NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3791 8.3044 120.3206 55.9046 33.8339 174.8779 2 H 4.7115 8.4029 118.3743 54.8398 29.3415 172.4256 3 L 4.7143 8.0298 120.6007 53.5372 44.8289 177.4179 4 T 4.1240 8.2584 119.6290 62.4693 70.4758 174.2181 5 P 3.9513 0.0000 0.0000 66.2174 31.3139 178.8518 6 E 3.9945 8.0437 116.6015 59.3745 29.5946 179.0519 7 E 3.9852 7.9069 118.2418 59.0381 29.6262 179.2646 8 K 3.8888 8.7872 119.9389 59.5020 32.1715 179.5764 9 S 4.1508 8.1915 114.2558 61.2039 62.7374 176.4705 10 A 3.9861 7.8297 124.0937 54.9609 18.1643 179.4738 11 V 3.4245 7.5516 116.3416 66.4304 31.0543 177.9943 12 T 3.9300 7.9544 114.9703 67.0515 68.2348 176.4557 13 A 4.1180 7.9508 120.7043 54.7412 18.6567 179.0442 14 L 3.9954 7.9452 119.3072 57.7095 42.1677 178.6181 15 W 4.4144 8.6710 128.6411 60.6001 30.3694 177.9946 16 G 3.7800 7.8498 104.0951 47.4507 0.0000 174.7109 17 K 4.3933 7.8014 117.6777 55.4761 32.7764 176.6633 18 V 3.8560 7.1127 120.3588 61.7208 32.4571 175.7682 19 N 4.5447 8.1723 125.0943 52.2557 39.0405 175.6323 20 V 3.5100 8.0449 128.5690 65.6506 31.5503 177.3208 21 D 4.3184 8.0594 118.4048 57.4201 40.8001 178.4436 22 E 3.9175 8.4254 118.7899 59.5316 29.5859 179.6848 23 V 3.5997 7.9061 118.4993 65.6331 31.5796 178.3437 24 G 3.6704 8.4159 106.0354 47.6909 0.0000 175.9825 25 G 3.5865 7.7777 108.7445 47.3949 0.0000 175.4452 26 E 3.8989 8.2228 121.8976 58.6981 29.6492 178.7191 27 A 3.9250 8.0281 120.7916 55.2099 18.6553 179.4357 28 L 4.0030 7.8112 118.5419 58.1276 42.0288 179.4438 29 G 3.5531 8.0816 105.7970 47.8226 0.0000 175.9130 30 R 3.8932 8.3225 121.1073 58.6844 30.0199 178.6983 31 L 4.0227 7.8871 120.1286 58.4938 42.0033 179.2880 32 L 4.0717 7.8570 117.8627 56.9839 41.1950 179.4461 33 V 3.7259 7.0590 117.2918 65.2202 31.9462 177.8626 34 V 3.4189 7.8471 116.9781 64.4338 32.8405 176.3629 35 F 3.9188 7.2074 117.7729 53.7093 38.4408 173.7873 36 P 4.4705 0.0000 0.0000 64.9993 31.0068 178.2929 37 W 4.4264 8.0249 115.4127 58.8762 27.7187 177.5985 38 T 4.2841 7.7910 110.6345 63.5883 68.3208 175.8490 39 Q 4.3861 8.1944 121.5983 57.7774 28.5480 177.8952 40 R 3.8256 7.4706 116.8161 58.4043 29.3079 177.7432 41 F 4.3405 6.9720 115.6008 56.9870 40.5598 175.5229 42 F 4.5932 7.4111 117.7814 56.6220 39.1136 176.8493 43 E 4.1761 8.0186 122.4003 59.2520 30.0056 179.5645 44 S 4.4893 8.0480 110.9750 59.7909 63.4429 174.9993 45 F 4.5200 7.9587 118.9840 58.9664 39.8575 175.3654 46 G 4.0095 7.2586 105.1454 44.4051 0.0000 174.8725 47 D 4.6477 8.7812 126.9985 53.6428 39.9016 175.8445 48 L 4.9087 8.2361 127.6168 54.6520 42.9252 179.0739 49 S 4.3509 8.2731 117.5141 61.0374 63.1594 175.1092 50 T 4.7248 7.3728 109.8982 58.2109 72.9221 172.6440 51 P 4.1850 0.0000 0.0000 66.2003 31.3945 178.2906 52 D 4.3524 8.1952 116.4319 57.7213 40.5874 179.0360 53 A 4.0624 8.0829 119.6082 54.4915 18.4297 179.6419 54 V 3.7710 7.7985 117.1913 66.3962 31.6361 178.2189 55 M 4.1503 8.6081 117.4120 58.0230 31.7951 178.4079 56 G 3.9476 7.9805 104.6271 45.1415 0.0000 173.4020 57 N 4.3567 7.5366 120.8382 52.9792 39.2716 173.6386 58 P 4.2761 0.0000 0.0000 65.9598 31.4031 178.5813 59 K 3.6910 7.9938 117.8094 58.9094 31.8675 179.3848 60 V 3.7514 8.0271 118.6443 66.0241 31.5106 178.2868 61 K 3.9491 8.1010 118.0556 59.4563 31.5607 179.2075 62 A 4.0740 8.1554 121.0001 55.0420 18.3207 179.1955 63 H 4.3771 8.3115 117.1239 59.2155 29.9501 177.6450 64 G 3.6262 8.2589 107.7671 47.7585 0.0000 175.6057 65 K 4.0574 7.9610 121.5615 58.8285 32.1949 179.0114 66 K 3.9937 7.7115 119.9574 59.3054 32.1829 179.0562 67 V 3.5957 7.8513 118.4758 66.2147 31.5214 178.1425 68 L 4.3756 8.1619 118.5098 57.5710 41.3685 179.1318 69 G 3.7889 8.1039 105.7855 47.6877 0.0000 175.2051 70 A 4.1463 8.1527 123.9796 54.5683 18.7935 179.3257 71 F 4.2942 8.4861 118.8007 61.6234 39.4462 177.0246 72 S 4.2628 9.1112 113.2454 62.0228 62.1107 176.0764 73 D 4.5317 8.4719 121.2285 57.0009 40.5196 178.8791 74 G 3.5167 8.0259 108.4940 47.9652 0.0000 175.0413 75 L 3.8901 7.3205 117.9582 55.7599 41.5670 177.2101 76 A 4.5537 7.5413 120.4498 52.4197 19.9518 176.5540 77 H 4.8932 7.8306 113.9894 54.7736 29.8790 175.1795 78 L 3.8909 8.1031 121.9696 57.3897 42.1226 176.7099 79 D 4.7732 7.5251 116.0448 53.9938 41.9042 176.3187 80 N 4.6470 7.8725 113.9440 52.1433 41.2816 175.2011 81 L 4.0243 7.4952 122.6074 57.3633 41.8105 178.8316 82 K 3.9622 8.1580 119.4938 59.8530 31.8960 178.9571 83 G 3.6442 8.0618 104.4012 47.9155 0.0000 175.4666 84 T 3.7941 7.3902 116.8879 65.6159 68.6418 175.9372 85 F 4.7927 8.1052 117.6287 57.0719 39.2141 177.3313 86 A 4.0486 7.5716 121.9425 56.0190 18.1695 180.6509 87 T 3.8755 7.8580 113.3631 66.6463 68.5688 176.6477 88 L 4.1109 7.9591 121.9264 57.8980 42.1880 178.8304 89 S 4.4994 8.5163 115.0688 60.9904 62.3387 175.9724 90 E 3.8925 8.2561 121.3030 59.1889 29.1514 178.9819 91 L 3.9071 7.9051 120.3434 58.7369 42.1912 178.9166 92 H 4.1847 8.2780 115.9438 59.0863 28.3478 176.8811 93 C 3.5582 7.6228 120.5131 62.0620 31.1406 175.2931 94 D 4.4159 8.4177 121.7609 56.0883 40.6106 177.4184 95 K 4.3207 7.8153 117.0308 57.8365 33.5883 177.6149 96 L 4.1479 7.7375 116.0735 55.2262 42.2794 176.3036 97 H 4.1725 7.2184 113.0471 56.6524 26.5559 175.0738 98 V 3.7564 7.7901 118.4125 61.2069 32.4867 174.7726 99 D 4.4053 8.6191 127.2705 53.4198 41.7841 174.9945 100 P 3.2721 0.0000 0.0000 64.9056 31.7699 177.9605 101 E 3.8920 8.2324 118.8674 59.0975 29.3067 178.3504 102 N 4.2589 8.0167 116.8465 56.2797 38.5789 177.2572 103 F 4.4935 7.4251 119.1871 60.5783 39.0606 177.9429 104 R 4.0239 7.7978 117.3747 58.9008 30.0427 178.7389 105 L 3.7398 7.7990 118.8609 57.6235 41.5089 179.2489 106 L 4.0563 8.1025 120.3555 58.0652 41.9860 178.9480 107 G 3.9182 7.9798 105.4232 48.2792 0.0000 175.3453 108 N 4.4320 8.0846 118.7624 55.7172 38.4411 177.7603 109 V 3.6105 7.9064 119.7382 65.8344 31.5747 177.4720 110 L 3.8487 8.6814 121.3153 58.5097 41.8462 179.0857 111 V 3.5615 7.9599 117.7932 66.4194 31.4194 177.8012 112 C 4.1884 7.9912 116.1574 62.5942 27.9035 176.2597 113 V 3.5872 7.9932 120.2747 65.9933 31.0735 178.0774 114 L 3.8458 7.9415 118.7561 57.6623 41.4492 179.4320 115 A 3.7231 7.3894 120.6623 55.0547 18.0577 179.0341 116 H 4.1031 7.9473 115.8822 59.8453 30.0087 177.0151 117 H 3.9437 8.0865 116.3328 58.5308 28.9726 177.1808 118 F 4.6147 8.5112 117.5899 55.4507 39.4714 178.5509 119 G 3.9019 8.8140 108.4120 45.6333 0.0000 175.1773 120 K 3.9070 9.3481 121.8681 59.7689 31.9822 177.2328 121 E 4.0514 8.2423 119.3207 58.3353 29.8196 177.1740 122 F 4.5486 8.1008 122.7956 57.0176 37.9108 175.4668 123 T 4.2097 7.3780 115.3117 59.9675 71.4368 173.5430 124 P 4.1319 0.0000 0.0000 65.7728 31.2767 177.1982 125 P 4.2035 0.0000 0.0000 65.3835 31.2399 178.9304 126 V 3.5861 7.3487 117.4120 65.7589 31.3845 177.8173 127 Q 3.5753 8.2169 119.5023 58.9662 28.6895 178.0678 128 A 3.9885 8.1192 121.5911 55.3540 18.3739 179.5510 129 A 3.9230 7.8471 118.8737 55.4535 18.3301 179.5267 130 Y 3.9264 8.1143 115.4100 61.1552 37.9296 178.4713 131 Q 4.1396 8.7442 119.6690 58.8979 28.7279 178.9186 132 K 4.0424 7.9304 119.7504 59.1558 31.9468 179.7340 133 V 3.4796 7.5340 118.2433 66.0382 31.4304 178.4503 134 V 3.7310 8.2654 112.3640 64.4442 31.3711 178.4283 135 A 4.0882 8.1618 120.5381 55.0573 18.2617 179.7572 136 G 3.5823 8.2117 104.3462 48.0323 0.0000 175.9242 137 V 3.3881 8.4952 121.8036 65.4750 31.6480 177.8121 138 A 3.8937 8.1810 120.6632 55.2973 18.2557 179.3754 139 N 4.2843 8.3541 114.7181 56.3236 38.4010 177.4969 140 A 4.0279 7.8027 120.9093 55.3453 18.7336 179.5051 141 L 3.9118 7.9890 117.3234 57.3150 41.6468 178.9429 142 A 4.3161 7.9435 119.1160 53.1652 18.7276 178.4603 143 H 4.1046 7.7864 116.7776 59.2403 29.8791 175.9500 144 K 4.3951 8.2981 115.4892 56.3676 32.0687 176.5329 145 Y 4.1703 8.0105 117.7279 58.4387 38.4096 175.7254 146 H 4.4489 8.3109 117.6802 56.1797 28.2594 173.2942 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 M 8.30 4.38 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.54 0.00 2 H 8.40 4.71 0.00 3.14 3.22 0.00 5.71 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 3 L 8.03 4.71 0.00 1.57 1.47 0.80 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.26 4.12 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 1.24 0.00 0.00 5 P 0.00 3.95 0.00 2.05 2.10 0.00 3.81 0.00 0.00 3.72 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 6 E 8.04 3.99 0.00 2.02 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 2.38 2.44 0.00 7 E 7.91 3.99 0.00 2.15 1.91 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 2.35 2.34 0.00 8 K 8.79 3.89 0.00 1.85 1.79 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.48 7.81 9 S 8.19 4.15 0.00 4.05 4.28 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 10 A 7.83 3.99 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 7.55 3.42 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 0.51 0.00 0.00 0.56 0.00 0.00 12 T 7.95 3.93 4.51 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 0.00 0.00 0.00 1.28 0.00 0.00 13 A 7.95 4.12 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 14 L 7.95 4.00 0.00 1.83 2.06 0.40 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.67 4.41 0.00 3.79 3.36 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 16 G 7.85 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.80 4.39 0.00 2.10 2.16 0.00 1.96 0.00 0.00 1.77 0.00 0.00 3.17 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.48 7.81 18 V 7.11 3.86 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 -0.07 0.00 0.00 0.69 0.00 0.00 19 N 8.17 4.54 0.00 2.70 2.60 0.00 0.00 6.83 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 20 V 8.04 3.51 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 1.20 0.00 0.00 0.88 0.00 0.00 21 D 8.06 4.32 0.00 3.00 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 8.43 3.92 0.00 1.96 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 2.29 2.42 0.00 23 V 7.91 3.60 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 0.88 0.00 0.00 0.64 0.00 0.00 24 G 8.42 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.78 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 26 E 8.22 3.90 0.00 2.28 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 2.29 2.32 0.00 27 A 8.03 3.93 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 28 L 7.81 4.00 0.00 1.76 1.63 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.08 3.55 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 30 R 8.32 3.89 0.00 1.91 1.96 0.00 3.11 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 31 L 7.89 4.02 0.00 1.92 1.93 0.97 0.80 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 32 L 7.86 4.07 0.00 1.88 1.71 0.79 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.06 3.73 2.18 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 0.73 0.00 0.00 0.91 0.00 0.00 34 V 7.85 3.42 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 -0.03 0.00 0.00 0.80 0.00 0.00 35 F 7.21 3.92 0.00 2.70 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 36 P 0.00 4.47 0.00 2.36 2.36 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.93 0.00 37 W 8.02 4.43 0.00 3.58 3.52 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 38 T 7.79 4.28 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 1.06 0.00 0.00 39 Q 8.19 4.39 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 40 R 7.47 3.83 0.00 1.55 1.83 0.00 2.96 0.00 0.00 2.59 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.50 0.00 41 F 6.97 4.34 0.00 1.54 2.44 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 0.00 42 F 7.41 4.59 0.00 2.90 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 0.00 0.00 0.00 43 E 8.02 4.18 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.20 0.00 44 S 8.05 4.49 0.00 4.11 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 7.96 4.52 0.00 3.22 3.16 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 46 G 7.26 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 0.00 0.00 0.00 47 D 8.78 4.65 0.00 2.67 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 48 L 8.24 4.91 0.00 1.73 1.61 1.06 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.27 4.35 0.00 3.93 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 50 T 7.37 4.72 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 1.21 0.00 0.00 51 P 0.00 4.18 0.00 2.15 2.13 0.00 3.60 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 2.10 2.17 0.00 52 D 8.20 4.35 0.00 2.67 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 53 A 8.08 4.06 1.40 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 54 V 7.80 3.77 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 1.07 0.00 0.00 0.97 0.00 0.00 55 M 8.61 4.15 0.00 1.97 2.10 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 2.61 2.84 0.00 56 G 7.98 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 0.00 0.00 0.00 57 N 7.54 4.36 0.00 2.91 2.94 0.00 0.00 6.79 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 58 P 0.00 4.28 0.00 2.25 2.26 0.00 3.74 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 7.99 3.69 0.00 1.77 0.74 0.00 1.35 0.00 0.00 1.25 0.00 0.00 2.80 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.12 1.27 7.81 60 V 8.03 3.75 2.30 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 1.02 0.00 0.00 1.07 0.00 0.00 61 K 8.10 3.95 0.00 2.00 1.82 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.19 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.49 7.81 62 A 8.16 4.07 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.31 4.38 0.00 3.58 3.45 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 8.26 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 65 K 7.96 4.06 0.00 1.96 1.82 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.45 7.81 66 K 7.71 3.99 0.00 2.04 1.95 0.00 1.75 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.50 7.81 67 V 7.85 3.60 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 1.00 0.00 0.00 0.89 0.00 0.00 68 L 8.16 4.38 0.00 1.96 1.86 1.18 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.10 3.79 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 0.00 0.00 0.00 0.00 70 A 8.15 4.15 1.54 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 0.00 0.00 71 F 8.49 4.29 0.00 3.28 3.30 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 72 S 9.11 4.26 0.00 4.60 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 73 D 8.47 4.53 0.00 2.74 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 74 G 8.03 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.32 3.89 0.00 1.50 1.43 -0.33 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.54 4.55 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 77 H 7.83 4.89 0.00 3.04 3.14 0.00 5.83 0.00 0.00 0.00 0.00 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.10 3.89 0.00 1.47 1.61 0.72 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.53 4.77 0.00 2.64 2.61 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 80 N 7.87 4.65 0.00 2.68 2.60 0.00 0.00 7.22 6.36 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 81 L 7.50 4.02 0.00 1.78 1.89 0.88 0.88 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 82 K 8.16 3.96 0.00 1.81 1.76 0.00 1.51 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.23 1.39 7.81 83 G 8.06 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.39 3.79 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 85 F 8.11 4.79 0.00 3.10 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 86 A 7.57 4.05 1.40 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 87 T 7.86 3.88 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 88 L 7.96 4.11 0.00 1.89 1.98 1.04 1.09 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 8.52 4.50 0.00 4.19 4.07 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 90 E 8.26 3.89 0.00 2.06 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 2.33 2.55 0.00 91 L 7.91 3.91 0.00 1.86 1.89 0.91 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.28 4.18 0.00 3.63 3.80 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.62 3.56 0.00 1.62 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 94 D 8.42 4.42 0.00 2.72 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 95 K 7.82 4.32 0.00 1.86 1.79 0.00 1.55 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.40 7.81 96 L 7.74 4.15 0.00 1.73 1.64 0.72 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.22 4.17 0.00 3.47 3.44 0.00 5.64 0.00 0.00 0.00 0.00 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.79 3.76 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 0.10 0.00 0.00 0.56 0.00 0.00 99 D 8.62 4.41 0.00 2.80 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 0.00 100 P 0.00 3.27 0.00 1.92 1.82 0.00 3.36 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.44 0.00 101 E 8.23 3.89 0.00 2.02 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 102 N 8.02 4.26 0.00 2.47 2.65 0.00 0.00 6.90 7.81 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 0.00 103 F 7.43 4.49 0.00 3.10 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.80 4.02 0.00 2.00 1.95 0.00 3.26 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 105 L 7.80 3.74 0.00 1.69 1.29 0.62 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.10 4.06 0.00 1.80 1.72 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 107 G 7.98 3.92 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 0.00 0.00 0.00 108 N 8.08 4.43 0.00 2.96 2.95 0.00 0.00 6.72 6.96 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 0.00 109 V 7.91 3.61 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 1.17 0.00 0.00 1.16 0.00 0.00 110 L 8.68 3.85 0.00 1.70 1.87 0.86 0.21 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 0.00 111 V 7.96 3.56 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 1.29 0.00 0.00 1.17 0.00 0.00 112 C 7.99 4.19 0.00 3.24 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 0.00 113 V 7.99 3.59 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 0.99 0.00 0.00 0.96 0.00 0.00 114 L 7.94 3.85 0.00 0.95 1.03 0.70 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.39 3.72 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 0.00 116 H 7.95 4.10 0.00 3.23 3.57 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.09 3.94 0.00 2.85 2.65 0.00 5.70 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 0.00 118 F 8.51 4.61 0.00 3.26 3.13 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 0.00 119 G 8.81 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 9.35 3.91 0.00 1.92 2.05 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.67 1.54 7.81 121 E 8.24 4.05 0.00 2.36 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 2.36 2.34 0.00 122 F 8.10 4.55 0.00 3.07 3.16 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 0.00 123 T 7.38 4.21 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 1.31 0.00 0.00 124 P 0.00 4.13 0.00 2.15 2.15 0.00 3.57 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 2.11 2.20 0.00 125 P 0.00 4.20 0.00 2.12 2.06 0.00 3.45 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 2.08 2.11 0.00 126 V 7.35 3.59 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 1.03 0.00 0.00 0.90 0.00 0.00 127 Q 8.22 3.58 0.00 1.54 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 128 A 8.12 3.99 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 0.00 129 A 7.85 3.92 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 0.00 130 Y 8.11 3.93 0.00 3.44 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 0.00 131 Q 8.74 4.14 0.00 2.21 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.77 2.61 0.00 132 K 7.93 4.04 0.00 1.86 1.83 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.46 1.63 7.81 133 V 7.53 3.48 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 0.80 0.00 0.00 0.77 0.00 0.00 134 V 8.27 3.73 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 1.04 0.00 0.00 1.11 0.00 0.00 135 A 8.16 4.09 1.40 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 0.00 136 G 8.21 3.58 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 0.00 137 V 8.50 3.39 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 0.65 0.00 0.00 0.70 0.00 0.00 138 A 8.18 3.89 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 0.00 139 N 8.35 4.28 0.00 2.98 2.88 0.00 0.00 6.93 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 7.80 4.03 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.99 3.91 0.00 1.33 0.72 -0.08 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.94 4.32 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 7.79 4.10 0.00 3.31 3.66 0.00 5.75 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.30 4.40 0.00 1.82 1.82 0.00 1.68 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.50 1.79 7.81 145 Y 8.01 4.17 0.00 3.13 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 0.00 146 H 8.31 4.45 0.00 3.22 3.24 0.00 5.75 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