NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4123 8.3049 120.3481 55.1318 33.6185 176.2322 2 L 4.1349 8.0020 123.8866 52.9847 39.5718 175.6991 3 T 3.8356 8.2372 117.5090 64.9337 68.5826 173.2831 4 D 4.5829 7.8278 119.7834 50.9039 42.4100 173.2088 5 P 4.2130 0.0000 0.0000 65.6886 31.5564 177.8993 6 I 3.5990 7.8747 117.2765 64.0049 36.8801 178.3294 7 A 3.9156 8.7527 122.2131 54.8613 18.3862 178.6841 8 D 4.3216 8.0871 116.8551 57.9336 41.1736 178.5217 9 M 3.9099 8.1452 118.1776 58.6393 32.2100 177.7116 10 L 3.8574 7.6621 119.1144 58.3519 41.7685 179.8599 11 T 3.7518 8.5882 115.5345 66.8116 68.3649 176.6961 12 R 3.8144 8.1359 120.2644 59.6325 30.0722 179.0464 13 I 3.6188 7.8176 119.0769 64.4627 36.9555 178.3034 14 R 3.7845 7.8399 118.3922 60.1631 29.9360 177.5248 15 N 4.4314 9.1050 117.4381 54.8095 38.4974 176.9179 16 A 3.9639 8.5665 122.2560 55.8921 18.7109 179.9265 17 T 3.9558 8.1046 108.0251 65.1255 68.6816 176.9797 18 R 4.0642 7.9043 119.8890 57.7831 29.9663 177.7994 19 V 4.4214 7.3234 110.1547 60.6455 32.2172 174.7865 20 Y 3.1304 7.4730 114.9363 57.2698 35.8151 171.2673 21 K 4.3090 8.1441 118.7841 56.8156 33.1385 176.1022 22 E 4.8863 8.4852 118.3079 57.4961 32.2799 176.0522 23 S 5.0321 7.7502 110.8019 58.4960 65.6819 174.5392 24 T 4.4875 8.3789 119.5869 60.6855 69.3891 172.5419 25 D 5.2788 8.5918 127.5336 52.9871 42.6161 176.1752 26 V 4.6138 7.9808 115.9100 58.5433 35.6410 173.4668 27 P 3.5201 0.0000 0.0000 62.1272 31.7324 176.1424 28 A 4.3076 8.2044 127.0196 51.8809 19.1731 177.1679 29 S 4.5761 8.3831 114.8635 55.6220 66.2572 174.6784 30 R 3.8905 8.8524 122.7736 59.8773 29.7964 178.5745 31 F 4.4014 8.3454 119.2216 61.6061 39.2041 177.2343 32 K 3.5844 8.6378 117.9924 59.3905 31.7933 178.6605 33 E 3.5108 8.3172 119.7618 59.5963 29.2361 178.1272 34 E 3.8802 8.1622 117.0375 59.9913 29.8455 179.0696 35 I 3.6770 7.5417 118.8736 64.6452 37.2876 178.1263 36 L 3.8129 7.7654 119.5508 58.1767 41.3999 179.7085 37 R 4.0399 8.0665 117.8046 59.6689 30.0757 178.9612 38 I 3.7045 7.8170 118.9273 64.5539 37.1795 177.9595 39 L 4.1326 8.1312 118.8155 58.2530 41.4670 179.0864 40 A 4.0520 8.5541 120.4681 55.5733 18.3432 179.5489 41 R 3.9335 8.1390 116.7798 59.6859 30.0844 178.2184 42 E 3.9946 8.4527 115.0811 56.1946 30.2909 176.7477 43 G 3.7100 7.6404 106.7143 47.7843 0.0000 174.3050 44 F 4.8896 8.1620 114.1491 57.1663 40.8501 176.5961 45 I 4.6519 7.1412 113.3974 59.3438 40.0644 175.8306 46 K 4.2388 8.5015 120.0030 57.0825 31.7778 178.2018 47 G 3.9545 9.8162 108.2608 45.7877 0.0000 172.2313 48 Y 5.2910 7.4843 113.8528 56.3916 40.3924 173.4670 49 E 4.5831 8.9133 118.8684 54.1936 33.4470 175.0283 50 R 4.5044 8.6176 118.1616 56.9402 30.7369 175.9105 51 V 4.5060 8.2448 119.8086 62.6678 35.4795 172.5057 52 D 5.0248 8.5968 119.3892 53.2055 44.4218 174.7706 53 V 4.1117 8.4780 124.1047 61.9510 33.4784 175.0107 54 D 4.2986 10.0375 123.9978 54.7878 39.8812 173.7023 55 G 4.1453 8.3023 103.6291 45.5347 0.0000 173.8944 56 K 4.6560 8.3615 120.1391 53.2025 35.0909 173.4478 57 P 4.8788 0.0000 0.0000 64.3120 32.0712 174.4720 58 Y 5.1602 8.6400 123.7100 56.5490 41.9676 174.7717 59 L 5.1465 8.7526 117.8541 53.5223 44.4401 175.3150 60 R 4.0867 8.7602 121.8316 56.8874 31.8469 175.8609 61 V 4.3158 8.1624 121.6216 61.0826 34.3949 173.7952 62 Y 4.5942 8.6114 126.6641 57.9078 38.5818 176.0042 63 L 4.6195 8.3229 124.5111 53.9838 43.2115 176.3175 64 K 4.6407 7.9445 118.8396 55.0860 35.4206 175.1892 65 Y 4.8463 8.2156 118.7525 56.6063 42.9166 176.4112 66 G 4.1747 9.3634 111.1669 44.8036 0.0000 171.5638 67 P 4.6695 0.0000 0.0000 61.1633 32.8428 175.3795 68 R 3.8444 8.5292 119.8126 57.6389 30.2038 176.5389 69 R 4.4230 8.9817 125.9695 55.7907 31.7114 175.7073 70 Q 4.2683 8.5666 119.1279 55.2173 30.3426 178.1360 71 G 3.6796 8.6460 108.3168 45.4774 0.0000 171.7633 72 P 4.1505 0.0000 0.0000 63.9269 31.7634 175.3490 73 D 4.2186 8.5789 122.0134 54.3880 38.6741 170.9364 74 P 4.5041 0.0000 0.0000 63.1262 32.4014 176.9430 75 R 3.5133 7.4675 117.2876 54.2097 30.0565 174.2533 76 P 4.6231 0.0000 0.0000 63.1440 32.3714 174.7992 77 E 4.7186 8.6791 120.7861 55.1295 31.5947 175.0447 78 Q 4.6577 8.5714 124.1250 55.9058 29.2105 176.4634 79 V 3.9914 8.5513 121.7129 64.7624 32.2600 176.7068 80 I 4.3395 7.2853 121.2487 59.5291 35.0085 174.5080 81 H 3.9914 8.2794 119.9902 58.4691 29.4216 178.0061 82 H 3.9428 7.0190 121.7724 54.9117 31.2089 173.4556 83 I 3.6591 5.7812 126.2904 60.2753 38.3048 171.9976 84 R 4.5433 7.6078 127.9341 54.0071 33.3443 174.3591 85 R 4.3559 8.2785 120.9068 55.6314 30.7007 175.7456 86 I 4.1087 7.2403 121.5687 63.0739 38.9472 176.3584 87 S 4.2650 8.0876 114.4846 58.3544 63.1420 173.5096 88 K 4.6740 8.1909 121.6692 54.8379 35.2089 173.6001 89 P 4.0997 0.0000 0.0000 64.4479 31.8768 175.9672 90 G 3.7820 9.2302 106.8616 46.0248 0.0000 172.7773 91 R 3.6438 7.3867 118.0484 56.1470 29.6546 173.5976 92 R 4.6420 7.1896 119.5295 55.4356 31.5947 177.4115 93 V 4.0497 7.1923 118.3689 61.7869 33.6151 172.9679 94 Y 5.2805 8.1310 124.6504 56.5695 39.8825 175.6750 95 V 4.5912 9.0589 115.5327 59.6612 35.9981 175.4952 96 G 4.2311 8.7493 112.3589 44.1202 0.0000 175.1173 97 V 3.8326 8.5633 120.4080 64.6852 31.0149 178.0948 98 K 4.2762 8.0025 116.0121 57.8118 32.5898 176.7217 99 E 4.5517 9.2496 118.0158 55.9393 30.8473 175.8809 100 I 3.9469 7.4994 120.7301 59.9036 36.4519 174.1274 101 P 4.2254 0.0000 0.0000 63.0843 31.2515 176.8806 102 R 4.2284 8.1748 117.3200 54.2505 28.7897 175.4992 103 V 3.4420 8.1756 124.6415 64.3626 32.1496 176.3494 104 R 3.3803 8.9232 127.8553 58.4833 27.4957 176.2160 105 R 3.7244 8.9293 108.2124 57.2606 28.0466 178.1830 106 G 3.9574 8.2230 105.2363 45.6395 0.0000 175.0493 107 L 4.1709 7.8262 118.7513 55.7510 41.9348 176.0712 108 G 4.5864 7.6467 104.6976 44.3454 0.0000 170.8219 109 I 4.9968 8.6836 112.3961 59.2176 41.2000 175.2170 110 A 5.5681 8.7515 121.6698 49.3151 19.8050 175.1750 111 I 3.9993 7.9699 121.5435 61.7838 39.1188 174.7914 112 L 4.5280 8.2241 120.4625 54.8987 43.9461 173.8979 113 S 4.5447 8.3852 119.1100 58.8506 62.3742 172.9306 114 T 4.9623 8.8876 115.5468 60.0040 72.1926 174.9405 115 S 4.3428 8.7862 116.0022 61.1106 63.3786 176.2028 116 K 4.0441 7.7638 120.4914 57.5808 32.1945 177.0325 117 G 3.9018 7.5126 104.3899 45.6771 0.0000 170.8553 118 V 4.6401 8.4644 119.8777 61.7159 32.3019 175.9868 119 L 4.8127 8.4031 127.1829 54.4885 44.3429 175.0986 120 T 4.2786 8.5586 110.3454 61.5664 70.0361 174.7758 121 D 4.3462 8.4019 122.9732 57.0834 38.7072 178.7422 122 R 3.8200 7.7613 117.8983 58.3986 29.7625 178.8130 123 E 3.8502 8.2671 117.8882 59.4931 30.0547 179.7463 124 A 3.9658 8.5851 121.0515 55.1818 18.4604 179.2491 125 R 3.8186 8.5035 117.4728 59.6459 29.8525 178.1037 126 K 3.8665 8.0851 117.9744 59.7815 32.2628 177.9199 127 L 4.3319 7.8851 115.0409 53.7510 42.9353 177.1063 128 G 4.0523 8.4456 107.8693 46.1660 0.0000 173.2966 129 V 4.5295 8.0031 109.3154 59.9641 36.5598 175.7480 130 G 4.4210 9.3614 111.0321 45.2659 0.0000 171.6753 131 G 4.0197 7.7079 104.8126 45.4497 0.0000 170.3104 132 E 4.5747 8.3172 122.0505 55.9515 31.0252 177.0163 133 L 4.1545 9.1782 130.9351 55.4018 41.9305 177.4509 134 I 3.9917 8.7711 128.9916 63.0427 38.2962 176.2877 135 C 5.2757 7.3902 118.8189 57.9391 32.6953 173.4641 136 E 4.7619 7.7855 118.4774 56.1274 31.8372 174.9671 137 V 4.3195 8.0542 118.3776 61.6067 35.8466 173.6098 138 W 4.0696 7.8458 121.8737 57.4729 27.4211 174.1976 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 4.41 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.56 0.00 2 L 8.00 4.13 0.00 1.81 1.59 0.94 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.24 3.84 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 4 D 7.83 4.58 0.00 2.79 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.21 0.00 2.23 2.11 0.00 3.67 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 6 I 7.87 3.60 1.93 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.00 0.82 0.00 0.00 7 A 8.75 3.92 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 8 D 8.09 4.32 0.00 2.76 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 M 8.15 3.91 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 10 L 7.66 3.86 0.00 1.89 1.62 0.87 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.59 3.75 4.33 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 1.17 0.00 0.00 12 R 8.14 3.81 0.00 1.97 2.00 0.00 3.20 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 13 I 7.82 3.62 2.01 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.66 0.82 0.00 0.00 14 R 7.84 3.78 0.00 1.78 2.01 0.00 3.17 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 15 N 9.11 4.43 0.00 2.85 2.73 0.00 0.00 6.80 7.16 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 16 A 8.57 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 17 T 8.10 3.96 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 18 R 7.90 4.06 0.00 1.95 1.99 0.00 3.04 0.00 0.00 3.44 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 19 V 7.32 4.42 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.97 0.00 0.00 20 Y 7.47 3.13 0.00 2.87 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 21 K 8.14 4.31 0.00 1.81 1.84 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.70 1.54 7.81 22 E 8.49 4.89 0.00 2.17 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 0.00 2.40 2.53 0.00 23 S 7.75 5.03 0.00 3.23 3.41 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 24 T 8.38 4.49 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 25 D 8.59 5.28 0.00 2.62 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 26 V 7.98 4.61 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 0.76 0.00 0.00 0.83 0.00 0.00 27 P 0.00 3.52 0.00 1.67 1.49 0.00 3.51 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.68 0.00 28 A 8.20 4.31 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 29 S 8.38 4.58 0.00 3.97 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.85 3.89 0.00 1.89 2.11 0.00 3.35 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.69 0.00 31 F 8.35 4.40 0.00 3.02 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 32 K 8.64 3.58 0.00 1.83 1.68 0.00 1.74 0.00 0.00 1.47 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.40 7.81 33 E 8.32 3.51 0.00 2.12 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 2.27 2.18 0.00 34 E 8.16 3.88 0.00 2.10 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 2.42 2.69 0.00 35 I 7.54 3.68 1.72 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.30 0.74 0.00 0.00 36 L 7.77 3.81 0.00 1.42 1.32 0.29 1.06 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 37 R 8.07 4.04 0.00 2.18 2.06 0.00 3.18 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.82 0.00 38 I 7.82 3.70 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.42 0.98 0.00 0.00 39 L 8.13 4.13 0.00 1.90 1.88 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.55 4.05 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 41 R 8.14 3.93 0.00 1.99 2.13 0.00 3.11 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 42 E 8.45 3.99 0.00 1.78 1.68 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 2.51 2.57 0.00 43 G 7.64 3.71 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 0.00 0.00 0.00 44 F 8.16 4.89 0.00 3.09 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 45 I 7.14 4.65 2.16 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.28 0.95 0.00 0.00 46 K 8.50 4.24 0.00 2.02 1.90 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.50 1.48 7.81 47 G 9.82 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 48 Y 7.48 5.29 0.00 3.23 2.99 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 49 E 8.91 4.58 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 2.60 2.40 0.00 50 R 8.62 4.50 0.00 1.92 2.11 0.00 3.05 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 51 V 8.24 4.51 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.07 0.00 0.00 52 D 8.60 5.02 0.00 2.66 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 53 V 8.48 4.11 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.49 0.00 0.00 54 D 10.04 4.30 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 55 G 8.30 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.36 4.66 0.00 1.98 1.83 0.00 1.62 0.00 0.00 1.75 0.00 0.00 3.16 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.42 7.81 57 P 0.00 4.88 0.00 2.14 2.27 0.00 3.70 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 58 Y 8.64 5.16 0.00 2.87 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 59 L 8.75 5.15 0.00 1.56 1.61 0.72 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 60 R 8.76 4.09 0.00 1.94 1.39 0.00 3.13 0.00 0.00 2.99 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 61 V 8.16 4.32 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.03 0.00 0.00 62 Y 8.61 4.59 0.00 3.07 2.96 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 63 L 8.32 4.62 0.00 1.35 1.15 0.86 1.37 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 64 K 7.94 4.64 0.00 1.50 1.62 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.42 7.81 65 Y 8.22 4.85 0.00 3.07 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 66 G 9.36 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 0.00 0.00 0.00 0.00 67 P 0.00 4.67 0.00 2.21 2.09 0.00 3.86 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 68 R 8.53 3.84 0.00 1.82 1.91 0.00 3.20 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 69 R 8.98 4.42 0.00 1.80 1.87 0.00 3.23 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 70 Q 8.57 4.27 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.12 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 71 G 8.65 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 72 P 0.00 4.15 0.00 2.18 2.07 0.00 3.92 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 73 D 8.58 4.22 0.00 2.78 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 74 P 0.00 4.50 0.00 2.20 2.24 0.00 3.72 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.92 0.00 75 R 7.47 3.51 0.00 2.06 1.71 0.00 3.26 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.37 0.00 76 P 0.00 4.62 0.00 2.14 2.35 0.00 2.81 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.02 0.00 77 E 8.68 4.72 0.00 2.11 1.88 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 2.31 2.35 0.00 78 Q 8.57 4.66 0.00 1.93 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.84 0.00 0.00 0.00 0.00 0.00 2.36 2.23 0.00 79 V 8.55 3.99 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 0.93 0.00 0.00 1.02 0.00 0.00 80 I 7.29 4.34 1.77 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.74 0.69 0.00 0.00 81 H 8.28 3.99 0.00 3.04 3.23 0.00 5.84 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.02 3.94 0.00 1.40 1.31 0.00 6.00 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 5.78 3.66 1.54 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.49 0.67 0.00 0.00 84 R 7.61 4.54 0.00 1.51 1.55 0.00 3.12 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.49 0.00 85 R 8.28 4.36 0.00 1.79 1.80 0.00 3.30 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 86 I 7.24 4.11 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.83 0.89 0.00 0.00 87 S 8.09 4.27 0.00 3.88 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 88 K 8.19 4.67 0.00 1.85 1.68 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.44 1.30 7.81 89 P 0.00 4.10 0.00 2.19 2.12 0.00 3.89 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 1.98 1.99 0.00 90 G 9.23 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 91 R 7.39 3.64 0.00 1.88 2.05 0.00 3.30 0.00 0.00 3.31 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.34 0.00 92 R 7.19 4.64 0.00 1.37 1.37 0.00 3.44 0.00 0.00 3.89 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 93 V 7.19 4.05 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 0.84 0.00 0.00 0.89 0.00 0.00 94 Y 8.13 5.28 0.00 2.92 2.83 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 0.00 0.00 0.00 95 V 9.06 4.59 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.03 0.00 0.00 96 G 8.75 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.56 3.83 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 0.84 0.00 0.00 0.94 0.00 0.00 98 K 8.00 4.28 0.00 1.89 1.98 0.00 1.52 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.47 7.81 99 E 9.25 4.55 0.00 2.15 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 2.24 2.25 0.00 100 I 7.50 3.95 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.67 0.94 0.00 0.00 101 P 0.00 4.23 0.00 2.19 2.10 0.00 3.77 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 102 R 8.17 4.23 0.00 1.91 2.01 0.00 3.01 0.00 0.00 3.13 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 103 V 8.18 3.44 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 1.16 0.00 0.00 1.05 0.00 0.00 104 R 8.92 3.38 0.00 1.36 1.49 0.00 2.97 0.00 0.00 2.77 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 105 R 8.93 3.72 0.00 1.77 1.89 0.00 3.24 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 106 G 8.22 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 L 7.83 4.17 0.00 1.50 1.69 0.86 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.65 4.59 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 0.00 109 I 8.68 5.00 2.09 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.10 1.09 0.00 0.00 110 A 8.75 5.57 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 0.00 111 I 7.97 4.00 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.87 0.88 0.00 0.00 112 L 8.22 4.53 0.00 1.87 1.77 0.97 1.24 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 S 8.39 4.54 0.00 4.26 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 T 8.89 4.96 4.33 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 1.33 0.00 0.00 115 S 8.79 4.34 0.00 3.99 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 0.00 116 K 7.76 4.04 0.00 1.91 1.92 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.39 7.81 117 G 7.51 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 0.00 118 V 8.46 4.64 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 0.88 0.00 0.00 1.23 0.00 0.00 119 L 8.40 4.81 0.00 1.85 1.73 0.93 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.56 4.28 4.30 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 1.33 0.00 0.00 121 D 8.40 4.35 0.00 2.70 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 0.00 122 R 7.76 3.82 0.00 1.85 1.92 0.00 3.33 0.00 0.00 3.35 8.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.71 0.00 123 E 8.27 3.85 0.00 2.28 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 2.35 2.40 0.00 124 A 8.59 3.97 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 0.00 125 R 8.50 3.82 0.00 2.05 2.03 0.00 3.13 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 126 K 8.09 3.87 0.00 1.76 2.07 0.00 1.85 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.51 7.81 127 L 7.89 4.33 0.00 1.69 1.70 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.45 4.05 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 0.00 0.00 0.00 129 V 8.00 4.53 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 0.71 0.00 0.00 0.95 0.00 0.00 130 G 9.36 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 0.00 0.00 0.00 0.00 131 G 7.71 4.02 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 0.00 0.00 0.00 132 E 8.32 4.57 0.00 2.44 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 0.00 2.39 2.12 0.00 133 L 9.18 4.15 0.00 1.82 1.55 0.94 0.86 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 0.00 134 I 8.77 3.99 1.94 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.92 0.87 0.00 0.00 135 C 7.39 5.28 0.00 3.12 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 0.00 136 E 7.79 4.76 0.00 2.31 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 0.00 2.29 2.39 0.00 137 V 8.05 4.32 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 -0.03 0.00 0.00 0.75 0.00 0.00 138 W 7.85 4.07 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