NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4042 8.2644 122.4709 51.6598 19.9131 175.8646 2 T 3.8028 8.4308 117.0147 62.7340 68.6259 171.2187 3 K 5.2867 9.2142 129.1113 54.7003 36.1008 174.3523 4 A 5.4124 9.1073 124.4320 50.3755 23.2281 175.1219 5 V 4.9885 8.9110 117.6828 60.4842 35.5175 173.5771 6 C 4.9847 9.4322 122.8781 57.7172 34.9329 172.5578 7 V 4.6692 8.3775 125.9023 61.5172 32.4046 174.4198 8 L 4.6947 8.9863 128.8458 54.2781 43.4959 176.0598 9 K 4.6279 8.9286 120.0228 56.3761 37.2418 175.7449 10 G 3.9693 7.8666 108.5380 46.2284 0.0000 172.5788 11 D 4.5770 8.7902 118.3595 55.3240 41.5281 176.3943 12 G 4.4015 7.5238 109.0277 43.8642 0.0000 171.4053 13 P 4.5134 0.0000 0.0000 62.8869 31.8038 175.2529 14 V 4.0287 7.5313 120.1539 63.2194 32.0551 175.2365 15 Q 4.8152 8.8313 126.0527 54.5735 33.4075 174.2987 16 G 4.3874 8.4714 107.1298 45.4040 0.0000 172.0217 17 I 5.0013 8.2832 121.7074 59.4053 40.1682 174.5958 18 I 4.6348 8.8812 128.8211 59.4702 39.5713 174.5375 19 N 5.0158 8.2460 124.1357 51.1538 41.2933 173.6426 20 F 5.4727 9.0011 121.1338 55.8408 42.8827 174.0819 21 E 5.1284 9.6439 122.9886 55.1363 32.1107 173.5864 22 Q 4.7589 8.9490 127.3860 53.8904 30.4146 175.3632 23 K 4.1142 8.9570 126.0987 58.7860 32.5912 177.2679 24 E 4.8162 7.7138 113.2532 54.0928 32.6333 176.5449 25 S 4.1415 8.7505 115.6433 61.2289 63.3295 175.2556 26 N 4.4549 8.1273 117.3354 54.5936 37.6671 175.3319 27 G 3.9384 7.7647 108.1312 43.8662 0.0000 170.8281 28 P 4.6442 0.0000 0.0000 62.5600 32.5134 176.1218 29 V 4.3326 9.2018 123.7910 62.0900 33.0292 174.9253 30 K 4.9451 9.4953 128.9810 55.9709 33.5127 176.2373 31 V 4.9754 8.9500 125.2606 59.6050 34.2070 174.6792 32 W 5.2629 8.1945 120.7188 55.3289 31.8334 174.7620 33 G 4.0905 7.9436 108.0908 46.2033 0.0000 171.3882 34 S 5.1623 7.7130 112.7368 56.8712 66.6385 174.2263 35 I 5.1261 8.7831 125.3202 59.4070 41.0127 174.7541 36 K 4.7147 9.3118 125.7401 55.5312 36.1254 176.8116 37 G 3.9591 8.6290 105.2942 46.6192 0.0000 173.2939 38 L 4.5869 7.6547 119.5701 52.5883 43.3815 176.3768 39 T 4.2391 8.2050 111.9839 61.0565 69.5236 173.9811 40 E 4.1808 8.6479 124.9892 58.1842 30.2548 176.9562 41 G 3.8747 9.4006 109.8041 44.0696 0.0000 171.5184 42 L 4.8852 8.0864 119.8034 53.5866 43.7657 176.0502 43 H 5.0317 9.1605 120.1755 53.5389 32.4008 173.2165 44 G 4.1200 9.2180 111.0031 47.1442 0.0000 172.2298 45 F 5.4346 9.1475 124.6191 56.7918 42.1586 173.0037 46 H 5.1945 9.1575 122.9779 53.9421 33.5500 172.7254 47 V 4.5350 8.6431 121.3794 62.0794 32.9416 174.9504 48 H 5.1137 9.1578 125.1612 54.3658 31.3804 175.5401 49 E 3.6554 8.6332 121.1143 58.8161 29.8517 176.9157 50 F 4.8490 7.5840 117.9726 55.1287 41.3284 176.7907 51 G 4.0995 8.2979 110.3824 44.6276 0.0000 174.2851 52 D 4.7363 7.9781 118.1587 52.6654 42.6656 174.2551 53 N 5.0575 8.5003 124.6077 53.4657 39.2250 176.4158 54 T 3.9084 8.2592 109.3284 63.5808 68.8594 174.4624 55 A 4.6336 8.2314 125.4131 51.4917 20.0603 176.9610 56 G 3.8248 8.0481 110.8515 46.7352 0.0000 174.1768 57 C 4.4635 8.5630 114.6486 59.5436 34.6048 175.9322 58 T 3.8366 7.5359 117.4011 66.5872 67.8321 176.5057 59 S 4.1826 8.3074 115.5384 61.7273 63.0047 176.2697 60 A 4.5432 7.4089 124.3763 54.1546 18.3019 178.5672 61 G 4.1534 8.1692 105.4882 44.7943 0.0000 170.4379 62 P 4.7287 0.0000 0.0000 62.2170 33.8103 175.6168 63 H 4.4208 8.6002 116.1315 56.0633 29.6419 175.7865 64 F 4.4329 9.2451 124.5658 57.6391 39.3770 174.5441 65 N 4.5742 8.0132 126.2487 51.2405 38.6711 172.8710 66 P 4.2334 0.0000 0.0000 64.9223 32.2703 178.0048 67 L 4.3341 7.6841 117.3307 53.8205 41.6222 176.5616 68 S 3.6148 7.1604 112.3742 59.5670 60.8866 172.2611 69 R 4.5717 7.7636 117.7557 54.6118 31.9361 176.9346 70 K 4.3357 8.5062 118.7781 56.2122 33.4702 176.4344 71 H 3.8780 8.7499 123.5975 56.8906 30.1401 175.0194 72 G 3.8818 8.6819 112.8119 45.4294 0.0000 172.1895 73 G 4.1240 9.0246 110.2925 43.4680 0.0000 173.1453 74 P 4.4155 0.0000 0.0000 64.6750 31.2102 177.8118 75 K 4.1909 7.8734 116.7400 57.9619 32.5352 176.9285 76 D 4.6171 7.7859 118.8163 53.6568 41.6021 176.3197 77 E 3.9300 8.7420 123.1537 59.0096 29.9077 176.7489 78 E 4.2416 7.9034 120.3668 55.4791 29.7354 175.0012 79 R 4.6777 7.6889 120.2093 56.6386 31.8834 173.6305 80 H 4.7713 8.3275 115.3462 54.9054 29.7467 176.8003 81 V 3.4429 8.3378 122.5336 66.3949 31.3502 177.4704 82 G 3.7543 8.5385 105.7883 48.0159 0.0000 173.2007 83 D 4.9384 8.2790 121.8735 53.0684 40.5916 176.2090 84 L 4.7101 8.5965 120.6890 52.9272 42.9593 177.3430 85 G 4.1754 9.0162 110.9179 45.7443 0.0000 175.4040 86 N 5.5667 8.5654 119.8876 51.4283 42.2500 173.1200 87 V 4.1478 8.7837 116.1595 60.3596 34.6432 175.1190 88 T 4.9275 8.1181 118.5867 61.8002 70.7382 173.4669 89 A 4.5511 9.9057 130.7516 51.1393 20.0336 177.4520 90 D 4.6175 8.9308 123.4166 52.5300 40.4300 177.2441 91 K 4.1087 8.5083 117.3328 59.8072 32.5481 177.2985 92 D 4.5643 8.2793 117.1547 54.0424 41.1969 176.8666 93 G 4.3059 8.5621 108.3303 44.5946 0.0000 172.7131 94 V 4.7111 8.1246 120.2852 61.0239 33.3120 174.4964 95 A 5.1470 9.1546 131.0258 49.8704 20.4886 175.0107 96 D 4.8097 8.6297 123.1112 53.5524 42.6411 175.5381 97 V 4.2416 8.4205 126.3302 61.2970 33.6755 174.5891 98 S 4.8677 8.4727 122.1593 57.2369 64.8683 172.8061 99 I 4.8487 9.0320 127.4128 59.7008 41.9845 173.9266 100 E 5.1718 8.7787 124.7448 54.6226 32.3405 174.1426 101 D 4.9800 9.5698 126.1663 52.5702 44.8421 175.8054 102 S 4.9108 8.8951 118.9725 58.3441 63.9001 174.5250 103 V 4.2145 7.8995 121.0850 64.0047 32.8843 176.3267 104 I 4.0630 7.4491 111.6973 61.1306 38.3116 174.5401 105 S 4.6539 8.3875 114.4479 57.7189 65.4862 174.0591 106 L 4.5470 9.1257 121.9433 53.9967 41.5303 176.4908 107 S 4.4320 7.8906 112.2555 58.2806 66.0248 174.7608 108 G 3.8792 8.5763 108.6727 44.6033 0.0000 173.7023 109 D 4.4403 8.5909 117.1287 57.1735 40.6981 177.3999 110 H 5.0491 8.1098 114.0348 55.3117 29.2487 173.6926 111 C 4.4061 8.0537 121.2762 59.9892 31.7486 173.4934 112 I 3.9237 8.0951 118.9161 60.9037 38.3248 175.8679 113 T 3.8577 7.4860 118.7864 65.1766 68.6506 174.4631 114 G 3.8094 9.8482 115.3295 45.2563 0.0000 173.0734 115 R 4.5186 7.4555 119.2301 54.8863 33.4031 174.7006 116 T 4.9357 7.8415 115.8820 61.9134 71.5244 173.6704 117 L 4.4014 8.4387 129.0469 54.5461 43.6369 175.4524 118 V 4.8854 8.7178 126.2596 60.9614 34.6545 174.1988 119 V 4.8435 8.7545 127.9479 60.7155 33.1353 175.1735 120 H 5.1360 9.0925 123.1969 54.3293 30.2391 174.9978 121 E 4.1539 9.5222 122.3736 59.5197 29.5148 177.4125 122 K 4.6682 8.3296 117.5272 53.9418 35.3068 175.5442 123 A 4.3625 8.4323 124.3443 52.6284 18.5000 176.8959 124 D 4.7066 10.4821 123.8513 53.6766 41.3454 176.6745 125 D 4.4077 9.4901 125.9739 53.8225 39.5840 176.9896 126 L 3.5056 8.7214 119.1799 55.8942 39.4994 176.3908 127 G 4.1828 8.8066 106.8416 45.6488 0.0000 174.5991 128 K 4.5499 7.9282 118.8512 56.6505 32.5560 177.6057 129 G 3.9399 7.6188 108.2659 44.4945 0.0000 175.6205 130 G 3.9634 9.1675 107.3029 45.0847 0.0000 171.9549 131 N 5.0828 7.4476 115.1750 49.6924 41.1297 174.6631 132 E 4.0347 8.7871 117.7007 59.5487 29.5772 178.0780 133 E 3.9508 8.2381 118.7274 59.2756 29.4185 178.4456 134 S 4.1856 7.9379 112.6964 61.1106 62.3720 175.0624 135 T 4.4326 7.8309 113.0846 62.1333 67.0171 175.4690 136 K 4.2542 7.6996 118.2196 58.5060 33.7066 176.9360 137 T 4.0494 7.8978 105.0046 60.0604 70.2695 174.9011 138 G 4.3635 8.0753 109.5636 46.0444 0.0000 173.1109 139 N 4.2800 7.4893 112.8840 54.0905 36.6558 175.0424 140 A 4.4695 8.0740 119.5758 51.9510 20.5610 179.5315 141 G 3.7520 7.6586 104.2767 46.5485 0.0000 176.0133 142 S 4.3421 9.2491 119.3211 58.0452 63.6238 172.6053 143 R 4.2582 8.4059 124.5201 55.3852 29.7302 176.2332 144 L 4.3106 9.1078 126.2256 57.3657 43.0752 177.2463 145 A 4.7431 7.6995 117.0967 51.3564 22.6001 174.2565 146 C 5.7466 8.4518 115.0229 54.8088 41.0270 172.9318 147 G 4.5466 7.9915 101.4586 45.7357 0.0000 173.1470 148 V 4.2668 8.5534 124.9040 62.6927 32.4219 175.4741 149 I 4.0058 8.8764 129.9927 61.3388 37.8588 175.3371 150 G 4.2323 8.8609 114.4738 43.7284 0.0000 172.0070 151 I 4.1722 8.4170 122.0336 61.6083 37.4397 175.6045 152 A 4.7249 8.8501 129.0331 49.8068 21.8421 176.4503 153 Q 4.0731 8.4443 118.6850 56.4828 29.2265 175.7732 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 A 8.26 4.40 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 2 T 8.43 3.80 4.27 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 1.24 0.00 0.00 3 K 9.21 5.29 0.00 1.78 1.72 0.00 1.76 0.00 0.00 2.02 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.59 1.52 7.81 4 A 9.11 5.41 1.10 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 0.00 0.00 0.00 0.00 0.00 5 V 8.91 4.99 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 0.65 0.00 0.00 0.93 0.00 0.00 6 C 9.43 4.98 0.00 3.14 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 7 V 8.38 4.67 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 0.93 0.00 0.00 0.92 0.00 0.00 8 L 8.99 4.69 0.00 1.65 1.56 0.95 0.75 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 9 K 8.93 4.63 0.00 1.68 1.63 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.38 7.81 10 G 7.87 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 0.00 0.00 0.00 11 D 8.79 4.58 0.00 2.68 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 12 G 7.52 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 0.00 0.00 0.00 0.00 13 P 0.00 4.51 0.00 2.22 2.28 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.94 0.00 14 V 7.53 4.03 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 0.82 0.00 0.00 0.97 0.00 0.00 15 Q 8.83 4.82 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.40 0.00 0.00 0.00 0.00 0.00 2.26 2.52 0.00 16 G 8.47 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 0.00 0.00 0.00 0.00 17 I 8.28 5.00 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.83 0.83 0.00 0.00 18 I 8.88 4.63 1.88 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 1.27 1.10 0.55 0.00 0.00 19 N 8.25 5.02 0.00 1.44 1.42 0.00 0.00 6.45 7.74 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 20 F 9.00 5.47 0.00 2.96 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 21 E 9.64 5.13 0.00 2.48 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 2.33 2.41 0.00 22 Q 8.95 4.76 0.00 2.25 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.44 0.00 0.00 0.00 0.00 0.00 2.45 2.36 0.00 23 K 8.96 4.11 0.00 1.80 1.92 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.11 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.42 7.81 24 E 7.71 4.82 0.00 2.08 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 2.20 2.28 0.00 25 S 8.75 4.14 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 26 N 8.13 4.45 0.00 2.86 3.00 0.00 0.00 5.99 7.00 0.00 0.00 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 G 7.76 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 28 P 0.00 4.64 0.00 2.15 2.12 0.00 3.79 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 29 V 9.20 4.33 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 1.25 0.00 0.00 1.08 0.00 0.00 30 K 9.50 4.95 0.00 2.01 1.85 0.00 1.47 0.00 0.00 1.36 0.00 0.00 2.74 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.42 1.39 7.81 31 V 8.95 4.98 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 0.90 0.00 0.00 0.81 0.00 0.00 32 W 8.19 5.26 0.00 3.43 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 33 G 7.94 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 0.00 0.00 0.00 0.00 34 S 7.71 5.16 0.00 3.85 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 35 I 8.78 5.13 1.84 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 1.31 0.69 0.91 0.00 0.00 36 K 9.31 4.71 0.00 1.72 1.89 0.00 1.37 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.29 1.34 7.81 37 G 8.63 3.96 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 0.00 0.00 0.00 38 L 7.65 4.59 0.00 1.86 1.52 0.73 0.38 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 39 T 8.21 4.24 4.27 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 1.24 0.00 0.00 40 E 8.65 4.18 0.00 1.95 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 2.30 2.49 0.00 41 G 9.40 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 42 L 8.09 4.89 0.00 1.47 1.55 0.90 0.92 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 43 H 9.16 5.03 0.00 3.04 3.44 0.00 5.65 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 44 G 9.22 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 0.00 0.00 0.00 45 F 9.15 5.43 0.00 2.98 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 46 H 9.16 5.19 0.00 3.12 2.87 0.00 5.67 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.64 4.54 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 0.87 0.00 0.00 0.90 0.00 0.00 48 H 9.16 5.11 0.00 3.01 3.36 0.00 5.66 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.63 3.66 0.00 1.73 1.12 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 1.47 2.13 0.00 50 F 7.58 4.85 0.00 3.06 2.92 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 51 G 8.30 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 52 D 7.98 4.74 0.00 2.64 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 53 N 8.50 5.06 0.00 2.81 2.71 0.00 0.00 6.89 7.22 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 54 T 8.26 3.91 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 1.26 0.00 0.00 55 A 8.23 4.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 G 8.05 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 57 C 8.56 4.46 0.00 2.94 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 58 T 7.54 3.84 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 1.23 0.00 0.00 59 S 8.31 4.18 0.00 4.10 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 60 A 7.41 4.54 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 61 G 8.17 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 62 P 0.00 4.73 0.00 2.09 2.24 0.00 3.66 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.03 0.00 63 H 8.60 4.42 0.00 2.87 3.20 0.00 5.71 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.25 4.43 0.00 2.80 2.94 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 65 N 8.01 4.57 0.00 2.40 2.39 0.00 0.00 6.89 7.71 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 66 P 0.00 4.23 0.00 2.09 1.98 0.00 3.14 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.24 0.00 67 L 7.68 4.33 0.00 1.58 1.68 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.16 3.61 0.00 3.94 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 69 R 7.76 4.57 0.00 1.97 1.92 0.00 3.12 0.00 0.00 3.35 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.80 0.00 70 K 8.51 4.34 0.00 1.71 1.70 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.76 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.38 7.81 71 H 8.75 3.88 0.00 3.05 3.15 0.00 5.92 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 72 G 8.68 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 0.00 0.00 0.00 73 G 9.02 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 0.00 0.00 0.00 74 P 0.00 4.42 0.00 2.23 2.35 0.00 3.39 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 75 K 7.87 4.19 0.00 1.77 1.91 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.47 7.81 76 D 7.79 4.62 0.00 2.81 2.60 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 0.00 0.00 0.00 77 E 8.74 3.93 0.00 1.90 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 2.28 2.35 0.00 78 E 7.90 4.24 0.00 1.93 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.48 0.00 79 R 7.69 4.68 0.00 1.99 1.79 0.00 2.85 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.48 0.00 80 H 8.33 4.77 0.00 3.40 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.34 3.44 1.59 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 0.72 0.00 0.00 0.35 0.00 0.00 82 G 8.54 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 83 D 8.28 4.94 0.00 2.80 2.77 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 84 L 8.60 4.71 0.00 1.93 1.97 0.99 0.99 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 85 G 9.02 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.57 5.57 0.00 2.56 2.66 0.00 0.00 6.70 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 V 8.78 4.15 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 -0.27 0.00 0.00 0.83 0.00 0.00 88 T 8.12 4.93 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 1.25 0.00 0.00 89 A 9.91 4.55 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 90 D 8.93 4.62 0.00 2.90 2.85 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 91 K 8.51 4.11 0.00 1.88 2.13 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.40 1.46 7.81 92 D 8.28 4.56 0.00 2.79 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 G 8.56 4.31 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 0.00 94 V 8.12 4.71 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 1.01 0.00 0.00 0.92 0.00 0.00 95 A 9.15 5.15 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 96 D 8.63 4.81 0.00 2.66 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.42 4.24 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 0.76 0.00 0.00 0.62 0.00 0.00 98 S 8.47 4.87 0.00 3.87 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 9.03 4.85 1.97 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.53 1.02 0.00 0.00 100 E 8.78 5.17 0.00 1.94 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 101 D 9.57 4.98 0.00 2.86 2.54 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 0.00 0.00 0.00 0.00 102 S 8.90 4.91 0.00 3.89 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 0.00 103 V 7.90 4.21 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 0.83 0.00 0.00 0.95 0.00 0.00 104 I 7.45 4.06 1.96 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.82 1.05 0.00 0.00 105 S 8.39 4.65 0.00 3.89 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 L 9.13 4.55 0.00 1.63 1.63 1.03 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.89 4.43 0.00 3.91 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 0.00 108 G 8.58 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 0.00 0.00 0.00 109 D 8.59 4.44 0.00 2.67 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 0.00 110 H 8.11 5.05 0.00 3.20 3.44 0.00 5.65 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.05 4.41 0.00 3.14 2.92 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 0.00 112 I 8.10 3.92 1.63 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.21 0.99 0.00 0.00 113 T 7.49 3.86 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 1.13 0.00 0.00 114 G 9.85 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 0.00 115 R 7.46 4.52 0.00 1.69 1.74 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.22 0.00 116 T 7.84 4.94 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 1.24 0.00 0.00 117 L 8.44 4.40 0.00 1.78 1.51 0.23 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.72 4.89 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 0.73 0.00 0.00 0.69 0.00 0.00 119 V 8.75 4.84 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 0.94 0.00 0.00 1.06 0.00 0.00 120 H 9.09 5.14 0.00 3.09 3.59 0.00 5.68 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.52 4.15 0.00 2.12 2.27 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 2.37 2.36 0.00 122 K 8.33 4.67 0.00 1.97 1.71 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.41 7.81 123 A 8.43 4.36 1.23 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 0.00 0.00 124 D 10.48 4.71 0.00 2.69 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 0.00 125 D 9.49 4.41 0.00 2.92 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 0.00 126 L 8.72 3.51 0.00 1.87 1.78 0.93 1.00 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 0.00 127 G 8.81 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 7.93 4.55 0.00 1.84 1.83 0.00 1.55 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.41 7.81 129 G 7.62 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 0.00 130 G 9.17 3.96 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 0.00 0.00 0.00 131 N 7.45 5.08 0.00 2.76 2.77 0.00 0.00 6.13 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 0.00 132 E 8.79 4.03 0.00 2.05 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 2.38 2.37 0.00 133 E 8.24 3.95 0.00 2.11 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 2.41 2.44 0.00 134 S 7.94 4.19 0.00 4.16 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 0.00 135 T 7.83 4.43 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 136 K 7.70 4.25 0.00 1.71 1.79 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.61 7.81 137 T 7.90 4.05 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 1.14 0.00 0.00 138 G 8.08 4.36 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 0.00 139 N 7.49 4.28 0.00 2.92 2.91 0.00 0.00 6.82 7.23 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 0.00 140 A 8.07 4.47 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 0.00 141 G 7.66 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 0.00 142 S 9.25 4.34 0.00 4.22 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 0.00 143 R 8.41 4.26 0.00 1.68 1.76 0.00 3.21 0.00 0.00 3.06 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 144 L 9.11 4.31 0.00 1.69 1.69 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.70 4.74 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 0.00 146 C 8.45 5.75 0.00 2.93 3.10 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 0.00 0.00 0.00 147 G 7.99 4.55 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 0.00 0.00 0.00 148 V 8.55 4.27 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 0.82 0.00 0.00 0.96 0.00 0.00 149 I 8.88 4.01 1.77 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.53 0.38 0.00 0.00 150 G 8.86 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 0.00 0.00 0.00 151 I 8.42 4.17 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.54 0.91 0.00 0.00 152 A 8.85 4.72 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 0.00 153 Q 8.44 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00