NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.7610 8.0544 120.3438 62.1821 33.4405 174.5282 2 H 4.5941 7.7460 118.9846 54.1159 31.3205 171.6134 3 W 4.8742 8.2156 127.0305 54.9666 31.5437 176.4859 4 S 4.3816 8.8814 118.5833 57.9102 64.8152 175.3259 5 A 4.0169 8.5019 124.5802 55.3336 18.1960 179.7527 6 E 3.9366 8.1532 117.4879 59.3439 29.6604 178.8305 7 E 3.9846 8.1773 118.7808 59.2090 29.5390 179.2795 8 K 3.6644 7.8028 118.7075 59.4683 32.0720 179.3408 9 Q 3.9881 7.8791 117.3487 59.0949 28.4708 178.3455 10 L 3.9659 7.8526 122.4019 57.8409 42.1625 179.0983 11 I 3.8351 7.8944 113.3345 64.2104 37.1851 178.1060 12 T 4.0028 8.1850 118.4061 66.3560 68.1300 176.5920 13 G 3.7876 8.2018 106.3606 47.9391 0.0000 175.0566 14 L 3.9804 7.7648 121.7563 57.5373 42.1361 178.5406 15 W 4.5958 8.8077 128.6662 60.7901 30.3889 178.0711 16 G 3.7203 7.8930 103.7348 46.9258 0.0000 174.0751 17 K 4.4016 7.7578 117.9426 56.0747 32.9130 176.8665 18 V 3.5727 7.3648 120.5602 62.6192 31.8871 175.9747 19 N 4.4690 8.2873 125.6998 52.1035 38.5400 175.0493 20 V 3.4787 8.0326 127.4008 65.8327 31.5988 177.3836 21 A 3.9506 7.7750 119.6460 55.3162 18.3747 179.2801 22 D 4.2506 7.8610 116.8847 57.8040 40.9788 178.7429 23 C 4.0814 8.1295 117.3739 62.3628 28.1026 176.4515 24 G 3.5819 8.1331 107.2579 47.8579 0.0000 175.7074 25 A 4.0308 8.0210 123.8555 54.5938 18.3839 179.3962 26 E 3.8338 8.4053 117.7798 59.2490 29.7395 178.9016 27 A 3.9567 8.2240 121.1651 55.1563 18.5828 179.4300 28 L 3.9025 7.9193 118.4958 58.0883 42.2497 178.9804 29 A 3.9617 8.0589 120.8326 55.2819 18.3276 179.8792 30 R 3.8353 8.0732 116.5720 59.1093 30.1215 179.0592 31 L 4.0595 7.9032 120.2928 58.1978 41.9166 179.0320 32 L 4.1104 7.5156 118.4172 56.4008 41.5708 178.7915 33 I 4.0192 7.1339 118.5000 63.4266 37.7574 177.9347 34 V 3.7531 7.7747 111.4879 61.8613 33.1761 176.1335 35 Y 4.2547 6.9416 115.4836 54.0612 38.1363 173.8948 36 P 4.2994 0.0000 0.0000 65.5606 32.0841 177.9155 37 W 4.4131 8.2051 114.7807 59.3895 27.6492 178.0677 38 T 4.3535 7.4979 110.6142 64.3951 68.0948 176.3910 39 Q 4.3043 8.1849 121.4260 58.7798 28.4030 178.2282 40 R 3.8155 7.7501 119.0452 59.5343 30.0463 178.1363 41 F 4.1880 7.8533 115.6322 58.7522 39.1221 175.9461 42 F 4.6077 7.9965 118.3387 56.5687 39.4958 177.8816 43 S 4.1598 8.2774 118.4663 61.5135 62.6857 175.7561 44 S 4.5355 8.0862 112.6235 59.3959 62.9767 174.3961 45 F 4.6621 8.5962 119.7941 57.9796 40.1842 176.5218 46 G 4.0094 7.5587 110.1735 45.2531 0.0000 176.4811 47 N 4.5483 8.8296 127.2178 53.4156 38.4170 174.2295 48 L 4.9062 8.1643 128.0809 54.4879 43.1411 177.7433 49 S 4.4093 8.3793 114.3458 60.0389 63.9034 174.2240 50 S 4.6622 7.5731 115.1545 55.3173 66.8848 172.7534 51 P 4.2224 0.0000 0.0000 66.2346 31.0855 179.0777 52 T 3.8059 7.8636 113.5207 66.6108 68.4108 176.2547 53 A 4.0174 8.0823 122.5999 55.2662 18.1431 179.7704 54 I 3.6495 7.9091 117.4655 64.6570 37.3475 178.6107 55 L 4.2075 8.3064 118.5429 56.9667 41.4464 178.9417 56 G 3.9343 7.8045 104.3865 44.6159 0.0000 173.7103 57 N 4.3487 7.9515 120.9388 53.2456 39.4906 173.8055 58 P 4.2713 0.0000 0.0000 65.8618 31.4626 178.6380 59 M 3.8367 7.7966 117.2512 57.9397 31.7341 178.7190 60 V 3.7887 7.6585 117.9858 66.0415 31.6620 177.7972 61 R 3.8426 7.8967 118.0430 59.4798 29.7246 178.3614 62 A 3.9958 8.4050 120.8942 55.4286 18.4118 179.1044 63 H 4.3325 8.9545 117.3420 59.2860 30.0867 177.4673 64 G 3.8035 8.4405 107.8683 47.8443 0.0000 175.4118 65 K 3.9921 7.8425 121.8573 59.2582 32.2598 178.9609 66 K 4.0028 7.8091 118.6461 59.4657 32.0416 179.4421 67 V 3.6819 7.9032 118.4022 66.1250 31.3027 177.9476 68 L 4.4662 7.8756 118.3924 58.4471 42.2455 178.6820 69 T 4.3175 8.3631 116.1325 66.6757 68.4283 176.4526 70 S 4.0843 8.3325 115.1275 61.5055 62.4935 176.3064 71 F 4.2949 8.3861 120.1076 60.1192 38.6169 177.9571 72 G 2.8031 7.9392 105.6021 47.3591 0.0000 175.5934 73 D 4.2767 7.6766 119.5842 57.0432 40.5075 178.6873 74 A 4.0153 7.6154 120.2281 55.1054 18.5839 179.4462 75 V 3.2856 7.0735 115.4009 65.3800 31.5315 177.7063 76 K 4.1960 7.4803 116.3235 56.7374 33.3049 176.5366 77 N 5.0097 7.6261 116.6801 51.7192 38.9687 175.7908 78 L 3.8489 7.7739 120.2282 57.4234 42.4511 176.7538 79 D 4.9966 7.9987 115.2049 54.3626 42.6960 176.4413 80 N 4.9858 7.8922 117.8127 53.4284 40.2400 176.6957 81 I 3.8870 7.8949 122.0855 63.8516 37.0493 177.5976 82 K 3.9694 8.0755 118.0201 59.6938 32.3887 178.3884 83 N 4.4485 8.1489 115.8345 56.9247 38.3422 177.2672 84 T 3.7161 7.4226 115.0885 65.9412 68.6765 175.4946 85 F 4.6231 7.8463 116.0498 56.7829 39.0208 177.1041 86 A 3.9864 7.7370 122.6702 55.6492 18.3176 179.9907 87 Q 3.9874 7.9825 117.0339 58.9434 29.1739 177.9519 88 L 4.1083 7.8740 119.8955 57.5039 41.6847 179.0104 89 S 4.0940 8.4258 113.6706 61.4561 62.2505 176.1544 90 E 4.1402 7.8793 121.9254 58.5164 29.1406 178.9348 91 L 3.9012 7.8138 120.0884 58.7154 42.2608 178.8938 92 H 4.2575 8.4725 116.1090 58.7830 28.2955 177.6833 93 C 4.2285 8.3546 118.5251 62.8049 28.3088 175.8227 94 D 4.3797 8.1948 120.1710 56.3722 41.0268 178.9097 95 K 4.2021 7.9706 116.9474 58.0238 32.8631 177.5532 96 L 4.3903 7.9708 116.9969 54.7188 42.5639 176.1905 97 H 4.2250 7.5084 112.7900 56.7227 26.4089 175.2025 98 V 3.7944 7.8246 118.7072 61.9941 32.3226 174.8491 99 D 4.3635 8.5589 126.9105 53.2118 42.0260 174.9101 100 P 3.1239 0.0000 0.0000 65.5859 31.8362 178.2321 101 E 3.9397 8.4101 117.7613 59.3837 29.1914 179.0432 102 N 4.4387 8.2760 116.8224 56.0219 38.5076 177.4643 103 F 4.5510 7.5729 119.5464 60.5465 38.8321 177.6087 104 R 4.0197 8.0326 118.0013 59.4253 29.9595 178.4668 105 L 4.0093 7.8500 118.8044 57.5928 41.5832 179.1919 106 L 4.1920 8.3369 120.6015 58.1166 42.0546 179.2258 107 G 3.7878 8.3810 105.7833 47.9731 0.0000 175.4571 108 D 4.4860 8.1183 121.0141 57.1687 40.7833 178.8219 109 I 3.7543 7.9070 120.4684 64.2909 37.1288 178.1803 110 L 3.8469 8.0650 121.1240 58.0426 41.8769 179.0503 111 I 3.6496 7.6592 119.9333 64.4934 37.2614 178.5816 112 I 3.7364 7.8826 113.7051 63.8214 36.8501 178.3844 113 V 3.5481 7.8902 120.5501 65.7579 31.3149 178.0170 114 L 3.8584 7.7789 118.6086 57.2277 41.3120 179.2652 115 A 3.5157 7.3315 120.6769 54.9430 18.1202 179.5684 116 A 4.1144 7.6316 117.5846 54.8869 18.4726 178.7918 117 H 4.1826 7.4737 112.7272 56.7834 29.3239 176.4914 118 F 4.5346 8.0474 117.3342 56.8714 40.9445 176.1888 119 A 3.6108 8.9160 122.6946 52.5476 17.3776 179.3112 120 K 3.7287 8.9991 112.4282 60.6225 32.2722 177.7822 121 E 4.0921 7.9718 118.5261 58.6601 29.8219 177.1742 122 F 4.5904 8.5896 123.1521 56.9870 37.8791 175.3144 123 T 4.1741 7.4889 116.0660 60.1778 71.2810 173.4833 124 P 4.2157 0.0000 0.0000 65.9678 31.1651 178.7641 125 D 4.3602 7.9648 117.1579 57.1698 40.7416 178.2918 126 C 4.1001 7.7473 119.2142 62.4153 31.5745 175.2403 127 Q 3.5617 7.8788 121.3106 59.0560 28.5683 178.1149 128 A 4.0332 8.0913 121.4563 55.2299 18.4084 179.5224 129 A 4.0304 7.8661 119.3128 55.2011 18.3883 179.9883 130 W 3.9691 8.3945 117.5581 59.6276 29.1296 178.5834 131 Q 4.1102 8.8244 120.2261 59.0890 28.5350 178.2951 132 K 3.9123 8.1253 120.5795 59.4974 32.2904 178.4011 133 L 4.3161 8.2152 120.6062 58.4449 41.9838 179.1959 134 V 3.9725 8.3827 118.4026 66.0738 31.3868 178.2722 135 R 4.0732 8.1594 118.0958 58.8621 29.8317 179.1963 136 V 3.5694 8.0113 118.3104 65.9506 31.6881 178.2765 137 V 3.0914 7.8887 117.7863 65.6997 31.2749 177.8098 138 A 3.8334 7.9807 120.5032 55.4227 18.0336 179.0935 139 H 4.0943 8.3757 115.7439 59.3901 30.0371 177.1728 140 A 4.1071 8.1803 121.8091 54.6721 18.1807 179.0838 141 L 4.0343 7.2730 116.3000 56.5862 43.0287 178.2898 142 A 4.9925 7.9701 122.0609 51.4383 16.0620 176.4871 143 R 4.3810 7.5919 126.2175 57.5905 32.1920 177.9811 144 K 3.7359 7.0937 114.6140 58.8603 31.9386 176.1448 145 Y 4.3435 7.5317 114.1829 57.7682 39.8613 175.2305 146 H 4.4289 8.5434 123.6000 56.8333 30.9748 174.4896 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 V 8.05 3.76 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 0.93 0.00 0.00 0.85 0.00 0.00 2 H 7.75 4.59 0.00 3.10 3.07 0.00 5.96 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 W 8.22 4.87 0.00 3.23 3.02 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 0.00 0.00 0.00 4 S 8.88 4.38 0.00 4.09 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 5 A 8.50 4.02 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 6 E 8.15 3.94 0.00 2.03 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 2.35 0.00 7 E 8.18 3.98 0.00 2.42 2.19 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 2.40 2.42 0.00 8 K 7.80 3.66 0.00 1.83 1.72 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.12 1.57 7.81 9 Q 7.88 3.99 0.00 2.30 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.53 2.47 0.00 10 L 7.85 3.97 0.00 2.13 1.74 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.89 3.84 0.62 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.31 0.46 0.00 0.00 12 T 8.18 4.00 4.32 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 1.24 0.00 0.00 13 G 8.20 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 14 L 7.76 3.98 0.00 2.30 1.93 0.81 -0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.81 4.60 0.00 3.70 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 7.89 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 17 K 7.76 4.40 0.00 2.13 2.08 0.00 1.85 0.00 0.00 1.83 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.42 7.81 18 V 7.36 3.57 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 0.41 0.00 0.00 0.95 0.00 0.00 19 N 8.29 4.47 0.00 2.70 2.58 0.00 0.00 6.82 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 8.03 3.48 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.72 0.00 0.00 21 A 7.78 3.95 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 22 D 7.86 4.25 0.00 2.62 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 23 C 8.13 4.08 0.00 2.92 2.80 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 24 G 8.13 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 25 A 8.02 4.03 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 26 E 8.41 3.83 0.00 2.20 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 2.33 0.00 27 A 8.22 3.96 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 28 L 7.92 3.90 0.00 1.90 1.66 0.62 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.06 3.96 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 30 R 8.07 3.84 0.00 2.08 1.93 0.00 3.09 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 31 L 7.90 4.06 0.00 1.85 1.83 1.07 0.80 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 32 L 7.52 4.11 0.00 1.74 1.67 0.69 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.13 4.02 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.60 0.84 0.00 0.00 34 V 7.77 3.75 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 -0.52 0.00 0.00 35 Y 6.94 4.25 0.00 2.62 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 4.30 0.00 2.28 2.18 0.00 3.61 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 37 W 8.21 4.41 0.00 3.61 3.56 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 38 T 7.50 4.35 4.45 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 1.03 0.00 0.00 39 Q 8.18 4.30 0.00 2.29 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 40 R 7.75 3.82 0.00 1.78 1.83 0.00 3.14 0.00 0.00 2.96 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.52 0.00 41 F 7.85 4.19 0.00 2.71 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 8.00 4.61 0.00 2.88 2.31 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 43 S 8.28 4.16 0.00 4.03 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 44 S 8.09 4.54 0.00 4.14 4.14 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 45 F 8.60 4.66 0.00 3.21 3.18 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 46 G 7.56 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 N 8.83 4.55 0.00 2.72 2.79 0.00 0.00 6.59 7.78 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 48 L 8.16 4.91 0.00 1.65 1.61 1.08 1.09 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 49 S 8.38 4.41 0.00 3.99 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 S 7.57 4.66 0.00 4.01 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 51 P 0.00 4.22 0.00 2.16 2.13 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 52 T 7.86 3.81 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 1.20 0.00 0.00 53 A 8.08 4.02 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 54 I 7.91 3.65 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.68 0.88 0.00 0.00 55 L 8.31 4.21 0.00 1.56 1.71 0.93 0.82 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 56 G 7.80 3.93 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 0.00 0.00 0.00 57 N 7.95 4.35 0.00 2.97 2.85 0.00 0.00 7.04 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.27 0.00 2.14 2.04 0.00 3.61 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 59 M 7.80 3.84 0.00 0.66 1.62 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.30 0.00 60 V 7.66 3.79 2.31 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 1.10 0.00 0.00 1.06 0.00 0.00 61 R 7.90 3.84 0.00 2.07 2.08 0.00 3.13 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 62 A 8.41 4.00 1.34 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 0.00 0.00 63 H 8.95 4.33 0.00 3.59 3.65 0.00 5.81 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 8.44 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 0.00 0.00 0.00 65 K 7.84 3.99 0.00 1.83 2.02 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.52 7.81 66 K 7.81 4.00 0.00 1.99 1.90 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.69 7.81 67 V 7.90 3.68 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.99 0.00 0.00 68 L 7.88 4.47 0.00 1.99 1.90 1.09 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.36 4.32 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 1.30 0.00 0.00 70 S 8.33 4.08 0.00 4.05 4.14 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 71 F 8.39 4.29 0.00 3.54 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 72 G 7.94 2.80 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 0.00 0.00 0.00 73 D 7.68 4.28 0.00 2.66 2.50 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 74 A 7.62 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.07 3.29 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 0.65 0.00 0.00 0.43 0.00 0.00 76 K 7.48 4.20 0.00 1.66 1.78 0.00 1.75 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.41 1.43 7.81 77 N 7.63 5.01 0.00 2.86 2.69 0.00 0.00 6.43 6.22 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 78 L 7.77 3.85 0.00 1.24 1.36 0.25 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 79 D 8.00 5.00 0.00 2.71 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 80 N 7.89 4.99 0.00 2.77 2.71 0.00 0.00 7.03 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 81 I 7.89 3.89 2.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.03 1.04 0.00 0.00 82 K 8.08 3.97 0.00 1.75 1.90 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.51 7.81 83 N 8.15 4.45 0.00 2.71 2.84 0.00 0.00 6.98 7.05 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 84 T 7.42 3.72 4.17 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 0.51 0.00 0.00 85 F 7.85 4.62 0.00 3.01 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 86 A 7.74 3.99 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 87 Q 7.98 3.99 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.86 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 88 L 7.87 4.11 0.00 2.03 1.81 1.02 0.88 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 89 S 8.43 4.09 0.00 3.97 4.03 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 0.00 0.00 0.00 90 E 7.88 4.14 0.00 2.19 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 2.28 2.36 0.00 91 L 7.81 3.90 0.00 1.78 1.82 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.47 4.26 0.00 3.43 3.60 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.35 4.23 0.00 2.85 2.52 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 94 D 8.19 4.38 0.00 2.77 2.65 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 0.00 0.00 0.00 0.00 95 K 7.97 4.20 0.00 1.88 1.85 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.37 7.81 96 L 7.97 4.39 0.00 1.82 1.77 0.76 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.51 4.23 0.00 3.51 3.50 0.00 5.65 0.00 0.00 0.00 0.00 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.82 3.79 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 0.33 0.00 0.00 0.10 0.00 0.00 99 D 8.56 4.36 0.00 2.69 2.45 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 0.00 100 P 0.00 3.12 0.00 1.95 2.00 0.00 3.33 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 1.43 1.82 0.00 101 E 8.41 3.94 0.00 2.10 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 2.25 2.43 0.00 102 N 8.28 4.44 0.00 2.61 2.88 0.00 0.00 6.94 8.24 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 0.00 103 F 7.57 4.55 0.00 3.20 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 0.00 104 R 8.03 4.02 0.00 1.89 2.19 0.00 3.34 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.69 0.00 105 L 7.85 4.01 0.00 1.77 1.34 0.52 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.34 4.19 0.00 1.92 1.98 1.03 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.38 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 0.00 108 D 8.12 4.49 0.00 2.92 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 0.00 109 I 7.91 3.75 2.08 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.10 0.99 0.00 0.00 110 L 8.07 3.85 0.00 1.79 1.81 0.66 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 111 I 7.66 3.65 2.12 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.01 1.16 0.00 0.00 112 I 7.88 3.74 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.60 1.01 0.00 0.00 113 V 7.89 3.55 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 0.87 0.00 0.00 0.94 0.00 0.00 114 L 7.78 3.86 0.00 1.09 1.08 0.01 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.33 3.52 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.63 4.11 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 0.00 117 H 7.47 4.18 0.00 3.01 2.77 0.00 5.80 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.05 4.53 0.00 3.21 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 0.00 119 A 8.92 3.61 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 9.00 3.73 0.00 1.80 1.97 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.50 7.81 121 E 7.97 4.09 0.00 2.02 2.39 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 2.38 2.32 0.00 122 F 8.59 4.59 0.00 2.98 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 0.00 123 T 7.49 4.17 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 1.32 0.00 0.00 124 P 0.00 4.22 0.00 2.15 2.13 0.00 3.57 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 2.11 2.17 0.00 125 D 7.96 4.36 0.00 2.66 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 0.00 126 C 7.75 4.10 0.00 2.93 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.88 3.56 0.00 1.59 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 128 A 8.09 4.03 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 0.00 129 A 7.87 4.03 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 0.00 130 W 8.39 3.97 0.00 3.65 3.51 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 0.00 131 Q 8.82 4.11 0.00 2.44 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 132 K 8.13 3.91 0.00 1.89 2.11 0.00 1.48 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.30 0.00 0.00 0.00 0.00 1.19 1.21 7.81 133 L 8.22 4.32 0.00 1.78 1.83 1.09 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.38 3.97 2.45 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 1.10 0.00 0.00 1.19 0.00 0.00 135 R 8.16 4.07 0.00 2.20 1.97 0.00 3.20 0.00 0.00 3.11 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 136 V 8.01 3.57 2.37 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 1.16 0.00 0.00 0.89 0.00 0.00 137 V 7.89 3.09 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 -0.12 0.00 0.00 0.70 0.00 0.00 138 A 7.98 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 139 H 8.38 4.09 0.00 3.24 3.51 0.00 5.96 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 8.18 4.11 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 0.00 141 L 7.27 4.03 0.00 1.24 1.09 -0.12 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.97 4.99 1.44 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 0.00 0.00 143 R 7.59 4.38 0.00 1.98 1.86 0.00 3.16 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.39 0.00 144 K 7.09 3.74 0.00 1.37 1.46 0.00 1.52 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.37 7.81 145 Y 7.53 4.34 0.00 2.92 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 H 8.54 4.43 0.00 3.56 3.29 0.00 5.95 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