NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.6097 8.4249 119.1965 53.5904 39.9936 174.1736 3 C 4.3972 8.1814 121.3937 53.5017 43.1313 171.2576 4 P 4.3484 0.0000 0.0000 62.2206 32.2473 177.7075 5 L 4.0544 8.4858 120.6580 57.2188 41.6307 177.9553 6 D 4.8507 8.1807 116.3288 52.5298 39.6235 175.5202 7 W 4.5127 7.9124 118.5328 55.1950 32.4687 175.1825 8 L 4.2158 8.6275 125.0215 52.8482 42.6017 173.9075 9 P 4.7891 0.0000 0.0000 62.6999 32.3025 176.3913 10 M 4.3383 10.1182 125.1078 55.5719 34.8429 174.2817 11 N 4.3638 10.0049 126.6541 54.4076 36.2438 175.2552 12 G 3.9935 8.4026 105.1290 44.8979 0.0000 172.6761 13 L 4.8037 7.7048 118.5640 53.0468 45.7169 174.5291 14 C 5.5736 8.9012 117.4046 55.6045 41.5428 173.1853 15 Y 5.4695 8.8647 120.2657 56.4637 41.8673 174.6609 16 K 4.8758 8.7947 121.5109 55.9349 35.9784 174.5259 17 I 4.4981 8.2793 121.2032 60.1956 39.2967 174.8656 18 F 4.2499 8.7188 124.5568 55.4831 40.6380 176.4769 19 N 4.4224 8.7808 121.2254 55.2678 38.9630 175.5822 20 Q 4.2142 7.8631 118.3187 56.0742 30.0185 175.2162 21 L 5.5266 8.4186 123.0487 53.2335 43.1241 176.0408 22 K 4.8784 8.6349 121.4770 55.0625 37.3256 175.7278 23 T 5.4879 8.4464 111.0697 60.5591 69.9259 175.2310 24 W 2.6646 8.4678 132.0780 60.2871 30.3335 177.3203 25 E 3.8466 8.4171 118.3544 59.8621 29.1342 178.6435 26 D 4.3039 8.0545 117.6037 56.3747 40.6767 178.7527 27 A 2.9566 7.3165 121.9937 54.4840 18.5003 178.9268 28 E 3.4997 7.3233 117.8374 59.8403 29.6192 179.0444 29 M 4.0602 7.8420 118.4345 58.2521 31.6959 178.6478 30 F 3.9727 7.5667 119.8051 61.2094 39.7701 176.4148 31 C 4.4767 8.4076 116.3280 60.2794 39.8840 176.1565 32 R 3.8818 8.0351 119.6959 58.0201 29.6846 178.2551 33 K 4.2769 7.5365 115.0298 56.5231 32.4003 177.5144 34 Y 3.7993 7.7967 122.1093 59.0756 39.0963 175.6279 35 K 4.1020 6.8608 114.4835 55.0923 34.4683 172.5860 36 P 4.0855 0.0000 0.0000 64.5650 31.3715 176.3792 37 G 3.9001 9.0998 109.3185 45.2736 0.0000 172.8368 38 C 5.2679 7.7672 115.7134 55.5350 40.3013 172.6247 39 H 4.7827 8.9622 117.7237 54.4956 33.7515 172.5007 40 L 4.6834 9.8377 120.7413 54.5608 42.0542 177.7069 41 A 4.4663 9.1729 125.3982 52.6574 19.4962 176.8533 42 S 3.4129 8.7714 114.1830 55.6818 65.6646 173.6794 43 F 4.7770 6.4911 119.2253 56.4276 41.7937 175.0472 44 H 5.1168 9.4220 118.7351 55.1523 31.5444 173.3810 45 R 4.1422 6.7189 114.0974 53.7571 31.7675 174.9977 46 Y 5.0789 8.1890 122.3204 60.5593 38.7467 178.6794 47 G 3.6937 8.2323 106.0167 48.0785 0.0000 175.2672 48 E 3.8947 7.9714 120.5422 59.1386 29.4635 179.4420 49 S 4.4834 8.1809 114.7550 61.7182 62.8773 176.5625 50 L 3.8196 7.6172 121.3855 57.7158 41.3815 178.9630 51 E 3.9091 8.1046 118.9841 59.6584 29.5001 179.0935 52 I 3.8553 8.2108 119.7922 64.1911 37.0767 178.2325 53 A 4.2040 8.6464 122.0988 55.3077 18.2268 179.3612 54 E 3.8994 8.5942 118.1252 59.4217 29.8313 178.1608 55 Y 4.3272 8.4219 120.0151 61.0229 38.8523 178.2637 56 I 3.1031 8.3122 120.8782 64.3091 36.8988 178.4975 57 S 4.1898 7.9948 114.8670 61.9143 62.7520 176.3278 58 D 4.3385 8.1254 120.3560 56.7541 40.7357 177.5275 59 Y 4.3778 8.0020 115.1538 57.3783 39.0700 175.4678 60 H 4.2489 7.9436 120.3730 56.0777 30.2260 176.2825 61 K 4.1779 8.4343 131.1624 53.1089 30.5826 176.2631 62 G 3.7986 6.3734 105.4672 46.1866 0.0000 170.9398 63 Q 4.4983 8.7808 119.7604 55.5576 30.9442 175.7473 64 E 4.3253 8.1004 115.9908 56.3981 30.6371 175.6136 65 N 4.9431 8.2918 117.5571 53.1935 40.2910 174.2673 66 V 4.8509 8.3769 119.7682 60.8265 34.4205 174.9721 67 W 5.1917 9.3612 128.7999 57.0636 30.3107 175.2509 68 I 5.2295 9.0308 115.6768 58.7705 41.2986 176.0267 69 G 4.3724 9.6662 107.4368 47.3927 0.0000 172.5072 70 L 4.8280 8.2676 124.7132 53.9043 43.4767 175.5522 71 R 4.9346 8.7766 125.8505 55.0430 34.0292 173.9792 72 D 4.8456 9.1156 126.3355 51.3045 39.6059 176.2249 73 K 3.6183 8.0342 124.1060 58.8039 32.6252 177.3747 74 K 4.2168 7.4660 115.0274 55.8149 31.8385 176.9810 75 K 4.4375 7.5964 115.4405 56.1196 30.0554 174.4480 76 D 5.0425 7.3463 116.4745 53.3245 39.6236 175.4310 77 F 2.8075 8.5558 114.6180 59.5206 36.1499 175.9598 78 S 4.5756 8.3170 118.2959 56.5150 63.1466 172.0814 79 W 4.6339 8.3121 126.6985 56.8881 30.0499 175.4994 80 E 4.7994 8.9241 123.0220 54.3203 33.6710 174.9740 81 W 5.2921 8.8628 123.6524 56.6994 30.0914 177.5838 82 T 4.1964 9.1310 114.9991 64.2616 68.8521 174.8464 83 D 4.1528 8.3010 119.7912 52.6926 39.3473 176.2593 84 R 3.8989 8.0830 115.5201 57.3415 28.4153 176.3238 85 S 4.5049 8.7707 113.2173 58.0424 63.8462 173.2579 86 C 4.6990 8.4077 117.9751 59.6576 28.7916 175.0209 87 T 4.8253 8.5208 121.1614 62.4739 66.6142 173.8809 88 D 5.1512 8.5842 120.6237 52.4632 40.5913 176.0556 89 Y 4.8509 7.9665 119.8741 57.1010 41.7251 173.3921 90 L 4.1401 7.6593 126.2831 53.3454 46.1555 176.5477 91 T 3.8713 5.7900 117.1864 59.7160 67.0741 173.0446 92 W 4.5719 7.0100 122.1310 56.9549 30.3779 177.4495 93 D 4.6073 9.6865 124.0392 53.2962 42.3959 175.0879 94 K 3.8428 8.5408 122.8582 58.3601 32.2176 176.3300 95 N 4.3324 9.0903 122.3028 53.6478 36.3405 173.7889 96 Q 4.5201 7.8126 117.1479 53.1310 31.2375 173.7141 97 P 4.3263 0.0000 0.0000 62.3452 32.2425 175.6533 98 D 4.7586 8.7781 116.4408 51.9868 41.3150 175.1096 99 H 4.0659 9.5826 117.0681 55.4200 26.6598 174.4329 100 Y 4.5469 8.3337 119.3964 59.7191 39.0335 175.8217 101 Q 3.3124 8.9924 124.6423 56.9830 26.4546 172.9753 102 N 4.2199 8.4076 111.7524 54.3967 37.1178 174.9776 103 K 4.6635 7.8055 112.5237 56.0004 34.2415 176.0506 104 E 4.4744 7.1816 118.7406 54.8447 31.2939 175.7689 105 F 5.0719 8.5025 120.4602 56.7418 42.0744 175.0554 106 C 4.8556 8.1958 117.4125 54.8929 36.7605 173.5218 107 V 4.9693 8.9025 124.2825 62.6378 32.8823 174.5139 108 E 5.4314 9.0829 123.1570 54.9062 33.9237 173.9057 109 L 4.9359 9.6768 121.6299 53.8301 43.6033 176.2840 110 V 4.0729 8.9321 125.3804 62.5265 32.1252 176.4021 111 S 2.7900 9.4788 124.2553 61.1004 62.2636 176.4734 112 L 4.1587 7.7074 117.8809 57.3044 41.7851 177.8183 113 T 4.2193 7.6556 107.6792 60.9414 68.9981 175.3215 114 G 3.6773 8.3491 109.6745 46.9314 0.0000 173.4486 115 Y 3.7464 7.3805 113.9791 59.1374 35.7478 171.2920 116 R 4.5212 7.7106 118.7822 56.5203 32.1258 176.6780 117 L 4.8375 7.7081 116.2095 52.7516 45.0636 176.2260 118 W 5.8043 8.2512 120.8615 55.2799 32.1659 174.6505 119 N 5.4804 8.5157 117.6844 52.6446 41.7980 173.0602 120 D 5.2172 8.8068 125.5716 53.6661 40.7138 175.0061 121 Q 4.6901 9.4660 121.7611 54.2500 33.1657 173.7621 122 V 4.4824 8.8675 121.8221 62.8515 31.3828 175.8867 123 C 4.6333 9.1739 126.4362 60.2196 40.1731 176.1916 124 E 3.9013 8.2471 116.9715 58.3149 29.5539 177.0661 125 S 4.5561 9.7692 115.8778 58.7628 64.5245 173.5785 126 K 5.1348 8.7205 120.5799 55.3158 33.8479 175.1495 127 D 4.9855 9.0983 124.2809 51.9923 45.3082 175.3142 128 A 5.4642 8.6084 122.0204 51.0688 20.6918 176.1254 129 F 5.5161 8.5049 112.4415 55.7981 42.0907 173.4548 130 L 4.9927 8.8834 122.3009 53.9611 43.6036 174.8646 131 C 5.3699 9.4970 124.8325 56.1630 42.7706 172.6537 132 Q 4.9569 9.4274 122.1625 54.7205 31.8842 173.4594 133 C 5.3694 9.6291 122.4714 55.2876 45.3417 172.7339 134 K 4.8309 7.8925 119.6581 54.6592 33.7669 176.8192 135 F 4.1116 8.7149 122.1333 57.5373 39.2675 175.3977 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 N 8.42 4.61 0.00 2.66 2.74 0.00 0.00 6.78 6.77 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 3 C 8.18 4.40 0.00 2.87 2.58 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 4 P 0.00 4.35 0.00 1.97 1.81 0.00 2.37 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.34 0.00 5 L 8.49 4.05 0.00 1.62 1.76 0.88 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 6 D 8.18 4.85 0.00 2.70 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 7 W 7.91 4.51 0.00 3.06 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 8 L 8.63 4.22 0.00 0.63 1.09 0.70 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.79 0.00 1.94 1.94 0.00 3.66 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 10 M 10.12 4.34 0.00 2.05 1.82 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 11 N 10.00 4.36 0.00 2.87 2.82 0.00 0.00 7.33 7.65 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 12 G 8.40 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 0.00 0.00 0.00 13 L 7.70 4.80 0.00 1.50 1.14 0.84 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 14 C 8.90 5.57 0.00 3.12 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 15 Y 8.86 5.47 0.00 2.71 2.76 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 0.00 0.00 0.00 0.00 16 K 8.79 4.88 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.30 0.50 7.81 17 I 8.28 4.50 1.52 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.13 0.70 0.00 0.00 18 F 8.72 4.25 0.00 1.51 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 0.00 0.00 0.00 19 N 8.78 4.42 0.00 2.67 2.86 0.00 0.00 7.17 7.69 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 20 Q 7.86 4.21 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.97 0.00 0.00 0.00 0.00 0.00 2.48 2.41 0.00 21 L 8.42 5.53 0.00 1.60 1.69 1.00 1.03 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 22 K 8.63 4.88 0.00 1.51 1.56 0.00 0.96 0.00 0.00 1.80 0.00 0.00 2.61 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.41 1.48 7.81 23 T 8.45 5.49 4.49 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 1.33 0.00 0.00 24 W 8.47 2.66 0.00 1.78 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 25 E 8.42 3.85 0.00 2.21 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 2.36 2.48 0.00 26 D 8.05 4.30 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 27 A 7.32 2.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 7.32 3.50 0.00 1.22 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.85 0.00 29 M 7.84 4.06 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.72 0.00 30 F 7.57 3.97 0.00 3.02 2.89 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 0.00 0.00 0.00 31 C 8.41 4.48 0.00 3.14 3.15 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 32 R 8.04 3.88 0.00 1.74 1.89 0.00 3.01 0.00 0.00 2.88 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 33 K 7.54 4.28 0.00 1.60 1.68 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.48 7.81 34 Y 7.80 3.80 0.00 2.77 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 35 K 6.86 4.10 0.00 1.62 1.55 0.00 1.21 0.00 0.00 0.81 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.89 0.96 7.81 36 P 0.00 4.09 0.00 2.10 2.01 0.00 3.58 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.87 0.00 37 G 9.10 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 38 C 7.77 5.27 0.00 2.91 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 H 8.96 4.78 0.00 3.08 3.33 0.00 5.81 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.84 4.68 0.00 1.51 1.73 0.20 0.91 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 41 A 9.17 4.47 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 42 S 8.77 3.41 0.00 2.72 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 43 F 6.49 4.78 0.00 3.61 3.34 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 44 H 9.42 5.12 0.00 3.00 3.29 0.00 5.69 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 6.72 4.14 0.00 1.86 1.88 0.00 2.93 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.49 0.00 46 Y 8.19 5.08 0.00 3.17 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 47 G 8.23 3.69 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 0.00 0.00 0.00 48 E 7.97 3.89 0.00 2.14 1.77 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 2.18 2.23 0.00 49 S 8.18 4.48 0.00 4.02 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 50 L 7.62 3.82 0.00 1.71 1.59 0.58 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.10 3.91 0.00 2.09 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 2.20 2.34 0.00 52 I 8.21 3.86 2.20 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.48 1.12 0.00 0.00 53 A 8.65 4.20 1.57 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 0.00 0.00 54 E 8.59 3.90 0.00 2.15 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 0.00 2.55 2.35 0.00 55 Y 8.42 4.33 0.00 2.99 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 56 I 8.31 3.10 1.63 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.65 -0.38 0.00 0.00 57 S 7.99 4.19 0.00 4.01 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 58 D 8.13 4.34 0.00 2.88 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.00 4.38 0.00 2.28 2.75 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 60 H 7.94 4.25 0.00 2.61 3.11 0.00 5.94 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 K 8.43 4.18 0.00 1.72 1.68 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.45 7.81 62 G 6.37 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 63 Q 8.78 4.50 0.00 1.94 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.90 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 64 E 8.10 4.33 0.00 2.04 1.87 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 2.33 2.40 0.00 65 N 8.29 4.94 0.00 2.71 2.78 0.00 0.00 6.20 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 66 V 8.38 4.85 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 1.08 0.00 0.00 0.72 0.00 0.00 67 W 9.36 5.19 0.00 3.47 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 I 9.03 5.23 2.42 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.37 1.20 0.00 0.00 69 G 9.67 4.37 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 0.00 70 L 8.27 4.83 0.00 0.27 1.07 -0.08 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.78 4.93 0.00 0.68 1.10 0.00 3.15 0.00 0.00 2.73 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.02 0.00 72 D 9.12 4.85 0.00 1.58 1.92 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 73 K 8.03 3.62 0.00 1.66 1.89 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.39 7.81 74 K 7.47 4.22 0.00 1.80 1.75 0.00 1.80 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.32 7.81 75 K 7.60 4.44 0.00 1.58 1.56 0.00 1.20 0.00 0.00 0.80 0.00 0.00 2.17 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.30 0.72 7.81 76 D 7.35 5.04 0.00 2.72 2.75 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 77 F 8.56 2.81 0.00 3.10 3.27 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 78 S 8.32 4.58 0.00 3.79 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 79 W 8.31 4.63 0.00 3.27 3.14 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 80 E 8.92 4.80 0.00 1.95 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 0.00 2.26 2.45 0.00 81 W 8.86 5.29 0.00 3.59 3.25 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 82 T 9.13 4.20 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 83 D 8.30 4.15 0.00 2.66 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 84 R 8.08 3.90 0.00 2.03 2.10 0.00 3.20 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 85 S 8.77 4.50 0.00 3.91 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 86 C 8.41 4.70 0.00 3.11 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 87 T 8.52 4.83 4.42 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 1.39 0.00 0.00 88 D 8.58 5.15 0.00 2.91 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 89 Y 7.97 4.85 0.00 3.19 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 90 L 7.66 4.14 0.00 1.37 0.87 1.18 0.83 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 91 T 5.79 3.87 3.39 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 -0.24 0.00 0.00 92 W 7.01 4.57 0.00 3.04 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 D 9.69 4.61 0.00 2.84 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 94 K 8.54 3.84 0.00 1.78 1.72 0.00 1.90 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.49 7.81 95 N 9.09 4.33 0.00 2.87 2.90 0.00 0.00 6.94 7.69 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 96 Q 7.81 4.52 0.00 2.21 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.95 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 97 P 0.00 4.33 0.00 1.72 0.49 0.00 2.98 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 1.85 1.10 0.00 98 D 8.78 4.76 0.00 2.76 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 99 H 9.58 4.07 0.00 3.36 3.33 0.00 5.67 0.00 0.00 0.00 0.00 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 8.33 4.55 0.00 3.21 3.09 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 0.00 101 Q 8.99 3.31 0.00 1.90 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.50 0.00 0.00 0.00 0.00 0.00 1.79 1.16 0.00 102 N 8.41 4.22 0.00 2.75 2.92 0.00 0.00 6.60 7.61 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 0.00 103 K 7.81 4.66 0.00 1.73 1.73 0.00 1.55 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.66 7.81 104 E 7.18 4.47 0.00 1.89 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 2.34 2.28 0.00 105 F 8.50 5.07 0.00 2.81 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 0.00 106 C 8.20 4.86 0.00 2.53 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 0.00 0.00 0.00 107 V 8.90 4.97 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 0.73 0.00 0.00 0.85 0.00 0.00 108 E 9.08 5.43 0.00 1.95 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.31 0.00 109 L 9.68 4.94 0.00 1.89 1.92 1.15 0.86 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 0.00 110 V 8.93 4.07 2.14 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 0.86 0.00 0.00 1.01 0.00 0.00 111 S 9.48 2.79 0.00 3.76 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 0.00 112 L 7.71 4.16 0.00 1.59 1.66 0.87 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 113 T 7.66 4.22 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 1.23 0.00 0.00 114 G 8.35 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 0.00 115 Y 7.38 3.75 0.00 3.23 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 0.00 116 R 7.71 4.52 0.00 1.89 2.00 0.00 3.13 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.90 0.00 117 L 7.71 4.84 0.00 1.61 1.59 0.96 0.58 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 0.00 118 W 8.25 5.80 0.00 2.79 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 0.00 119 N 8.52 5.48 0.00 2.92 2.71 0.00 0.00 6.63 8.49 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 0.00 120 D 8.81 5.22 0.00 3.02 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 0.00 121 Q 9.47 4.69 0.00 2.34 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.62 0.00 122 V 8.87 4.48 2.24 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 1.37 0.00 0.00 1.03 0.00 0.00 123 C 9.17 4.63 0.00 3.05 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 0.00 124 E 8.25 3.90 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 125 S 9.77 4.56 0.00 4.21 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 0.00 126 K 8.72 5.13 0.00 1.69 1.85 0.00 1.88 0.00 0.00 1.91 0.00 0.00 3.01 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.46 7.81 127 D 9.10 4.99 0.00 1.58 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 0.00 0.00 0.00 0.00 128 A 8.61 5.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.50 5.52 0.00 3.24 3.34 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 0.00 130 L 8.88 4.99 0.00 1.96 1.79 1.08 1.23 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 0.00 131 C 9.50 5.37 0.00 3.12 3.25 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 0.00 132 Q 9.43 4.96 0.00 1.86 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.69 0.00 0.00 0.00 0.00 0.00 1.96 1.44 0.00 133 C 9.63 5.37 0.00 2.44 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 0.00 0.00 0.00 134 K 7.89 4.83 0.00 1.49 1.63 0.00 1.60 0.00 0.00 1.77 0.00 0.00 2.68 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.28 7.81 135 F 8.71 4.11 0.00 2.81 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00