NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5892 8.3493 120.1898 53.0747 43.3053 175.5849 3 K 4.3142 7.7891 116.7919 55.9046 33.2280 174.4762 4 I 4.0700 7.6865 121.3439 61.1256 38.4131 177.0217 5 I 4.0391 8.2600 127.4316 61.1431 39.7480 174.0480 6 H 5.1178 8.4742 120.6652 54.1107 31.6495 173.3263 7 L 4.9647 9.2518 123.8407 53.4182 44.2164 175.5107 8 T 4.8998 8.2641 109.9583 60.1007 72.1067 174.6735 9 E 4.0947 8.7449 120.3158 58.8380 29.6769 177.6593 10 D 4.7719 7.6264 116.3395 53.5270 39.9714 176.7522 11 S 4.6590 7.8095 113.7317 58.2139 65.4221 175.6835 12 F 3.9744 8.1986 123.6419 61.5054 38.9246 176.2245 13 D 4.3098 8.3353 116.7848 57.9971 40.7175 178.5038 14 T 3.8750 7.6899 113.8656 66.6863 68.7593 176.4166 15 D 4.4317 8.4081 119.5210 56.3023 41.1222 177.0302 16 V 3.9254 7.2913 117.0328 64.2012 34.2819 177.1189 17 L 4.2385 7.4062 116.7265 56.4589 41.7902 177.7666 18 K 4.4141 7.9305 116.8177 55.8270 32.1190 175.5829 19 A 4.5695 7.4725 122.3414 50.6468 20.3899 177.3994 20 D 4.6058 8.3624 121.6962 55.0394 41.8939 177.3005 21 G 3.9023 8.7715 107.0809 45.1113 0.0000 171.5849 22 A 5.0330 8.1228 119.6960 50.7095 20.9812 176.4390 23 I 4.9427 9.2941 122.8512 59.4306 41.3872 174.2646 24 L 4.9251 8.8773 130.2375 53.8777 43.3219 175.4317 25 V 4.0797 8.8700 128.1720 62.5189 33.1260 174.5079 26 D 5.1177 8.9762 129.2566 52.6180 40.9651 174.2338 27 F 5.0494 9.1339 124.6345 56.9940 40.3409 174.4874 28 W 5.3314 9.1434 119.3127 56.0158 32.0766 172.9435 29 A 3.7858 7.8728 119.7031 50.3358 21.2166 177.2747 30 E 4.0802 8.3751 120.7588 58.3871 29.9356 177.6980 31 W 4.6333 7.5705 113.6883 56.7605 28.6748 177.4822 32 C 4.8653 7.7095 121.0573 54.4772 41.4532 173.7841 33 G 3.9524 8.6417 113.9133 47.2563 0.0000 170.6042 34 P 4.2519 0.0000 0.0000 65.8121 31.2146 178.4274 35 C 4.0086 8.3109 116.0339 59.9340 39.9022 175.9138 36 K 3.7073 8.3111 120.3738 60.0699 31.7497 178.5278 37 M 4.1836 8.1012 118.3412 58.4187 32.3395 178.3110 38 I 3.7407 8.5415 118.8416 63.5577 37.7106 177.4734 39 A 3.8203 7.8069 122.2982 54.8752 17.9894 177.8884 40 P 4.3932 0.0000 0.0000 65.4441 31.3917 178.7487 41 I 3.6389 8.1058 120.5555 64.5348 37.0775 178.0478 42 L 3.9771 7.9979 119.1342 57.9242 41.3213 179.3651 43 D 4.2898 7.6128 118.4030 57.5730 40.8532 178.7066 44 E 4.0121 7.8292 118.9258 59.4894 29.4329 179.5776 45 I 3.8157 8.2823 120.1730 63.9142 36.8636 178.2927 46 A 3.9833 8.0423 121.4680 55.5073 18.3673 179.2274 47 D 4.4680 7.8380 115.7611 57.2153 40.9198 178.7692 48 E 4.1745 8.0784 118.4364 59.3168 29.4768 178.9176 49 Y 4.5034 8.3407 116.0842 57.1750 39.7080 175.6723 50 Q 3.9782 7.6114 120.2432 57.3532 29.8596 177.5074 51 G 4.1083 8.8546 110.3646 45.6395 0.0000 174.2562 52 K 4.5444 7.8459 116.0973 56.4309 34.3110 175.8135 53 L 4.8387 7.8360 120.0862 54.1650 45.5495 174.4908 54 T 4.6059 8.6159 121.8444 61.7128 71.6270 173.4136 55 V 4.3662 8.3532 126.0060 62.1007 32.8034 174.5388 56 A 4.9310 9.2619 130.3297 50.2825 22.0534 175.3223 57 K 4.9525 8.2002 117.3298 54.3819 35.8970 175.1245 58 L 5.0165 8.5960 125.9705 53.1928 45.0775 174.5921 59 N 4.3087 8.8256 126.0444 52.7806 39.3637 175.4363 60 I 4.1293 8.4411 120.8571 62.9183 38.1178 177.4926 61 D 4.4901 8.1262 122.6159 57.5280 40.8767 177.8491 62 Q 4.1436 8.0874 116.9608 58.5295 28.7406 176.8678 63 N 5.0716 7.7968 114.7376 50.8216 39.1449 172.6477 64 P 4.5539 0.0000 0.0000 64.4160 32.4883 178.7563 65 G 3.6693 8.8456 107.3458 47.5953 0.0000 174.2943 66 T 3.9036 7.5341 117.8475 64.5330 69.5513 176.3161 67 A 3.7754 8.1639 123.1468 55.0661 18.7569 177.5218 68 P 4.1780 0.0000 0.0000 67.1106 30.7132 178.9955 69 K 3.8447 8.1833 122.3898 58.8671 30.0791 179.2805 70 Y 4.9073 8.2289 115.7466 56.9977 38.2948 175.9835 71 G 4.1994 7.7465 106.6087 46.3779 0.0000 174.0464 72 I 4.0164 7.0329 119.3690 60.3874 37.6012 176.4274 73 R 4.5048 8.0907 122.6571 55.4988 31.4000 175.5610 74 G 4.1178 7.2044 104.4953 45.0163 0.0000 172.7059 75 I 4.8021 8.1229 113.0180 57.4385 40.7849 173.3052 76 P 4.4780 0.0000 0.0000 64.0015 31.8118 175.6910 77 T 4.9451 8.4691 117.7249 62.0656 72.8934 172.6799 78 L 5.4414 8.9303 126.0015 52.9959 44.7175 175.2414 79 L 5.0208 8.8660 124.0966 53.2374 45.6305 174.5615 80 L 5.0195 8.5637 127.8574 53.7113 44.1049 174.5686 81 F 5.4123 9.4184 125.5763 55.6261 41.8452 174.5808 82 K 4.8085 8.7694 122.8219 54.9856 35.2330 176.0627 83 N 3.9917 8.9817 121.9376 53.8082 37.8500 174.8202 84 G 4.3326 8.7680 101.6490 44.4537 0.0000 173.7068 85 E 4.8562 8.0409 118.3710 53.6633 33.0139 175.4679 86 V 3.2997 8.5085 121.5158 63.2273 31.7037 175.7056 87 A 4.2108 9.2278 132.1457 54.1295 19.0443 176.8652 88 A 4.7231 7.4938 115.4378 50.5273 22.3090 175.5909 89 T 3.9084 8.5526 116.0581 63.5477 69.0676 174.3623 90 K 4.2033 8.5241 123.9326 57.6292 33.2485 176.1796 91 V 4.2663 8.8259 115.6740 59.0719 35.3419 175.2216 92 G 4.1014 8.4013 111.5686 46.4675 0.0000 177.1023 93 A 4.5917 8.2453 120.7715 50.1469 17.6834 176.2312 94 L 4.2737 7.5584 122.1605 54.0089 43.0366 177.8498 95 S 4.5740 8.3172 115.3384 56.9827 65.7619 174.8994 96 K 3.8588 8.6294 122.7017 60.0332 31.8385 178.1556 97 G 3.9009 8.2628 104.8603 48.7761 0.0000 175.3682 98 Q 4.2840 8.1705 120.2589 57.7297 28.7596 178.5827 99 L 4.0236 8.3945 122.2226 57.9871 42.0319 178.8003 100 K 4.0015 8.0856 119.8452 59.1587 32.0704 178.5547 101 E 3.9821 8.1337 117.9393 59.4521 29.0677 178.9081 102 F 4.2198 8.5022 120.1800 61.7801 39.4453 177.6301 103 L 3.5365 7.9125 118.0323 57.6550 41.1743 179.0177 104 D 4.4094 8.2275 117.7323 57.5991 40.9439 178.8177 105 A 4.1252 8.5293 119.5067 54.1933 18.3327 177.7383 106 N 4.6475 7.1738 112.1291 54.1818 40.7371 175.5665 107 L 4.0371 8.3289 117.9198 55.2152 42.4581 176.8086 108 A 4.0901 8.6564 124.7745 52.7832 18.6713 176.5696 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 D 8.35 4.59 0.00 2.64 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.79 4.31 0.00 1.85 1.84 0.00 1.64 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.46 7.81 4 I 7.69 4.07 1.74 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.53 0.80 0.00 0.00 5 I 8.26 4.04 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.33 0.89 0.00 0.00 6 H 8.47 5.12 0.00 3.02 3.22 0.00 5.92 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 9.25 4.96 0.00 1.61 1.70 1.06 0.79 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 8 T 8.26 4.90 4.28 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 1.25 0.00 0.00 9 E 8.74 4.09 0.00 2.01 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 0.00 2.29 2.31 0.00 10 D 7.63 4.77 0.00 2.80 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 7.81 4.66 0.00 4.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 F 8.20 3.97 0.00 3.32 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 13 D 8.34 4.31 0.00 2.91 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 14 T 7.69 3.88 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 1.18 0.00 0.00 15 D 8.41 4.43 0.00 2.59 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 16 V 7.29 3.93 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 0.00 0.00 -0.34 0.00 0.00 0.09 0.00 0.00 17 L 7.41 4.24 0.00 1.91 1.72 1.21 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.93 4.41 0.00 1.91 1.76 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.48 7.81 19 A 7.47 4.57 1.22 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 0.00 0.00 0.00 20 D 8.36 4.61 0.00 2.67 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 8.77 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 22 A 8.12 5.03 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 23 I 9.29 4.94 1.84 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 1.07 0.73 0.88 0.00 0.00 24 L 8.88 4.93 0.00 1.78 1.55 1.13 1.01 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 25 V 8.87 4.08 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 0.10 0.00 0.00 1.01 0.00 0.00 26 D 8.98 5.12 0.00 2.74 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 27 F 9.13 5.05 0.00 3.24 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 28 W 9.14 5.33 0.00 3.39 3.22 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 0.00 29 A 7.87 3.79 0.17 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 30 E 8.38 4.08 0.00 1.85 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 0.00 2.38 2.48 0.00 31 W 7.57 4.63 0.00 3.49 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 32 C 7.71 4.87 0.00 2.15 2.78 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 33 G 8.64 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 34 P 0.00 4.25 0.00 2.29 2.35 0.00 3.71 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 35 C 8.31 4.01 0.00 3.24 3.35 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 36 K 8.31 3.71 0.00 1.90 2.10 0.00 1.86 0.00 0.00 1.74 0.00 0.00 3.10 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.58 7.81 37 M 8.10 4.18 0.00 2.00 2.22 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.87 0.00 38 I 8.54 3.74 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.87 0.97 0.00 0.00 39 A 7.81 3.82 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 40 P 0.00 4.39 0.00 2.24 2.28 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.02 0.00 41 I 8.11 3.64 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.60 0.89 0.00 0.00 42 L 8.00 3.98 0.00 1.72 1.66 0.80 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 43 D 7.61 4.29 0.00 2.85 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 44 E 7.83 4.01 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 2.34 2.35 0.00 45 I 8.28 3.82 1.79 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.87 0.59 0.00 0.00 46 A 8.04 3.98 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 47 D 7.84 4.47 0.00 2.69 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 48 E 8.08 4.17 0.00 2.28 2.13 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 2.38 2.43 0.00 49 Y 8.34 4.50 0.00 3.05 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 50 Q 7.61 3.98 0.00 2.21 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.80 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 51 G 8.85 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 7.85 4.54 0.00 1.86 1.88 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.77 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.38 1.50 7.81 53 L 7.84 4.84 0.00 1.71 1.75 0.93 0.64 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 54 T 8.62 4.61 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 1.17 0.00 0.00 55 V 8.35 4.37 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 0.88 0.00 0.00 0.93 0.00 0.00 56 A 9.26 4.93 1.15 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 57 K 8.20 4.95 0.00 1.71 1.70 0.00 0.95 0.00 0.00 0.82 0.00 0.00 2.53 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.21 1.12 7.81 58 L 8.60 5.02 0.00 1.64 1.31 0.99 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.83 4.31 0.00 2.43 2.46 0.00 0.00 6.95 7.52 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 60 I 8.44 4.13 1.90 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.04 1.04 0.00 0.00 61 D 8.13 4.49 0.00 2.74 2.77 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 0.00 0.00 0.00 62 Q 8.09 4.14 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 7.22 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 63 N 7.80 5.07 0.00 2.88 2.69 0.00 0.00 6.62 7.62 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 64 P 0.00 4.55 0.00 2.18 2.18 0.00 4.01 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 65 G 8.85 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 0.00 0.00 0.00 66 T 7.53 3.90 4.28 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 0.65 0.00 0.00 67 A 8.16 3.78 1.02 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 68 P 0.00 4.18 0.00 2.21 2.32 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.11 0.00 69 K 8.18 3.84 0.00 1.84 1.78 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.36 7.81 70 Y 8.23 4.91 0.00 3.01 3.07 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 71 G 7.75 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 0.00 0.00 0.00 0.00 72 I 7.03 4.02 1.57 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.47 0.58 0.00 0.00 73 R 8.09 4.50 0.00 2.00 1.91 0.00 3.36 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.15 0.00 74 G 7.20 4.12 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 0.00 0.00 0.00 75 I 8.12 4.80 1.86 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.65 0.94 0.00 0.00 76 P 0.00 4.48 0.00 2.11 2.13 0.00 3.73 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 2.00 2.03 0.00 77 T 8.47 4.95 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 1.28 0.00 0.00 78 L 8.93 5.44 0.00 1.53 1.59 0.89 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.87 5.02 0.00 2.06 1.80 0.90 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 80 L 8.56 5.02 0.00 2.05 1.64 0.90 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.42 5.41 0.00 3.02 2.86 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 0.00 0.00 0.00 82 K 8.77 4.81 0.00 1.68 1.68 0.00 1.81 0.00 0.00 1.56 0.00 0.00 2.74 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.32 7.81 83 N 8.98 3.99 0.00 2.81 2.88 0.00 0.00 7.24 9.22 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 84 G 8.77 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 0.00 0.00 0.00 0.00 85 E 8.04 4.86 0.00 2.18 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 2.29 2.28 0.00 86 V 8.51 3.30 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 0.59 0.00 0.00 0.79 0.00 0.00 87 A 9.23 4.21 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 88 A 7.49 4.72 1.41 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 0.00 0.00 89 T 8.55 3.91 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 1.19 0.00 0.00 90 K 8.52 4.20 0.00 1.74 1.80 0.00 1.48 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.44 7.81 91 V 8.83 4.27 1.73 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 0.08 0.00 0.00 0.51 0.00 0.00 92 G 8.40 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 0.00 0.00 0.00 93 A 8.25 4.59 1.24 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 0.00 0.00 0.00 94 L 7.56 4.27 0.00 1.60 1.60 0.69 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.32 4.57 0.00 4.04 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 96 K 8.63 3.86 0.00 1.84 1.88 0.00 1.84 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.54 1.55 7.81 97 G 8.26 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 98 Q 8.17 4.28 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 99 L 8.39 4.02 0.00 1.94 1.79 1.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.09 4.00 0.00 2.10 1.98 0.00 2.04 0.00 0.00 1.98 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.75 1.59 7.81 101 E 8.13 3.98 0.00 2.28 2.05 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 2.37 2.38 0.00 102 F 8.50 4.22 0.00 3.06 3.33 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 0.00 103 L 7.91 3.54 0.00 1.56 1.51 0.31 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.23 4.41 0.00 2.92 2.78 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 0.00 105 A 8.53 4.13 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 0.00 106 N 7.17 4.65 0.00 2.37 2.54 0.00 0.00 7.02 7.73 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 0.00 107 L 8.33 4.04 0.00 1.60 1.61 1.06 0.78 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 0.00 108 A 8.66 4.09 1.26 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 0.00 0.00