NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2644 8.2649 123.5815 51.3769 20.2563 176.2105 2 R 4.3250 7.7565 116.7308 54.4596 32.4499 170.2321 3 V 3.4558 9.0523 123.8028 66.2778 33.4215 176.6348 4 K 3.9128 8.1795 119.1220 57.4602 30.4464 175.2977 5 R 4.0018 7.7841 122.8880 59.5478 30.0442 178.5583 6 G 3.9507 8.1056 105.1143 48.2167 0.0000 175.5432 7 V 3.6623 7.8858 114.2879 63.6515 31.8831 177.7306 8 I 4.3751 7.3523 109.8287 61.5243 38.7514 177.4456 9 A 3.7096 8.3521 122.3795 55.0533 18.2321 179.1996 10 R 3.7292 7.9608 115.2945 59.4860 30.3379 178.5506 11 A 3.9630 8.0987 119.8742 55.5244 18.0629 179.3114 12 R 3.8570 8.1765 116.7423 59.8383 30.2749 178.1088 13 H 4.1951 7.9548 114.6148 59.0549 28.6118 177.3337 14 K 3.8426 8.0238 119.7948 59.8910 32.2397 177.7937 15 K 3.8979 8.2051 119.5761 60.1751 31.7812 178.6160 16 I 3.7451 7.6320 113.2687 63.8176 37.8272 177.5756 17 L 4.0616 8.3460 121.4405 57.0396 42.0789 178.6587 18 K 4.3852 7.5744 119.9817 55.8572 33.4974 177.8668 19 Q 4.1209 7.9399 117.8651 54.4993 27.1552 177.0803 20 A 3.9451 7.2798 122.1840 54.5358 20.1114 179.3229 21 K 4.0310 8.0050 116.1901 57.7164 32.7516 178.7229 22 G 3.8669 8.8770 108.7770 44.3521 0.0000 171.9691 23 Y 3.9871 7.5193 116.0876 56.5856 37.7455 169.0326 24 Y 4.9396 8.2225 118.4065 58.9170 43.1192 173.4014 25 G 3.2964 7.4308 115.9336 45.8842 0.0000 175.6856 26 A 3.9784 8.5176 123.9547 55.1923 18.2645 179.6130 27 R 4.1626 7.9976 111.4893 57.1387 29.7489 176.3800 28 S 4.7204 8.0737 112.5524 59.8761 70.0691 176.1340 29 R 3.9843 7.6105 118.7140 58.0312 30.1302 177.2085 30 V 4.3183 7.4228 116.9984 60.8976 33.1357 175.6538 31 Y 4.2366 8.8261 127.6051 60.5223 38.6277 178.2162 32 R 3.7373 8.3170 116.2455 59.1535 28.3969 178.0248 33 V 3.5254 8.1119 117.7770 64.0122 33.5603 180.1013 34 A 3.2687 8.1164 113.3639 49.6843 19.9602 179.3737 35 F 4.1528 9.7778 122.5695 59.8194 39.1248 175.3951 36 Q 4.1390 7.4877 116.6318 58.1936 29.1951 176.6909 37 A 4.1148 9.1288 121.2925 54.2955 19.8313 179.4871 38 V 3.9152 7.8156 116.9568 65.1079 31.0378 178.4224 39 I 3.6920 7.7670 120.5127 63.9051 36.9128 178.3107 40 K 3.6565 7.3818 118.8135 59.2518 31.7922 178.8742 41 A 4.1117 8.3664 121.5486 55.4896 18.1623 179.9574 42 G 3.5765 7.7285 103.9624 47.9322 0.0000 175.9978 43 Q 4.0734 7.9944 120.2503 59.2476 28.8001 178.2117 44 Y 4.4459 8.8158 118.5202 61.0792 37.3216 179.0219 45 A 3.9546 8.4596 121.8838 55.4105 18.4077 178.6926 46 Y 3.9738 7.9969 117.0059 61.1353 38.9423 178.3574 47 R 4.0145 7.7710 117.8135 58.5703 30.6284 178.5220 48 D 4.2573 7.7787 118.5585 57.2672 40.5438 178.8550 49 R 3.7916 7.3052 117.5524 59.4200 29.9257 178.2616 50 R 4.0267 7.6772 118.1305 58.8185 30.1279 177.7607 51 Q 3.7640 8.3645 117.2674 58.1602 28.9135 178.0975 52 R 3.6159 7.8306 121.4084 58.9582 29.8362 177.9903 53 K 3.9563 7.5166 118.5540 59.6412 31.9688 178.9020 54 R 4.0483 7.6066 115.3077 58.8754 29.3919 178.4405 55 Q 3.7126 7.7133 119.6293 58.7550 28.7250 178.3589 56 F 4.2725 7.7593 118.1159 59.7427 39.1712 177.6617 57 R 4.6504 7.6220 118.1194 59.8450 29.8242 178.2973 58 Q 3.9705 8.9252 119.7422 58.9223 28.9062 178.2696 59 L 3.9377 7.3517 121.0622 57.5967 42.2586 178.3988 60 W 4.5441 8.7358 120.4399 60.2267 29.1074 178.6377 61 I 3.8549 8.4389 112.7081 63.7322 36.7185 177.9285 62 A 3.9559 7.7487 122.8662 54.6780 18.0517 179.4580 63 R 3.8784 8.1168 114.2416 58.8121 29.9929 179.0710 64 I 3.7071 7.8375 120.5582 64.2439 36.9613 177.9329 65 N 4.4629 8.6385 116.7902 56.0436 38.8038 175.9958 66 A 4.3318 7.3494 120.0724 52.8678 19.6429 178.2894 67 A 4.3236 8.0547 119.1601 54.3377 19.5786 179.2282 68 A 4.1177 8.3540 119.7356 55.2170 18.2537 180.0456 69 R 4.5111 7.9366 115.6478 58.9247 29.4742 178.6036 70 Q 4.0322 7.6561 118.1229 57.8172 29.6174 176.2773 71 N 4.8934 7.7504 116.8624 52.2760 39.0431 173.6329 72 G 3.9568 7.8560 108.3795 46.5525 0.0000 169.5374 73 I 3.2008 8.2775 131.2443 60.6291 37.4102 174.0503 74 S 4.8501 8.3096 120.0931 57.6650 65.6195 174.2112 75 Y 4.4556 8.7451 121.9322 61.1851 38.0147 178.3388 76 S 4.2860 8.2284 114.9217 61.4573 63.1955 176.0945 77 K 4.2030 7.6095 121.2665 59.1259 32.0130 178.1138 78 F 4.4185 8.7920 121.0273 62.0850 39.1261 177.0083 79 I 3.2371 7.4407 118.2657 64.0754 36.7948 178.1335 80 N 4.3719 7.5271 117.8072 56.6919 39.0520 176.6672 81 G 3.6147 8.1289 107.4079 47.2121 0.0000 175.4186 82 L 3.7426 7.4271 121.7881 57.2254 41.8701 179.3391 83 K 4.0407 7.9731 117.3030 58.1950 32.0396 177.0968 84 K 4.1470 8.0143 118.9148 55.9556 31.8273 175.8675 85 A 4.3059 7.7902 125.0118 52.2303 21.4747 175.7149 86 S 4.5135 8.7634 115.1929 59.8249 63.8875 176.0325 87 V 4.2015 7.4657 115.8712 63.2010 33.3558 174.6752 88 E 4.1244 8.0324 118.4801 57.0287 27.4851 176.4207 89 I 4.3274 7.9468 118.1809 60.6458 41.4287 173.7697 90 D 4.2772 7.9575 118.9879 54.8225 40.2058 177.2427 91 R 4.2356 8.3395 124.6004 56.0498 31.3862 177.3463 92 K 4.5365 7.9335 126.4146 54.8887 30.6740 177.4366 93 I 2.0000 6.8618 114.7318 61.4192 37.8671 174.0387 94 L 4.1638 7.2346 119.0014 57.4186 41.0266 178.6698 95 A 4.1213 7.6673 123.4129 54.9520 18.6118 178.5546 96 D 4.4297 8.1865 112.6124 54.9925 41.0983 177.6153 97 I 2.1205 7.7018 121.0420 64.1444 37.1651 177.7803 98 A 3.6671 7.2544 121.3076 54.0911 18.2261 178.3107 99 V 3.9854 7.5107 108.7673 61.9806 32.6977 176.8009 100 F 4.7257 7.0031 112.3793 57.5973 40.1078 175.7775 101 D 5.0348 6.9900 120.6026 51.9689 40.9471 176.6086 102 K 3.8695 8.0384 123.5145 60.7721 32.5908 178.6606 103 V 3.5671 7.8867 112.7545 64.0020 31.2684 177.9512 104 A 3.9858 7.9091 118.6457 55.1342 18.5623 178.5970 105 F 4.1034 8.6871 118.9137 62.0052 39.0947 177.6189 106 T 3.7879 8.8977 112.4381 64.3957 66.9154 175.1911 107 A 4.8771 7.8356 122.1301 52.4373 18.5448 177.8711 108 L 4.3491 7.8611 118.7758 56.0219 42.7406 178.5626 109 V 3.5870 6.8934 111.0774 63.9811 31.2592 178.1487 110 E 3.5881 7.9947 118.1738 58.8014 29.2430 178.5486 111 K 4.0531 7.5951 117.4786 58.0550 32.3482 177.1402 112 A 4.5315 7.5940 118.6390 53.8560 20.3104 177.6311 113 K 3.8254 8.9119 118.8915 60.0274 32.0711 178.7496 114 A 3.7655 7.8601 119.1812 54.3220 18.3309 179.0858 115 A 4.2327 7.1840 118.9480 53.7625 18.6767 177.7941 116 L 3.7653 8.1532 117.8040 55.0200 41.9736 177.3545 117 A 4.1577 8.8043 125.6086 52.7667 18.1437 176.8423 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 A 8.26 4.26 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 2 R 7.76 4.33 0.00 1.83 1.83 0.00 3.21 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 3 V 9.05 3.46 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 0.75 0.00 0.00 0.92 0.00 0.00 4 K 8.18 3.91 0.00 1.93 1.87 0.00 1.69 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.49 7.81 5 R 7.78 4.00 0.00 1.86 1.96 0.00 3.20 0.00 0.00 3.32 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 6 G 8.11 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 7 V 7.89 3.66 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 0.88 0.00 0.00 0.97 0.00 0.00 8 I 7.35 4.38 1.87 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 1.56 0.94 0.91 0.00 0.00 9 A 8.35 3.71 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 10 R 7.96 3.73 0.00 1.90 1.91 0.00 3.14 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 11 A 8.10 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 12 R 8.18 3.86 0.00 1.98 2.00 0.00 3.21 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.80 0.00 13 H 7.95 4.20 0.00 3.23 3.36 0.00 5.89 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.02 3.84 0.00 1.88 2.00 0.00 1.83 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.48 7.81 15 K 8.21 3.90 0.00 2.01 2.10 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.48 7.81 16 I 7.63 3.75 1.85 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.02 0.84 0.00 0.00 17 L 8.35 4.06 0.00 1.88 1.86 1.03 0.73 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 18 K 7.57 4.39 0.00 2.07 1.79 0.00 1.84 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.46 7.81 19 Q 7.94 4.12 0.00 1.75 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.35 0.00 0.00 0.00 0.00 0.00 2.42 1.98 0.00 20 A 7.28 3.95 1.25 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 0.00 0.00 21 K 8.00 4.03 0.00 1.95 2.23 0.00 2.25 0.00 0.00 1.98 0.00 0.00 3.10 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.69 1.62 7.81 22 G 8.88 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 0.00 0.00 0.00 0.00 23 Y 7.52 3.99 0.00 3.11 2.94 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 24 Y 8.22 4.94 0.00 3.08 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 25 G 7.43 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 0.00 0.00 0.00 26 A 8.52 3.98 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 27 R 8.00 4.16 0.00 2.27 2.26 0.00 3.34 0.00 0.00 3.51 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.67 0.00 28 S 8.07 4.72 0.00 3.88 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 0.00 29 R 7.61 3.98 0.00 1.90 2.01 0.00 3.29 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 30 V 7.42 4.32 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 1.06 0.00 0.00 0.93 0.00 0.00 31 Y 8.83 4.24 0.00 3.10 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 32 R 8.32 3.74 0.00 2.04 2.22 0.00 3.05 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 33 V 8.11 3.53 2.17 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 0.81 0.00 0.00 1.03 0.00 0.00 34 A 8.12 3.27 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 F 9.78 4.15 0.00 2.79 3.12 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 0.00 0.00 0.00 0.00 36 Q 7.49 4.14 0.00 2.49 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.65 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 37 A 9.13 4.11 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 38 V 7.82 3.92 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 0.84 0.00 0.00 0.89 0.00 0.00 39 I 7.77 3.69 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.28 0.93 0.00 0.00 40 K 7.38 3.66 0.00 1.55 1.38 0.00 0.61 0.00 0.00 1.12 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.24 1.30 7.81 41 A 8.37 4.11 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 42 G 7.73 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 43 Q 7.99 4.07 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.71 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 44 Y 8.82 4.45 0.00 2.94 2.93 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 45 A 8.46 3.95 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.00 3.97 0.00 3.13 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 47 R 7.77 4.01 0.00 1.88 1.91 0.00 3.21 0.00 0.00 3.40 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.86 0.00 48 D 7.78 4.26 0.00 2.72 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.31 3.79 0.00 1.74 1.84 0.00 3.28 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 50 R 7.68 4.03 0.00 1.75 1.68 0.00 3.13 0.00 0.00 3.37 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 51 Q 8.36 3.76 0.00 2.22 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 52 R 7.83 3.62 0.00 2.06 1.77 0.00 2.89 0.00 0.00 2.89 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.99 0.00 53 K 7.52 3.96 0.00 1.74 1.97 0.00 1.71 0.00 0.00 1.86 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.60 7.81 54 R 7.61 4.05 0.00 2.18 2.20 0.00 2.78 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.59 0.00 55 Q 7.71 3.71 0.00 1.99 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.13 2.32 0.00 56 F 7.76 4.27 0.00 2.71 1.70 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 57 R 7.62 4.65 0.00 2.46 2.28 0.00 3.31 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.93 0.00 58 Q 8.93 3.97 0.00 2.27 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 59 L 7.35 3.94 0.00 1.61 1.64 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 60 W 8.74 4.54 0.00 3.68 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 61 I 8.44 3.85 1.04 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 1.63 0.60 1.14 0.00 0.00 62 A 7.75 3.96 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 63 R 8.12 3.88 0.00 2.00 2.16 0.00 2.92 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.61 0.00 64 I 7.84 3.71 2.24 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.03 1.48 0.00 0.00 65 N 8.64 4.46 0.00 2.49 2.92 0.00 0.00 7.18 8.02 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 66 A 7.35 4.33 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 67 A 8.05 4.32 1.03 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 0.00 0.00 68 A 8.35 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.94 4.51 0.00 2.08 2.31 0.00 3.16 0.00 0.00 3.24 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.55 0.00 70 Q 7.66 4.03 0.00 2.13 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.44 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 71 N 7.75 4.89 0.00 2.67 2.73 0.00 0.00 7.06 7.32 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 72 G 7.86 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 73 I 8.28 3.20 1.87 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 1.50 0.91 0.99 0.00 0.00 74 S 8.31 4.85 0.00 4.15 4.06 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 75 Y 8.75 4.46 0.00 3.12 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 76 S 8.23 4.29 0.00 3.96 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 77 K 7.61 4.20 0.00 2.11 1.87 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.47 7.81 78 F 8.79 4.42 0.00 3.08 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 79 I 7.44 3.24 1.57 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 -0.11 0.71 0.00 0.00 80 N 7.53 4.37 0.00 2.62 2.87 0.00 0.00 7.15 7.83 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 81 G 8.13 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 82 L 7.43 3.74 0.00 1.45 1.51 -0.20 0.56 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 83 K 7.97 4.04 0.00 1.75 1.84 0.00 1.62 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.50 7.81 84 K 8.01 4.15 0.00 1.76 1.74 0.00 1.61 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.39 7.81 85 A 7.79 4.31 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 86 S 8.76 4.51 0.00 3.85 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 87 V 7.47 4.20 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 0.83 0.00 0.00 0.92 0.00 0.00 88 E 8.03 4.12 0.00 1.95 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 2.29 2.22 0.00 89 I 7.95 4.33 1.82 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 1.35 0.58 0.87 0.00 0.00 90 D 7.96 4.28 0.00 2.69 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.34 4.24 0.00 1.69 1.84 0.00 3.41 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 92 K 7.93 4.54 0.00 1.86 1.30 0.00 1.49 0.00 0.00 1.38 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.01 1.35 7.81 93 I 6.86 2.00 0.68 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 1.35 0.68 0.62 0.00 0.00 94 L 7.23 4.16 0.00 1.93 1.93 0.94 0.77 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 95 A 7.67 4.12 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 96 D 8.19 4.43 0.00 3.12 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 97 I 7.70 2.12 1.95 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.90 0.93 0.00 0.00 98 A 7.25 3.67 0.57 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 99 V 7.51 3.99 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 0.76 0.00 0.00 1.07 0.00 0.00 100 F 7.00 4.73 0.00 3.14 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 0.00 101 D 6.99 5.03 0.00 3.07 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 0.00 102 K 8.04 3.87 0.00 1.99 2.06 0.00 1.60 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.52 7.81 103 V 7.89 3.57 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 0.80 0.00 0.00 0.97 0.00 0.00 104 A 7.91 3.99 1.50 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 0.00 0.00 105 F 8.69 4.10 0.00 3.03 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 0.00 106 T 8.90 3.79 4.26 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 1.29 0.00 0.00 107 A 7.84 4.88 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 7.86 4.35 0.00 1.80 1.54 1.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 109 V 6.89 3.59 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 0.03 0.00 0.00 0.79 0.00 0.00 110 E 7.99 3.59 0.00 1.98 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 2.36 2.37 0.00 111 K 7.60 4.05 0.00 1.77 2.06 0.00 2.20 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.52 7.81 112 A 7.59 4.53 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.91 3.83 0.00 1.84 1.82 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.47 7.81 114 A 7.86 3.77 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 0.00 115 A 7.18 4.23 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 0.00 116 L 8.15 3.77 0.00 1.79 1.67 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 117 A 8.80 4.16 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00