NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9692 8.0544 120.3828 63.5419 32.5587 177.4648 2 H 4.7133 8.6022 111.5109 54.0970 29.0760 172.6527 3 L 4.2872 8.0975 121.3636 54.1031 43.7764 177.8976 4 T 3.9756 8.4123 120.4114 62.5395 69.7374 173.6912 5 P 4.3101 0.0000 0.0000 66.1112 31.2892 178.7807 6 E 3.9745 8.0526 116.3775 59.5908 29.5578 179.2163 7 E 3.9539 7.9334 118.0174 59.1515 29.6994 179.3395 8 K 3.9674 9.1151 119.4068 58.9696 31.9326 179.1883 9 S 4.1805 7.7773 112.4857 60.6496 62.5059 175.8817 10 A 4.0107 7.6650 123.6869 55.1723 18.2887 179.4849 11 V 3.3065 7.4649 116.0753 66.4766 31.2072 177.9366 12 T 3.9207 7.6863 114.5063 67.0806 68.2098 176.3901 13 A 4.1134 8.5706 121.3894 54.6734 18.6283 179.2407 14 L 3.8852 8.0272 118.8360 58.1095 42.1853 178.7489 15 W 4.3392 8.5139 128.1099 60.7237 30.3351 177.8132 16 G 3.7881 7.7554 104.3257 47.6572 0.0000 174.6897 17 K 4.4375 7.9844 117.8439 55.2457 32.6661 176.9420 18 V 3.6138 7.6171 121.2329 62.4898 31.9696 176.6089 19 N 4.5035 8.1442 125.8034 51.5631 37.5418 175.0945 20 V 3.4408 7.8445 125.3536 66.0563 31.6413 176.3499 21 D 4.3514 8.1546 117.4281 57.8134 40.1161 178.6144 22 E 3.8627 8.5201 118.2365 59.5147 29.7555 179.6261 23 V 3.5999 8.4049 118.4927 66.0681 31.1791 177.7915 24 G 4.0027 8.1547 105.4600 48.4170 0.0000 175.7762 25 G 3.6098 7.9695 108.3221 46.9195 0.0000 175.1888 26 E 4.0163 7.9496 120.2546 58.6084 29.6851 178.6279 27 A 3.9065 7.8445 120.6971 55.0829 18.5844 179.4274 28 L 4.0479 7.7328 118.6088 57.8037 42.2401 179.3022 29 G 3.5672 7.9248 105.5761 48.0663 0.0000 176.0512 30 R 3.9536 8.6348 121.7824 58.2611 29.8599 178.7205 31 L 4.0582 7.8156 120.6024 58.3737 41.9007 178.9623 32 L 4.3416 7.7816 119.5519 57.0941 41.3298 180.0079 33 V 3.5459 7.2479 116.9550 66.0931 31.6893 178.1378 34 V 3.4393 7.8170 116.7569 64.3378 32.7293 175.5684 35 Y 3.7024 7.3407 116.2456 53.9843 38.0389 173.9515 36 P 4.2698 0.0000 0.0000 65.5229 31.7748 178.2795 37 W 4.3435 8.0725 116.1676 59.2576 27.3373 177.8011 38 T 4.3334 7.9154 110.4299 64.0251 68.2319 175.6669 39 Q 4.2643 8.2686 120.8226 57.0595 28.7969 177.5483 40 R 3.9568 7.7457 117.2019 58.2199 29.4180 177.6634 41 F 4.5603 7.2497 116.6356 57.2352 40.5117 175.6062 42 F 4.5990 7.6637 117.7041 56.4566 39.6316 176.8819 43 E 4.0331 8.1482 122.8341 59.5425 29.8436 180.2363 44 S 4.4518 8.1028 111.6780 60.8288 63.2153 175.3859 45 F 4.5358 8.1063 120.1268 59.4623 39.8904 175.4341 46 G 4.0687 7.2122 102.8867 44.3245 0.0000 176.4874 47 D 4.5182 8.8475 129.2832 53.9554 39.9936 174.9568 48 L 4.7994 8.2786 125.0998 54.4027 42.7784 178.8135 49 S 4.2877 8.2092 117.6964 61.4417 63.0561 175.3522 50 T 4.7347 7.4045 109.0094 58.2205 72.9231 172.6081 51 P 4.3293 0.0000 0.0000 66.5060 31.4304 178.6616 52 D 4.0397 8.0715 116.3894 57.3412 40.5694 178.6798 53 A 4.0413 8.2968 120.9714 54.8111 18.6572 179.5726 54 V 3.7357 8.4419 117.8907 66.3075 31.5916 178.0482 55 M 4.1318 8.7765 119.0179 58.4399 31.8558 178.8769 56 G 3.7558 8.0060 105.1212 46.1781 0.0000 173.9737 57 N 4.1667 7.5998 120.0749 53.6566 39.3908 173.5600 58 P 4.3803 0.0000 0.0000 65.2916 31.9002 178.5826 59 K 3.7184 7.9164 118.2229 58.7837 31.9869 179.3415 60 V 3.7152 7.6973 118.7327 66.0165 31.4581 178.1195 61 K 3.8943 7.9560 118.0118 59.4750 31.3820 179.1302 62 A 3.9602 8.0339 120.8841 55.5555 18.2684 179.2597 63 H 4.4196 8.2539 116.3291 59.0537 29.9015 177.8085 64 G 3.5594 7.8802 107.5989 47.5596 0.0000 175.7239 65 K 4.0706 7.9479 121.8624 58.6897 31.7519 178.9625 66 K 3.9951 7.7437 119.5828 59.3055 32.1190 179.0759 67 V 3.6775 7.6126 118.1432 66.1403 31.4946 177.9067 68 L 4.2882 8.1644 118.9097 57.7620 41.4266 179.6199 69 G 3.9774 8.3750 105.4009 48.1028 0.0000 175.4084 70 A 4.1362 7.8654 123.3638 54.5831 18.3597 179.4998 71 F 4.0785 8.4283 119.0659 61.5411 39.3736 176.9760 72 S 4.3074 9.0408 112.3640 62.0031 62.6106 175.7583 73 D 4.6280 8.9388 121.6801 57.3238 40.5036 178.9715 74 G 3.5528 8.1856 105.8488 47.0524 0.0000 175.4290 75 L 3.8851 7.5036 119.7565 56.3908 41.6756 177.9835 76 A 4.4218 7.5075 118.6850 52.2398 20.0821 176.4521 77 H 4.8786 7.9494 114.7724 55.0051 29.7055 174.9628 78 L 4.1819 7.9529 118.0595 56.5420 41.8784 178.0450 79 D 4.6620 7.7761 117.2355 54.8567 42.4101 176.4363 80 N 5.0158 8.2748 118.1565 51.5239 39.8300 174.7731 81 L 4.0637 7.8553 122.7371 57.4884 41.9636 178.7456 82 K 3.8965 8.2507 119.4719 59.9969 31.7775 178.7753 83 G 3.7015 7.9038 103.4837 47.6419 0.0000 175.4031 84 T 3.7470 7.4331 117.0576 65.7816 68.6674 175.9011 85 F 4.7202 8.0837 117.2193 57.1845 39.5200 177.5008 86 A 4.0986 7.6166 120.8113 55.8556 17.8348 179.8953 87 T 3.8359 7.8627 113.4286 66.7433 68.5984 176.5672 88 L 4.1123 7.9308 121.6969 57.7865 42.3360 178.7514 89 S 4.4429 8.3780 115.2881 61.0209 62.4007 176.0170 90 E 4.0161 8.2598 121.2507 58.8211 29.0621 179.1643 91 L 3.8638 7.5479 120.2289 58.6374 42.2146 178.8471 92 H 4.1455 8.4306 115.9309 58.3763 28.0609 176.9567 93 C 3.7957 7.2887 119.5448 61.6439 31.3577 175.3605 94 D 4.0541 8.2074 119.7753 56.6609 40.7611 177.5874 95 K 4.3062 7.9493 116.9080 58.2252 33.2281 178.0406 96 L 4.0110 7.7575 117.0090 56.0788 42.1040 176.9192 97 H 4.0184 7.1925 113.6999 56.6857 26.4877 175.0702 98 V 4.1300 7.9905 118.4547 60.9777 32.7289 174.8404 99 D 4.3978 8.6632 127.2422 53.3715 41.7540 175.0019 100 P 2.9700 0.0000 0.0000 65.0293 31.6555 177.9051 101 E 3.7987 8.5711 120.4041 59.4720 29.4673 178.3692 102 N 4.3314 7.7065 116.0287 56.0496 38.4023 177.3902 103 F 4.4400 7.4050 119.1857 60.6304 38.8912 177.5920 104 R 3.9348 7.9034 117.3401 59.3286 29.8346 178.7428 105 L 3.7620 7.8817 118.0477 57.8595 41.4322 179.0679 106 L 4.0230 8.0885 119.9331 58.3344 41.9887 178.8578 107 G 4.3405 8.1912 105.4564 48.2834 0.0000 174.9213 108 N 4.3558 7.9637 119.3620 55.9053 38.6494 177.6573 109 V 3.6185 8.0596 119.5141 66.0080 31.6462 177.6922 110 L 3.8669 8.8811 121.2213 58.0698 41.8199 179.0224 111 V 3.6028 7.7944 118.1460 66.3330 31.5017 177.8175 112 C 4.1157 8.3896 116.6834 62.7062 27.8919 176.3804 113 V 3.5269 7.8152 119.8479 65.9093 31.1032 178.0190 114 L 3.8083 8.1125 118.8386 57.7651 40.8865 179.2089 115 A 3.5253 7.6650 120.7930 55.4295 17.9739 179.2128 116 H 4.1389 7.8284 115.6535 59.5297 30.0118 176.8278 117 H 3.9042 8.0009 118.9705 58.8723 30.2920 176.5524 118 F 4.6127 8.6247 117.6281 55.5978 39.4990 177.9964 119 G 3.9651 8.5159 108.1417 45.9449 0.0000 175.2728 120 K 3.9422 9.2863 121.6802 59.4916 31.7657 177.2030 121 E 4.0841 8.0077 116.0604 59.5949 29.9818 178.3036 122 F 4.4992 8.2117 122.3025 57.3380 37.8512 175.4623 123 T 4.1328 7.2711 114.7487 60.4017 71.4617 173.4632 124 P 4.1635 0.0000 0.0000 65.8116 31.4376 177.1899 125 P 4.3218 0.0000 0.0000 65.4031 31.3265 178.7157 126 V 3.6792 7.2124 115.5787 65.1885 31.3233 177.9239 127 Q 3.6076 8.3328 119.9704 58.7430 28.6746 177.4697 128 A 3.9827 8.1273 121.0210 55.2098 18.6648 179.2836 129 A 3.9984 8.0177 119.0395 55.5991 18.4964 179.3183 130 Y 3.8780 8.0993 114.7327 61.3373 38.0991 178.8923 131 Q 4.1239 8.6395 119.2458 59.4195 28.8762 179.7033 132 K 4.0432 8.0161 118.9560 59.0379 31.9031 179.5954 133 V 3.4933 7.5127 118.2536 65.9634 31.7690 178.0539 134 V 3.7110 8.3255 112.2900 64.7706 31.4788 178.3543 135 A 4.0675 8.1039 120.1972 55.1456 18.2054 179.8221 136 G 3.5104 8.0121 103.5971 47.8044 0.0000 175.7536 137 V 3.1531 8.3428 121.2042 65.4804 30.9638 177.7659 138 A 3.8354 7.8157 120.2660 55.3802 18.0851 179.4268 139 N 4.2982 8.0021 114.3545 56.4441 38.4071 177.6455 140 A 4.0144 7.9729 121.4397 55.0452 18.2988 179.4104 141 L 3.9105 7.5506 117.0392 57.3504 41.5037 179.1933 142 A 4.1802 7.6845 119.6593 54.2833 18.2630 178.8866 143 H 3.9982 7.6471 117.3869 59.6700 29.8735 175.8479 144 K 4.4090 8.2266 115.6618 56.4948 31.8379 176.6761 145 Y 4.2456 8.0433 117.7106 58.2609 38.5203 175.5159 146 H 4.4511 8.3123 117.5352 56.2007 28.2353 173.3192 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 3.97 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 1.00 0.00 0.00 0.94 0.00 0.00 2 H 8.60 4.71 0.00 3.17 3.19 0.00 5.79 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.10 4.29 0.00 1.57 1.49 0.83 0.83 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 4 T 8.41 3.98 4.27 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 1.22 0.00 0.00 5 P 0.00 4.31 0.00 2.12 2.11 0.00 3.55 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 2.18 0.00 6 E 8.05 3.97 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 7.93 3.95 0.00 2.19 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 2.35 0.00 8 K 9.12 3.97 0.00 1.95 1.79 0.00 1.59 0.00 0.00 1.50 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.35 7.81 9 S 7.78 4.18 0.00 3.91 3.83 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 10 A 7.67 4.01 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.46 3.31 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 0.43 0.00 0.00 0.64 0.00 0.00 12 T 7.69 3.92 4.39 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 1.23 0.00 0.00 13 A 8.57 4.11 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 14 L 8.03 3.89 0.00 1.87 2.16 0.69 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.51 4.34 0.00 3.93 3.40 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 16 G 7.76 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 17 K 7.98 4.44 0.00 2.17 2.07 0.00 1.90 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.52 7.81 18 V 7.62 3.61 1.06 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 -0.07 0.00 0.00 0.56 0.00 0.00 19 N 8.14 4.50 0.00 2.66 2.53 0.00 0.00 6.80 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 7.84 3.44 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 1.04 0.00 0.00 0.85 0.00 0.00 21 D 8.15 4.35 0.00 2.98 2.67 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 22 E 8.52 3.86 0.00 2.11 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 2.45 0.00 23 V 8.40 3.60 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 0.90 0.00 0.00 0.73 0.00 0.00 24 G 8.15 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 0.00 0.00 0.00 25 G 7.97 3.61 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 0.00 0.00 0.00 26 E 7.95 4.02 0.00 2.25 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 2.26 2.29 0.00 27 A 7.84 3.91 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 28 L 7.73 4.05 0.00 1.75 1.63 0.76 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 29 G 7.92 3.57 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 0.00 30 R 8.63 3.95 0.00 1.95 1.95 0.00 3.23 0.00 0.00 3.03 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 31 L 7.82 4.06 0.00 1.96 1.83 0.95 0.74 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 32 L 7.78 4.34 0.00 1.71 1.69 0.79 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.25 3.55 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 0.71 0.00 0.00 0.88 0.00 0.00 34 V 7.82 3.44 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 -0.07 0.00 0.00 0.76 0.00 0.00 35 Y 7.34 3.70 0.00 2.62 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 36 P 0.00 4.27 0.00 2.37 2.33 0.00 3.50 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 2.20 1.95 0.00 37 W 8.07 4.34 0.00 3.57 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 38 T 7.92 4.33 4.44 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 1.06 0.00 0.00 39 Q 8.27 4.26 0.00 2.16 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.85 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 40 R 7.75 3.96 0.00 1.73 1.94 0.00 2.97 0.00 0.00 2.75 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.56 0.00 41 F 7.25 4.56 0.00 1.82 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 42 F 7.66 4.60 0.00 2.72 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 43 E 8.15 4.03 0.00 2.02 2.03 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 2.36 2.23 0.00 44 S 8.10 4.45 0.00 4.25 4.13 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 45 F 8.11 4.54 0.00 3.16 3.17 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 46 G 7.21 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 0.00 0.00 0.00 47 D 8.85 4.52 0.00 2.67 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 48 L 8.28 4.80 0.00 1.75 1.63 1.05 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.21 4.29 0.00 4.07 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 50 T 7.40 4.73 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 51 P 0.00 4.33 0.00 2.15 2.13 0.00 3.58 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 8.07 4.04 0.00 2.67 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 53 A 8.30 4.04 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 54 V 8.44 3.74 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 1.04 0.00 0.00 0.95 0.00 0.00 55 M 8.78 4.13 0.00 1.93 2.14 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.90 0.00 56 G 8.01 3.76 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 0.00 0.00 0.00 57 N 7.60 4.17 0.00 2.99 2.95 0.00 0.00 6.99 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 58 P 0.00 4.38 0.00 2.25 2.25 0.00 3.71 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 59 K 7.92 3.72 0.00 1.66 0.74 0.00 1.53 0.00 0.00 1.49 0.00 0.00 2.80 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.11 1.26 7.81 60 V 7.70 3.72 2.26 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 1.09 0.00 0.00 1.10 0.00 0.00 61 K 7.96 3.89 0.00 1.87 1.82 0.00 1.63 0.00 0.00 1.78 0.00 0.00 3.18 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.49 7.81 62 A 8.03 3.96 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 8.25 4.42 0.00 3.60 3.50 0.00 5.78 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 7.88 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 0.00 0.00 0.00 65 K 7.95 4.07 0.00 1.76 1.82 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.59 7.81 66 K 7.74 4.00 0.00 2.12 1.95 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.50 7.81 67 V 7.61 3.68 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 1.04 0.00 0.00 0.97 0.00 0.00 68 L 8.16 4.29 0.00 2.01 1.86 1.25 0.81 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 69 G 8.38 3.98 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 0.00 0.00 0.00 70 A 7.87 4.14 1.56 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 0.00 0.00 71 F 8.43 4.08 0.00 3.39 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 0.00 72 S 9.04 4.31 0.00 4.52 4.56 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 73 D 8.94 4.63 0.00 2.75 2.67 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 74 G 8.19 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 75 L 7.50 3.89 0.00 1.63 1.50 -0.12 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.51 4.42 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 7.95 4.88 0.00 3.03 3.14 0.00 5.82 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 78 L 7.95 4.18 0.00 1.51 1.63 0.77 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.78 4.66 0.00 2.63 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 80 N 8.27 5.02 0.00 2.66 2.60 0.00 0.00 7.06 6.67 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 81 L 7.86 4.06 0.00 1.78 1.91 0.84 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.25 3.90 0.00 1.82 1.78 0.00 1.53 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.20 7.81 83 G 7.90 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.43 3.75 3.87 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 0.08 0.00 0.00 85 F 8.08 4.72 0.00 3.27 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 86 A 7.62 4.10 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.86 3.84 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 88 L 7.93 4.11 0.00 1.85 1.99 1.07 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.38 4.44 0.00 4.24 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.26 4.02 0.00 2.07 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 0.00 2.32 2.57 0.00 91 L 7.55 3.86 0.00 1.77 1.79 0.89 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.43 4.15 0.00 3.67 3.74 0.00 5.85 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.29 3.80 0.00 1.23 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 0.00 0.00 0.00 94 D 8.21 4.05 0.00 2.71 2.67 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 95 K 7.95 4.31 0.00 1.88 1.80 0.00 1.55 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.41 7.81 96 L 7.76 4.01 0.00 1.65 1.59 0.68 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.19 4.02 0.00 3.25 3.45 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.99 4.13 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 0.16 0.00 0.00 0.54 0.00 0.00 99 D 8.66 4.40 0.00 2.78 2.53 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 0.00 100 P 0.00 2.97 0.00 2.03 1.84 0.00 3.48 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.48 0.00 101 E 8.57 3.80 0.00 2.35 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 2.27 2.37 0.00 102 N 7.71 4.33 0.00 2.59 2.83 0.00 0.00 7.07 9.28 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 0.00 103 F 7.41 4.44 0.00 3.04 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 0.00 104 R 7.90 3.93 0.00 2.09 1.97 0.00 3.28 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 105 L 7.88 3.76 0.00 1.65 1.19 0.61 0.15 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 0.00 106 L 8.09 4.02 0.00 1.80 1.91 0.93 1.12 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 0.00 107 G 8.19 4.34 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 0.00 108 N 7.96 4.36 0.00 3.05 2.97 0.00 0.00 6.77 7.75 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 0.00 109 V 8.06 3.62 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 1.13 0.00 0.00 1.22 0.00 0.00 110 L 8.88 3.87 0.00 1.57 1.83 0.80 0.24 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 0.00 111 V 7.79 3.60 2.26 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 1.18 0.00 0.00 1.14 0.00 0.00 112 C 8.39 4.12 0.00 3.15 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 7.82 3.53 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 1.10 0.00 0.00 0.92 0.00 0.00 114 L 8.11 3.81 0.00 0.97 1.09 0.83 0.81 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 0.00 115 A 7.67 3.53 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 7.83 4.14 0.00 3.24 3.46 0.00 5.95 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.00 3.90 0.00 3.20 2.92 0.00 5.79 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 8.62 4.61 0.00 3.24 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 0.00 119 G 8.52 3.97 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 0.00 0.00 0.00 120 K 9.29 3.94 0.00 1.82 1.98 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.56 7.81 121 E 8.01 4.08 0.00 2.50 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 0.00 2.45 2.37 0.00 122 F 8.21 4.50 0.00 3.10 3.21 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 0.00 123 T 7.27 4.13 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 124 P 0.00 4.16 0.00 2.14 2.16 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 2.21 0.00 125 P 0.00 4.32 0.00 2.11 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 7.21 3.68 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 0.99 0.00 0.00 0.90 0.00 0.00 127 Q 8.33 3.61 0.00 1.72 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 128 A 8.13 3.98 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.02 4.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 8.10 3.88 0.00 3.26 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 8.64 4.12 0.00 2.30 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.69 2.64 0.00 132 K 8.02 4.04 0.00 2.04 1.82 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.44 7.81 133 V 7.51 3.49 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.75 0.00 0.00 134 V 8.33 3.71 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 0.99 0.00 0.00 1.10 0.00 0.00 135 A 8.10 4.07 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 0.00 136 G 8.01 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 0.00 0.00 0.00 137 V 8.34 3.15 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 0.73 0.00 0.00 0.59 0.00 0.00 138 A 7.82 3.84 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 0.00 139 N 8.00 4.30 0.00 2.98 2.86 0.00 0.00 6.96 7.24 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 0.00 140 A 7.97 4.01 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 0.00 141 L 7.55 3.91 0.00 1.17 0.51 -0.31 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.68 4.18 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 7.65 4.00 0.00 3.08 3.70 0.00 5.77 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.23 4.41 0.00 1.81 1.80 0.00 1.57 0.00 0.00 1.61 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.80 7.81 145 Y 8.04 4.25 0.00 3.14 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 0.00 146 H 8.31 4.45 0.00 3.22 3.23 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