NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 E 4.3464 8.3033 118.7977 55.2351 31.4039 177.0056 7 P 4.2983 0.0000 0.0000 64.3200 31.5481 173.7970 8 E 4.2681 7.8842 116.5538 57.3530 31.0597 176.9540 9 T 4.1209 8.0116 110.9931 61.2791 70.7121 175.0430 10 L 4.0081 8.4384 121.4723 58.0036 41.5609 179.8445 11 E 3.9827 8.1605 117.7797 59.5123 29.6078 179.0528 12 A 4.0472 8.1562 120.7778 55.0656 18.3174 179.9219 13 R 3.8697 8.3560 116.8899 59.5973 30.3471 179.2161 14 I 3.3534 8.2722 118.6613 63.8657 37.6399 177.6793 15 N 4.3080 7.9783 116.9942 55.9652 38.4516 177.1647 16 R 3.9425 7.9882 119.9183 59.4760 30.1240 178.5191 17 A 3.9365 7.9586 119.1541 54.1219 18.2378 177.9990 18 T 4.0980 7.3201 105.5201 60.7692 69.7040 173.1118 19 N 4.2589 7.7200 122.4569 53.5831 38.9826 173.7869 20 P 4.5371 0.0000 0.0000 64.5574 31.5440 176.8560 21 L 4.3889 8.0692 118.4057 55.5210 42.1460 176.8914 22 N 4.4253 7.9400 116.8440 53.8681 38.8357 175.4372 23 K 4.1800 8.8068 122.1185 58.7278 32.6184 176.2169 24 E 4.8852 7.8098 114.1214 54.9807 31.8083 174.7791 25 L 3.7333 8.7341 119.4180 55.4636 42.0004 178.1316 26 D 4.6393 7.9618 122.8367 52.9497 40.3614 176.5486 27 W 4.1599 8.3601 125.8956 58.7030 29.4349 177.6156 28 A 4.0773 8.2141 120.6676 55.5906 17.8285 179.7524 29 S 4.1624 8.2332 112.9806 61.4529 62.8827 176.9975 30 I 3.6219 7.8441 122.5893 64.6528 36.9415 178.3450 31 N 4.6202 8.7048 117.4877 56.0871 38.3188 177.8276 32 G 3.6299 8.1865 107.4272 47.6117 0.0000 175.2440 33 F 4.0684 8.3494 123.3229 61.5267 39.5148 176.6595 34 C 4.0797 8.1693 115.3723 59.9698 39.7244 176.0364 35 E 3.8794 8.0269 119.3621 59.4192 28.9058 178.8779 36 Q 4.0201 8.0410 119.8600 58.6909 28.5864 177.9701 37 L 3.7921 7.4304 120.7812 57.9194 41.3205 177.2151 38 N 4.8017 7.4004 118.1344 50.8328 36.5657 174.8241 39 E 4.9415 6.9612 111.2636 54.7738 33.1554 175.3177 40 D 4.4410 7.5870 122.8056 54.5400 43.6838 176.0022 41 F 4.0140 8.7515 118.2589 57.5954 39.9132 177.1320 42 E 4.5907 8.1350 119.4979 56.1598 29.8336 177.5855 43 G 3.6120 7.7456 108.0469 46.7283 0.0000 173.6629 44 P 4.3401 0.0000 0.0000 64.7285 31.3681 177.1392 45 P 4.2551 0.0000 0.0000 65.2091 31.2499 178.5133 46 L 3.9706 7.8554 118.9131 57.9482 41.9330 178.7169 47 A 4.2592 8.3418 121.3741 55.6014 18.2720 179.7590 48 T 3.6361 7.9747 108.2399 64.9352 68.5356 177.0294 49 R 4.0286 7.8726 121.0612 58.9317 30.0967 179.0558 50 L 4.0898 8.1800 118.7536 57.7915 41.6013 179.4772 51 L 3.9999 8.3511 118.8889 57.7984 41.5203 179.3107 52 A 4.1099 8.5317 120.8136 55.6450 18.1023 179.1837 53 H 4.1502 7.8211 115.1853 59.4622 30.2881 177.3674 54 K 4.0542 7.9749 119.8699 59.4822 31.6203 179.4765 55 I 3.8429 7.9037 119.4389 63.9333 37.0134 177.4531 56 Q 4.3241 7.4987 116.5055 55.0421 28.9902 176.0265 57 S 4.1969 7.3472 115.8000 57.6429 62.8783 172.8611 58 P 4.2841 0.0000 0.0000 64.7323 31.7025 176.9872 59 Q 4.3435 8.1328 118.6441 54.3934 29.2105 175.7191 60 E 3.9675 8.8356 126.6996 59.3238 29.7363 178.4748 61 W 4.7125 8.3107 127.6408 60.4072 30.7517 177.2605 62 E 3.8991 8.5018 119.9901 58.5796 29.0954 178.5893 63 A 4.0807 7.8305 120.2459 55.2006 18.4695 179.5525 64 I 3.6520 8.2841 118.6574 64.7051 37.1816 178.5982 65 Q 3.5252 7.6511 118.4229 58.8057 28.3662 178.8850 66 A 3.8188 7.8265 121.5951 55.1604 18.3164 179.7278 67 L 4.0380 8.1375 117.4736 58.1030 41.6308 179.9269 68 T 3.9405 7.7756 116.0628 66.4037 68.2416 176.9239 69 V 3.5234 7.8184 120.3406 65.7358 31.5414 177.7190 70 L 4.1260 8.1562 120.1811 58.3301 41.8823 178.3629 71 E 4.2906 8.6948 119.5037 59.9122 29.5480 179.0446 72 T 4.0215 8.1861 115.4694 67.0572 68.5634 176.2314 73 C 4.2347 8.5948 118.6515 60.1251 39.8403 176.0884 74 M 4.1517 8.2362 119.7405 58.3197 31.5521 178.5831 75 K 4.2454 7.8828 118.4082 58.6702 32.3655 178.6496 76 S 4.5478 7.9388 112.8171 59.4078 64.0197 175.3002 77 C 4.5564 7.5956 119.5566 59.5486 29.1267 175.1464 78 G 3.7400 8.1192 109.5703 45.0002 0.0000 173.5267 79 K 3.8311 8.4700 117.9655 59.7040 32.2615 179.9060 80 R 3.7842 7.8957 117.8296 59.3551 29.9342 178.6776 81 F 4.1331 7.9345 119.6847 61.4380 39.4696 176.6150 82 H 3.8435 7.9480 115.8920 59.2507 28.2915 177.4746 83 D 4.4701 7.9262 120.7855 56.6003 40.6258 178.2801 84 E 3.9994 7.2193 117.8124 58.9186 29.8136 178.8249 85 V 3.3106 7.1810 118.4553 65.2003 31.2531 176.7238 86 G 4.1544 7.7615 104.2593 44.4328 0.0000 173.4061 87 K 4.4500 7.0632 118.8372 53.5641 35.4149 177.9354 88 F 4.4964 8.1432 120.2654 60.4871 38.5599 177.6596 89 R 3.9812 8.2026 117.5892 59.3477 29.9220 177.4904 90 F 4.4876 8.0517 119.1271 60.8539 39.8871 177.4463 91 L 3.9358 8.3456 118.9536 57.9451 41.3801 179.2861 92 N 4.2999 8.6597 116.7818 56.3162 38.1578 177.2535 93 E 3.9027 7.7692 119.4029 59.1288 29.7391 178.9741 94 L 4.0593 7.4352 118.7147 57.6929 41.7959 179.2953 95 I 3.7554 7.8908 119.9161 64.3565 36.9197 178.6620 96 K 4.0228 7.9946 119.3172 59.1890 31.6349 179.6228 97 V 3.6131 7.6176 118.5132 65.3868 31.2825 177.7080 98 V 4.1084 7.6284 109.0322 61.5180 32.6156 175.7787 99 S 4.5481 7.9489 116.0760 56.6493 62.9919 173.2552 100 P 4.3347 0.0000 0.0000 65.0457 31.3485 177.9724 101 K 3.9927 7.7927 117.2114 58.1527 33.6407 177.3346 102 Y 4.3849 8.2034 111.3498 58.1025 38.6206 176.1112 103 L 4.5391 5.9136 133.9988 55.4334 43.7701 178.6240 104 G 4.0400 8.3874 109.1638 49.1196 0.0000 175.7204 105 S 4.2487 8.0374 112.5995 59.5603 63.4583 174.6734 106 R 4.4512 7.7792 116.0463 56.1131 29.9919 176.1234 107 T 4.4803 7.2510 116.4427 62.2924 70.1396 175.4892 108 S 4.3550 8.3294 119.9507 58.2596 65.2162 175.2548 109 E 3.9764 8.7954 123.1949 59.5100 29.2167 179.6368 110 K 3.8945 8.0066 119.1379 59.4869 32.3466 178.8205 111 V 3.5999 7.5570 118.3839 66.0190 31.5033 178.1724 112 K 4.0009 7.9707 117.9563 59.4839 31.9205 179.0453 113 N 4.3220 8.7890 117.0967 56.1933 38.4216 177.2159 114 K 3.8902 8.0600 120.8469 59.6477 32.2353 178.6923 115 I 3.6406 7.7417 119.9017 64.5637 37.0802 178.4508 116 L 4.1005 8.0621 119.6596 57.6201 41.4098 179.3236 117 E 3.9119 8.2692 119.3339 59.1504 29.6621 178.7143 118 L 3.3461 7.7672 119.0906 57.6140 41.5608 179.5014 119 L 3.6645 7.4565 118.7280 57.8089 41.6637 179.0486 120 Y 3.0163 7.5375 119.5184 60.2174 38.5817 178.0923 121 S 3.8195 7.6709 115.1570 61.3147 62.8740 176.6324 122 W 4.3158 7.7952 122.7267 59.4475 28.5437 178.6100 123 T 3.8589 7.7220 109.3347 64.6545 68.0862 176.2565 124 V 3.7816 7.1437 119.7430 65.1000 31.7879 177.7575 125 G 3.8428 8.1115 104.0550 45.5759 0.0000 173.6549 126 L 5.0687 7.9937 119.9661 52.2283 42.0871 175.8838 127 P 4.5021 0.0000 0.0000 63.7843 32.4222 178.1315 128 E 4.0656 8.2708 117.4934 59.3464 29.6142 176.6727 129 E 4.4778 8.1052 121.5855 54.4685 28.0387 177.2264 130 V 3.7657 7.9473 116.9872 64.2612 31.7873 177.8231 131 K 4.1732 7.8848 117.6741 59.0381 31.8034 179.2921 132 I 3.8000 7.5389 120.3666 64.3820 36.9954 178.1407 133 A 4.1437 8.0896 121.0387 55.3153 18.2305 179.3145 134 E 4.0046 8.5436 116.9610 59.5924 29.6127 179.5461 135 A 4.1224 8.6632 121.1841 55.3840 18.5258 179.0912 136 Y 4.0904 8.4419 118.2314 60.9306 38.7876 178.1708 137 Q 3.9445 8.6281 119.4648 59.0705 28.7218 178.4352 138 M 3.9843 8.0981 119.2320 58.6081 32.2410 178.2307 139 L 3.9186 7.9164 119.0625 57.6279 41.7821 179.5787 140 K 3.7416 7.7342 118.2937 59.4138 31.7990 179.2496 141 K 3.9351 7.9492 118.5356 59.4498 32.2070 177.9767 142 Q 4.3223 8.1044 115.4385 55.7527 28.7461 176.6231 143 G 3.8074 7.8263 108.1885 45.8735 0.0000 173.6651 144 I 3.9605 7.7084 121.0649 60.6611 37.1829 175.8996 145 V 4.5560 7.9078 117.5029 58.8683 35.6019 175.8598 146 K 4.1678 8.5247 119.0758 56.9839 31.8648 177.3564 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 6 E 8.30 4.35 0.00 2.14 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 0.00 2.26 2.29 0.00 7 P 0.00 4.30 0.00 2.15 2.15 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 8 E 7.88 4.27 0.00 1.95 1.98 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 2.28 2.29 0.00 9 T 8.01 4.12 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 10 L 8.44 4.01 0.00 1.72 1.87 0.70 0.34 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 11 E 8.16 3.98 0.00 2.08 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 2.42 2.48 0.00 12 A 8.16 4.05 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 13 R 8.36 3.87 0.00 2.29 2.20 0.00 3.15 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 14 I 8.27 3.35 1.69 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.98 0.97 0.00 0.00 15 N 7.98 4.31 0.00 2.89 2.84 0.00 0.00 6.97 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 16 R 7.99 3.94 0.00 2.03 1.87 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 17 A 7.96 3.94 1.14 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 0.00 0.00 18 T 7.32 4.10 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 19 N 7.72 4.26 0.00 2.90 2.89 0.00 0.00 6.96 7.59 0.00 0.00 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 P 0.00 4.54 0.00 2.29 2.20 0.00 3.78 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 2.01 2.08 0.00 21 L 8.07 4.39 0.00 1.80 1.80 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 22 N 7.94 4.43 0.00 3.05 3.14 0.00 0.00 7.00 6.97 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 23 K 8.81 4.18 0.00 1.79 1.88 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.46 7.81 24 E 7.81 4.89 0.00 2.13 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 2.23 2.38 0.00 25 L 8.73 3.73 0.00 1.52 0.82 1.03 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 26 D 7.96 4.64 0.00 2.71 2.41 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 27 W 8.36 4.16 0.00 3.47 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 28 A 8.21 4.08 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 29 S 8.23 4.16 0.00 4.05 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 30 I 7.84 3.62 1.83 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.86 0.94 0.00 0.00 31 N 8.70 4.62 0.00 2.96 2.94 0.00 0.00 7.01 7.34 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 32 G 8.19 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.35 4.07 0.00 3.07 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 34 C 8.17 4.08 0.00 2.99 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 35 E 8.03 3.88 0.00 2.14 1.97 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 2.31 2.28 0.00 36 Q 8.04 4.02 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 37 L 7.43 3.79 0.00 1.63 1.23 0.73 -0.12 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 38 N 7.40 4.80 0.00 2.98 2.72 0.00 0.00 6.73 7.54 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 39 E 6.96 4.94 0.00 1.85 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 2.10 2.06 0.00 40 D 7.59 4.44 0.00 2.60 2.70 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 0.00 0.00 0.00 0.00 41 F 8.75 4.01 0.00 3.09 3.07 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 0.00 0.00 0.00 42 E 8.14 4.59 0.00 2.05 1.97 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 2.34 2.45 0.00 43 G 7.75 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.34 0.00 2.09 2.13 0.00 3.46 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.10 0.00 45 P 0.00 4.26 0.00 2.15 2.08 0.00 3.63 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 2.09 2.10 0.00 46 L 7.86 3.97 0.00 1.80 1.89 1.00 1.40 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 47 A 8.34 4.26 1.47 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 0.00 0.00 48 T 7.97 3.64 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 49 R 7.87 4.03 0.00 2.05 2.08 0.00 3.16 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.85 0.00 50 L 8.18 4.09 0.00 2.02 1.79 1.07 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.35 4.00 0.00 2.04 1.92 1.19 0.89 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 52 A 8.53 4.11 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 53 H 7.82 4.15 0.00 3.15 3.52 0.00 5.76 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 54 K 7.97 4.05 0.00 1.88 1.76 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.64 1.54 7.81 55 I 7.90 3.84 2.04 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.63 0.93 0.00 0.00 56 Q 7.50 4.32 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 57 S 7.35 4.20 0.00 3.89 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 58 P 0.00 4.28 0.00 2.09 2.11 0.00 3.71 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 2.03 2.11 0.00 59 Q 8.13 4.34 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 60 E 8.84 3.97 0.00 2.07 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 0.00 2.48 2.44 0.00 61 W 8.31 4.71 0.00 3.28 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 62 E 8.50 3.90 0.00 2.02 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 2.29 2.27 0.00 63 A 7.83 4.08 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 64 I 8.28 3.65 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.03 1.07 0.00 0.00 65 Q 7.65 3.53 0.00 1.74 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 1.19 1.16 0.00 66 A 7.83 3.82 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.14 4.04 0.00 1.87 1.78 0.95 0.66 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 68 T 7.78 3.94 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 1.00 0.00 0.00 69 V 7.82 3.52 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 0.76 0.00 0.00 0.68 0.00 0.00 70 L 8.16 4.13 0.00 2.09 2.08 1.08 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 71 E 8.69 4.29 0.00 2.30 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 0.00 2.48 2.53 0.00 72 T 8.19 4.02 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 73 C 8.59 4.23 0.00 2.62 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 0.00 0.00 0.00 0.00 74 M 8.24 4.15 0.00 1.95 2.52 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.93 0.00 75 K 7.88 4.25 0.00 1.92 1.92 0.00 1.75 0.00 0.00 1.82 0.00 0.00 3.17 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.58 1.80 7.81 76 S 7.94 4.55 0.00 4.01 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 77 C 7.60 4.56 0.00 2.89 2.81 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 0.00 0.00 0.00 78 G 8.12 3.74 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 0.00 0.00 0.00 79 K 8.47 3.83 0.00 1.79 1.76 0.00 1.72 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.50 7.81 80 R 7.90 3.78 0.00 1.75 1.81 0.00 2.71 0.00 0.00 2.89 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 81 F 7.93 4.13 0.00 2.90 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 82 H 7.95 3.84 0.00 3.30 3.25 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 83 D 7.93 4.47 0.00 2.66 2.63 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 0.00 0.00 0.00 84 E 7.22 4.00 0.00 1.86 1.74 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 2.20 2.43 0.00 85 V 7.18 3.31 1.47 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 0.53 0.00 0.00 -0.40 0.00 0.00 86 G 7.76 4.15 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 0.00 0.00 0.00 87 K 7.06 4.45 0.00 1.84 1.62 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.23 1.44 7.81 88 F 8.14 4.50 0.00 3.11 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 R 8.20 3.98 0.00 1.85 2.05 0.00 3.25 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 90 F 8.05 4.49 0.00 3.12 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 91 L 8.35 3.94 0.00 1.92 1.88 0.88 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.66 4.30 0.00 2.77 2.78 0.00 0.00 6.97 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 E 7.77 3.90 0.00 1.74 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 2.42 2.46 0.00 94 L 7.44 4.06 0.00 1.77 1.69 1.11 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.89 3.76 1.96 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 1.55 0.99 0.91 0.00 0.00 96 K 7.99 4.02 0.00 1.84 1.77 0.00 1.57 0.00 0.00 1.38 0.00 0.00 2.70 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.55 0.96 7.81 97 V 7.62 3.61 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 1.04 0.00 0.00 0.99 0.00 0.00 98 V 7.63 4.11 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 0.81 0.00 0.00 1.01 0.00 0.00 99 S 7.95 4.55 0.00 4.00 4.05 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 0.00 100 P 0.00 4.33 0.00 2.04 2.08 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 101 K 7.79 3.99 0.00 1.06 1.09 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.29 7.81 102 Y 8.20 4.38 0.00 3.09 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 L 5.91 4.54 0.00 1.84 1.72 0.94 1.22 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 0.00 104 G 8.39 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 0.00 0.00 0.00 105 S 8.04 4.25 0.00 3.98 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 R 7.78 4.45 0.00 1.96 2.07 0.00 3.06 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.58 0.00 107 T 7.25 4.48 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 0.00 108 S 8.33 4.35 0.00 4.06 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.80 3.98 0.00 2.00 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 2.41 2.32 0.00 110 K 8.01 3.89 0.00 1.84 1.97 0.00 1.77 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.53 7.81 111 V 7.56 3.60 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 0.99 0.00 0.00 0.97 0.00 0.00 112 K 7.97 4.00 0.00 1.89 1.85 0.00 1.74 0.00 0.00 1.79 0.00 0.00 3.23 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.63 7.81 113 N 8.79 4.32 0.00 2.93 2.88 0.00 0.00 6.68 7.75 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 0.00 114 K 8.06 3.89 0.00 2.02 1.97 0.00 1.53 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.54 7.81 115 I 7.74 3.64 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 1.55 0.56 0.93 0.00 0.00 116 L 8.06 4.10 0.00 1.88 1.84 0.94 0.75 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 0.00 117 E 8.27 3.91 0.00 2.03 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 0.00 2.24 2.34 0.00 118 L 7.77 3.35 0.00 1.31 0.23 0.98 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 119 L 7.46 3.66 0.00 1.81 1.75 1.07 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 120 Y 7.54 3.02 0.00 2.62 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 0.00 121 S 7.67 3.82 0.00 4.00 4.05 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 0.00 122 W 7.80 4.32 0.00 3.51 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 0.00 123 T 7.72 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 1.27 0.00 0.00 124 V 7.14 3.78 1.74 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 0.75 0.00 0.00 0.34 0.00 0.00 125 G 8.11 3.84 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 0.00 0.00 0.00 126 L 7.99 5.07 0.00 1.77 1.47 0.48 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 127 P 0.00 4.50 0.00 2.03 2.09 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.17 0.00 128 E 8.27 4.07 0.00 2.08 2.20 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 2.31 2.25 0.00 129 E 8.11 4.48 0.00 1.97 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 2.21 2.25 0.00 130 V 7.95 3.77 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 0.83 0.00 0.00 0.92 0.00 0.00 131 K 7.88 4.17 0.00 1.59 0.98 0.00 1.45 0.00 0.00 0.76 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.21 1.33 7.81 132 I 7.54 3.80 2.09 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.55 1.20 0.00 0.00 133 A 8.09 4.14 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 0.00 134 E 8.54 4.00 0.00 2.49 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 2.44 2.63 0.00 135 A 8.66 4.12 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 Y 8.44 4.09 0.00 3.24 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 0.00 137 Q 8.63 3.94 0.00 2.34 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.67 2.59 0.00 138 M 8.10 3.98 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.71 0.00 139 L 7.92 3.92 0.00 1.72 1.62 0.99 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 140 K 7.73 3.74 0.00 1.81 1.74 0.00 1.63 0.00 0.00 1.27 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 0.94 7.81 141 K 7.95 3.94 0.00 1.76 1.95 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.47 7.81 142 Q 8.10 4.32 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.96 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 143 G 7.83 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 144 I 7.71 3.96 1.90 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 0.84 0.91 0.00 0.00 145 V 7.91 4.56 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 0.72 0.00 0.00 0.92 0.00 0.00 146 K 8.52 4.17 0.00 1.74 1.72 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.44 7.81