NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.3597 8.3049 120.3439 54.8660 33.4156 174.5217 3 L 4.3309 8.3446 119.1432 52.6390 43.0117 176.2550 4 T 4.4701 8.4922 114.0320 61.7992 70.9489 175.4874 5 A 4.1927 8.7681 121.7537 56.0038 19.2444 180.1581 6 E 3.9741 8.0152 116.3365 61.2703 29.4641 180.7878 7 E 4.2451 7.7887 118.4621 59.0761 29.6223 179.4769 8 K 3.8867 7.7154 118.0724 59.4551 32.4408 178.8100 9 A 4.0200 8.1374 120.8834 55.0363 18.2822 179.3572 10 A 4.1454 7.7452 118.0263 54.9015 18.3024 180.0054 11 V 3.7832 7.6527 117.1241 66.3273 31.0841 178.5293 12 T 4.0485 8.0072 115.2836 66.3447 68.1202 176.5757 13 A 4.1047 7.7752 121.2315 55.3612 18.8821 179.1850 14 F 4.3073 8.5316 119.1307 61.2243 39.5182 177.1444 15 W 4.1220 8.4885 127.6946 60.1092 30.2164 178.1096 16 G 3.6784 7.7062 104.8514 47.5088 0.0000 175.1213 17 K 4.1621 7.4569 117.8851 56.2564 32.6153 177.3950 18 V 3.4747 6.4355 120.6154 61.9714 32.1205 176.3473 19 K 4.1517 8.1811 127.3263 55.4061 32.5518 177.2250 20 V 3.4611 8.1111 125.4412 66.4529 30.8877 177.1624 21 D 4.3697 7.9889 117.5670 57.6021 40.3413 178.4260 22 E 4.1611 7.9857 119.1063 59.0117 29.7907 178.6307 23 V 3.5632 7.7369 118.1355 65.4069 31.6850 178.3627 24 G 3.6950 7.8807 105.6691 47.7074 0.0000 176.0258 25 G 3.6157 7.5896 108.8734 47.3618 0.0000 175.4553 26 E 3.9088 7.7504 121.3194 58.8112 29.6133 178.8000 27 A 3.9290 7.8769 120.6546 55.1924 18.6288 179.4298 28 L 3.9378 7.8594 118.6350 58.0223 42.1099 179.1192 29 G 3.5855 8.0849 105.6717 48.1793 0.0000 175.8590 30 R 3.8933 8.3749 121.6405 58.3910 29.9956 179.0123 31 L 4.0962 8.0867 120.4218 58.1988 41.9668 178.9905 32 L 4.0842 7.6640 119.8025 56.3609 41.3138 179.6218 33 V 3.5317 7.4361 117.8377 65.8642 31.7115 178.0065 34 V 3.6412 7.8523 116.8590 64.2884 32.2205 175.3299 35 Y 4.0147 7.2964 118.1483 55.2124 37.2565 174.0198 36 P 4.8992 0.0000 0.0000 62.2869 31.9295 178.5394 37 W 4.5188 7.7413 116.8471 58.6818 28.9523 177.5618 38 T 4.2217 7.2704 109.7701 63.3150 68.5692 176.2801 39 Q 4.3134 7.9384 120.7177 58.6384 28.5321 178.0331 40 R 3.9507 7.5601 119.2327 59.3164 30.1472 178.1834 41 F 4.1020 8.0386 115.1776 58.8081 39.4820 175.5241 42 F 4.7403 7.9379 118.1678 56.7313 39.9939 177.4341 43 E 4.1148 8.4497 122.5117 59.5107 29.5992 179.5995 44 S 4.4632 8.1450 111.4322 60.2407 63.3100 174.8351 45 F 4.4038 8.2794 118.9710 57.8015 40.6617 175.3821 46 G 4.1920 7.8109 106.6168 44.7764 0.0000 175.9663 47 D 4.9897 9.3175 117.4696 52.5657 43.3259 174.6767 48 L 4.8359 8.3474 123.7225 54.6367 43.7715 177.6459 49 S 4.1885 8.4485 114.8714 61.0035 63.1748 175.1876 50 T 4.5621 7.4261 111.4363 58.8939 72.2945 175.0271 51 A 4.0297 8.3224 122.9263 55.2602 18.1716 179.7875 52 D 4.2765 8.0479 117.1260 57.3624 40.7841 178.5670 53 A 4.1079 7.3840 120.3552 54.8144 18.7490 179.7289 54 V 3.6808 7.7703 116.8894 66.5276 31.5850 177.9925 55 M 4.3548 8.0445 115.5111 56.7433 31.8842 176.5446 56 N 4.8580 7.3902 113.5118 52.3480 40.3510 174.5773 57 N 4.4221 7.9800 118.5096 52.9798 39.8426 173.4321 58 P 4.2814 0.0000 0.0000 65.6943 31.5281 178.8356 59 K 3.8481 8.0102 117.4995 59.1048 31.8807 179.5322 60 V 3.8590 8.0958 118.0843 66.2899 31.3993 178.1796 61 K 4.0318 8.2152 117.9136 59.3736 30.6907 179.3348 62 A 4.0212 8.2039 121.1736 55.1714 18.3631 179.0389 63 H 4.7513 8.5431 117.0458 58.9892 30.1276 177.6551 64 G 3.7038 8.3904 107.8115 47.5582 0.0000 175.5334 65 K 4.0195 7.8944 121.8983 59.3636 32.2805 179.1269 66 K 4.0591 7.5286 119.0985 59.4373 32.0923 179.5946 67 V 3.7787 7.7864 118.1568 65.9559 31.3928 178.1133 68 L 4.4037 8.0714 118.3325 57.6927 41.5852 179.0936 69 D 4.5634 8.1485 119.0118 57.1567 40.8702 178.7413 70 S 4.1839 8.2684 114.6423 60.9611 63.0767 176.3084 71 F 4.1740 8.2926 124.1848 61.1232 38.9725 177.5222 72 S 4.2870 8.6859 114.5849 61.5169 63.0519 175.8414 73 N 4.5586 8.2353 119.4922 56.7552 38.4084 177.2807 74 G 3.7185 7.9064 106.3359 47.7357 0.0000 175.4578 75 M 4.0376 7.5510 119.7470 57.7658 31.9853 178.2012 76 K 4.2290 7.7691 117.1432 57.5452 33.1197 176.8121 77 H 4.9453 7.6494 116.9970 55.0738 29.3073 175.9176 78 L 4.1035 8.0008 120.2872 57.2398 41.9110 178.8170 79 D 4.3943 7.9658 117.3157 55.6619 38.5069 176.6347 80 D 4.4501 8.1592 119.3022 52.6706 42.8336 174.6807 81 L 4.4956 8.2500 126.8376 56.0975 42.0573 178.4395 82 K 3.9561 8.0602 119.0721 59.4131 32.2336 178.4214 83 G 3.7482 7.7380 103.9761 47.4408 0.0000 175.7915 84 T 3.9455 7.2479 117.5045 65.9048 68.7729 176.0388 85 F 4.5514 8.0745 117.8829 57.3803 39.2060 177.8989 86 A 4.0028 7.8049 122.9234 55.1258 18.4311 180.0777 87 A 4.0526 7.8349 118.7277 55.5071 18.6912 179.7628 88 L 4.0393 7.9160 116.7763 57.7657 41.7442 179.5578 89 S 4.1528 7.9932 112.8682 61.5676 62.1954 175.9821 90 E 4.0003 8.0901 121.4539 58.7329 28.9029 178.5741 91 L 3.9838 7.7461 120.3556 58.4873 42.2950 178.3699 92 H 4.4252 8.5021 115.5788 58.7379 28.7082 176.1553 93 C 4.9724 7.8263 122.2704 61.1763 31.1844 174.7994 94 D 4.3015 8.1356 121.7506 56.7106 41.2517 177.5712 95 K 4.3658 7.6397 116.5941 56.7079 33.0946 177.1797 96 L 4.6860 7.6093 115.8120 53.6854 44.0675 175.9097 97 H 4.2901 8.0320 113.7900 56.4608 26.8636 175.0612 98 V 3.6292 8.0969 119.1225 62.3448 31.9775 175.0901 99 D 4.1285 8.4871 127.5538 53.1936 41.2947 174.9575 100 P 3.6936 0.0000 0.0000 65.5060 31.2650 177.9856 101 E 3.8992 7.6873 118.3903 59.0909 29.2726 178.2886 102 N 4.3248 7.8725 116.1728 55.5796 38.5006 177.3261 103 F 4.5136 7.2398 118.8273 60.3615 38.9264 177.6119 104 K 4.0338 7.8828 118.2849 59.5230 31.7502 179.3777 105 L 3.8958 7.7045 118.7612 57.5312 41.4694 179.1547 106 L 4.0926 7.8477 120.7018 57.9703 41.9407 179.0601 107 G 3.8147 8.3243 105.7767 48.1306 0.0000 175.4118 108 N 4.4630 8.3294 118.9421 55.8493 38.5278 177.7407 109 V 3.6011 8.0816 119.9536 65.9525 31.6104 177.5406 110 L 3.8867 8.2243 120.4788 58.3590 41.8098 179.2014 111 V 3.5386 7.6324 117.6824 66.0622 31.5191 178.1458 112 V 3.6386 7.8348 118.0129 66.0285 31.2136 178.1404 113 V 3.5604 8.2468 118.4266 65.8546 31.4762 177.9938 114 L 3.8516 8.0200 118.7426 57.6840 41.3889 179.4032 115 A 4.1217 7.7834 120.6408 54.9477 18.0986 179.6274 116 R 3.8435 7.8576 116.2710 59.7289 30.3907 178.0884 117 N 4.5101 7.6629 112.6675 54.2829 38.9044 175.4507 118 F 4.7749 7.6969 116.4718 55.7664 42.7922 177.0293 119 G 3.9053 8.0902 111.6134 46.6392 0.0000 177.5109 120 K 4.1782 9.0120 123.5647 58.6270 32.0958 177.5806 121 E 4.0981 8.1725 119.2336 58.6961 29.9436 177.2381 122 F 4.4867 7.5778 121.6344 56.2247 37.8487 175.5103 123 T 3.9059 7.4037 114.8129 61.0847 70.7240 173.0820 124 P 4.0100 0.0000 0.0000 66.0245 31.1965 179.1486 125 V 3.5481 7.5257 116.4178 65.7103 31.6126 177.7429 126 L 3.9228 7.3684 120.0515 57.5934 41.7627 178.8950 127 Q 3.3948 7.7431 119.9222 58.9040 28.7934 177.7014 128 A 4.0168 7.3499 120.1842 55.4398 18.3092 179.0697 129 D 4.4170 7.9635 117.0648 57.4027 40.9152 178.7629 130 F 4.2009 7.9916 116.4333 59.8703 38.5762 177.7194 131 Q 4.2090 8.1934 118.0757 58.5180 28.4603 178.4928 132 K 4.1158 7.7833 118.6092 58.9268 32.0473 179.5817 133 V 3.4919 7.5167 118.2242 66.2119 31.7574 178.5248 134 V 4.0404 8.1189 111.6854 64.0034 31.4433 178.2962 135 A 4.2622 7.8517 119.6659 54.5096 18.3243 179.8135 136 G 3.4960 7.8992 103.7960 47.7757 0.0000 175.9471 137 V 3.1830 8.1084 120.7645 65.4648 31.2069 177.7622 138 A 3.8777 7.7108 120.4548 55.5806 18.0208 179.4334 139 N 4.6058 8.0980 113.9341 56.2076 38.3733 177.5963 140 A 3.9662 7.5606 122.7679 54.6830 18.5874 178.2275 141 L 4.1241 7.0591 113.4846 55.5790 42.0680 177.2061 142 A 5.2092 7.6273 121.6395 52.2328 19.2612 177.6446 143 H 4.3470 7.8120 119.7724 59.7786 30.0551 177.4648 144 R 4.0821 7.8611 116.4221 58.5648 29.8619 182.3280 145 Y 4.5121 7.5493 113.1439 59.9089 38.8907 175.3667 146 H 4.5450 8.2496 121.2832 56.0583 28.7198 175.0190 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 4.36 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.83 0.00 3 L 8.34 4.33 0.00 1.70 1.54 0.79 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.49 4.47 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 1.19 0.00 0.00 5 A 8.77 4.19 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.02 3.97 0.00 1.99 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 1.97 0.00 7 E 7.79 4.25 0.00 2.04 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 2.40 2.30 0.00 8 K 7.72 3.89 0.00 2.13 1.90 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.40 1.40 7.81 9 A 8.14 4.02 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 7.75 4.15 1.39 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 11 V 7.65 3.78 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 0.51 0.00 0.00 0.74 0.00 0.00 12 T 8.01 4.05 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 1.28 0.00 0.00 13 A 7.78 4.10 1.50 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 0.00 0.00 0.00 0.00 0.00 0.00 14 F 8.53 4.31 0.00 3.27 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.49 4.12 0.00 3.90 3.31 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 16 G 7.71 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 0.00 0.00 0.00 17 K 7.46 4.16 0.00 1.63 1.95 0.00 1.77 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.41 7.81 18 V 6.44 3.47 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 0.00 0.00 -0.00 0.00 0.00 -0.09 0.00 0.00 19 K 8.18 4.15 0.00 1.96 1.87 0.00 1.35 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.33 1.42 7.81 20 V 8.11 3.46 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 1.15 0.00 0.00 0.90 0.00 0.00 21 D 7.99 4.37 0.00 2.76 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 22 E 7.99 4.16 0.00 2.06 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 2.37 1.93 0.00 23 V 7.74 3.56 1.94 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 0.86 0.00 0.00 0.83 0.00 0.00 24 G 7.88 3.70 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 0.00 0.00 0.00 25 G 7.59 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 7.75 3.91 0.00 1.83 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 0.00 2.27 2.29 0.00 27 A 7.88 3.93 1.39 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 28 L 7.86 3.94 0.00 1.91 1.59 0.93 0.30 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 29 G 8.08 3.59 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 0.00 0.00 0.00 30 R 8.37 3.89 0.00 1.90 1.96 0.00 3.11 0.00 0.00 3.06 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 31 L 8.09 4.10 0.00 1.89 1.85 0.91 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.66 4.08 0.00 1.82 1.62 0.63 0.51 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 33 V 7.44 3.53 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 0.72 0.00 0.00 0.95 0.00 0.00 34 V 7.85 3.64 1.51 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 0.17 0.00 0.00 0.78 0.00 0.00 35 Y 7.30 4.01 0.00 2.48 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 36 P 0.00 4.90 0.00 2.25 2.25 0.00 3.91 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.90 0.00 37 W 7.74 4.52 0.00 3.61 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.27 4.22 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 0.71 0.00 0.00 39 Q 7.94 4.31 0.00 2.33 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.83 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 40 R 7.56 3.95 0.00 1.71 1.91 0.00 3.19 0.00 0.00 3.12 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.58 0.00 41 F 8.04 4.10 0.00 3.01 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 42 F 7.94 4.74 0.00 2.84 2.29 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 43 E 8.45 4.11 0.00 2.06 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 0.00 2.43 2.49 0.00 44 S 8.15 4.46 0.00 4.10 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 45 F 8.28 4.40 0.00 3.30 3.24 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 46 G 7.81 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 47 D 9.32 4.99 0.00 2.63 2.57 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 48 L 8.35 4.84 0.00 1.64 1.60 1.03 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.45 4.19 0.00 4.01 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 50 T 7.43 4.56 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 1.21 0.00 0.00 51 A 8.32 4.03 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 52 D 8.05 4.28 0.00 2.69 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 53 A 7.38 4.11 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 54 V 7.77 3.68 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.95 0.00 0.00 55 M 8.04 4.35 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.79 0.00 56 N 7.39 4.86 0.00 2.84 2.80 0.00 0.00 6.89 7.88 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 57 N 7.98 4.42 0.00 3.04 2.77 0.00 0.00 7.15 6.99 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 58 P 0.00 4.28 0.00 2.17 2.07 0.00 3.66 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 59 K 8.01 3.85 0.00 1.73 0.85 0.00 1.64 0.00 0.00 1.04 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.16 1.28 7.81 60 V 8.10 3.86 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.03 0.00 0.00 61 K 8.22 4.03 0.00 1.87 1.85 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.59 7.81 62 A 8.20 4.02 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 63 H 8.54 4.75 0.00 3.72 3.77 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.39 3.70 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 0.00 0.00 0.00 65 K 7.89 4.02 0.00 1.96 1.95 0.00 1.68 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.45 1.64 7.81 66 K 7.53 4.06 0.00 2.15 1.86 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.65 7.81 67 V 7.79 3.78 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 1.10 0.00 0.00 68 L 8.07 4.40 0.00 1.95 1.86 1.13 1.19 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 69 D 8.15 4.56 0.00 2.95 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 70 S 8.27 4.18 0.00 4.05 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 71 F 8.29 4.17 0.00 3.56 3.28 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 72 S 8.69 4.29 0.00 4.21 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 73 N 8.24 4.56 0.00 2.97 2.80 0.00 0.00 7.11 7.31 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 74 G 7.91 3.72 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 0.00 0.00 0.00 75 M 7.55 4.04 0.00 1.73 2.11 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 2.59 0.00 76 K 7.77 4.23 0.00 1.91 1.81 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.72 7.81 77 H 7.65 4.95 0.00 3.08 3.21 0.00 5.62 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.00 4.10 0.00 1.58 1.68 0.85 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.97 4.39 0.00 2.76 2.78 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 80 D 8.16 4.45 0.00 2.76 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 81 L 8.25 4.50 0.00 1.70 1.70 0.85 0.91 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 82 K 8.06 3.96 0.00 1.62 1.78 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.22 1.19 7.81 83 G 7.74 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 84 T 7.25 3.95 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 0.77 0.00 0.00 85 F 8.07 4.55 0.00 3.08 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 86 A 7.80 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 A 7.83 4.05 1.29 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 0.00 0.00 88 L 7.92 4.04 0.00 1.82 1.89 0.97 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 89 S 7.99 4.15 0.00 4.21 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 90 E 8.09 4.00 0.00 2.04 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 2.28 2.29 0.00 91 L 7.75 3.98 0.00 1.81 1.79 0.93 1.09 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 92 H 8.50 4.43 0.00 3.58 3.70 0.00 5.85 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 93 C 7.83 4.97 0.00 2.93 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 94 D 8.14 4.30 0.00 2.64 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 95 K 7.64 4.37 0.00 1.96 1.84 0.00 1.58 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.43 7.81 96 L 7.61 4.69 0.00 1.88 1.82 0.85 1.12 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 97 H 8.03 4.29 0.00 3.44 3.46 0.00 5.66 0.00 0.00 0.00 0.00 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.10 3.63 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 0.19 0.00 0.00 0.78 0.00 0.00 99 D 8.49 4.13 0.00 2.62 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 0.00 100 P 0.00 3.69 0.00 2.04 1.89 0.00 3.21 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.23 0.00 101 E 7.69 3.90 0.00 2.06 1.94 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 2.22 2.33 0.00 102 N 7.87 4.32 0.00 2.52 2.67 0.00 0.00 6.94 7.41 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 0.00 103 F 7.24 4.51 0.00 3.17 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 0.00 104 K 7.88 4.03 0.00 2.02 1.87 0.00 1.59 0.00 0.00 1.88 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.57 7.81 105 L 7.70 3.90 0.00 1.44 0.85 0.81 0.26 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 0.00 106 L 7.85 4.09 0.00 1.76 1.77 0.97 1.14 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 0.00 107 G 8.32 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 0.00 108 N 8.33 4.46 0.00 3.10 2.96 0.00 0.00 6.68 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 0.00 109 V 8.08 3.60 2.28 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 1.06 0.00 0.00 1.17 0.00 0.00 110 L 8.22 3.89 0.00 1.85 1.84 0.81 0.72 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 0.00 111 V 7.63 3.54 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 1.15 0.00 0.00 1.16 0.00 0.00 112 V 7.83 3.64 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 0.95 0.00 0.00 1.06 0.00 0.00 113 V 8.25 3.56 2.17 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 1.07 0.00 0.00 0.95 0.00 0.00 114 L 8.02 3.85 0.00 1.28 0.64 0.46 0.85 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 0.00 115 A 7.78 4.12 1.55 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 0.00 116 R 7.86 3.84 0.00 1.93 1.94 0.00 3.24 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 117 N 7.66 4.51 0.00 2.78 2.52 0.00 0.00 6.89 7.50 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 0.00 118 F 7.70 4.77 0.00 3.42 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 0.00 119 G 8.09 3.91 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 0.00 0.00 0.00 120 K 9.01 4.18 0.00 1.81 1.92 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.39 7.81 121 E 8.17 4.10 0.00 2.22 2.43 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 2.58 2.41 0.00 122 F 7.58 4.49 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 0.00 123 T 7.40 3.91 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 1.18 0.00 0.00 124 P 0.00 4.01 0.00 2.10 2.10 0.00 3.52 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 125 V 7.53 3.55 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 0.99 0.00 0.00 0.89 0.00 0.00 126 L 7.37 3.92 0.00 1.55 1.27 0.95 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.74 3.39 0.00 1.35 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 128 A 7.35 4.02 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 D 7.96 4.42 0.00 2.68 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 0.00 130 F 7.99 4.20 0.00 3.51 3.28 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 0.00 131 Q 8.19 4.21 0.00 2.34 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.82 0.00 0.00 0.00 0.00 0.00 2.65 2.58 0.00 132 K 7.78 4.12 0.00 1.97 1.82 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.60 7.81 133 V 7.52 3.49 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 1.01 0.00 0.00 0.68 0.00 0.00 134 V 8.12 4.04 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 1.08 0.00 0.00 1.14 0.00 0.00 135 A 7.85 4.26 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 0.00 136 G 7.90 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.11 3.18 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.00 0.35 0.00 0.00 138 A 7.71 3.88 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.10 4.61 0.00 2.77 2.92 0.00 0.00 6.92 6.74 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 0.00 140 A 7.56 3.97 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 0.00 141 L 7.06 4.12 0.00 0.80 0.64 0.23 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.63 5.21 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 0.00 143 H 7.81 4.35 0.00 3.33 3.39 0.00 5.95 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 R 7.86 4.08 0.00 1.87 1.82 0.00 3.31 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.22 0.00 145 Y 7.55 4.51 0.00 3.01 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 0.00 146 H 8.25 4.54 0.00 3.10 3.16 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00