 7.13 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 0.00 137 K 8.15 4.46 0.00 1.49 1.65 0.00 1.59 0.00 0.00 1.54 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.25 1.25 7.81 138 R 7.68 3.77 0.00 1.22 0.66 0.00 3.07 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 139 S 7.62 4.98 0.00 3.91 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 0.00 140 V 8.56 4.07 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 0.58 0.00 0.00 0.98 0.00 0.00