NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 18 F 4.2855 8.1833 122.8189 58.4796 40.5772 175.1148 19 L 3.3790 7.8417 120.7810 54.6261 39.5825 175.2708 20 K 3.8900 7.9146 120.5330 59.0617 33.0035 178.8763 21 G 3.6236 7.8726 106.3434 47.3844 0.0000 174.2564 22 L 4.2036 8.0792 119.9991 55.6363 42.4210 176.8452 23 V 3.7709 6.9715 117.6566 64.2379 31.8689 174.7898 24 N 4.1889 8.6326 120.9066 54.4476 36.8218 173.4622 25 H 4.9265 8.5511 114.7394 53.9532 32.8701 172.9404 26 R 4.8545 8.3820 119.8234 55.4929 31.4592 175.4312 27 V 4.9794 9.0563 119.2253 59.5062 36.8021 174.6757 28 G 4.3236 9.8865 109.7439 44.5975 0.0000 172.1582 29 V 4.7666 8.9297 127.1295 61.3868 32.5989 174.2521 30 K 4.6090 8.6950 130.4482 54.6444 34.0396 175.7464 31 L 4.3113 7.7320 126.9179 53.5215 42.7638 177.0974 32 K 4.1597 8.1233 120.2377 58.3738 32.4510 178.0092 33 F 4.9197 6.5767 113.0175 55.9137 40.8078 176.7565 34 N 4.4998 9.7246 117.9375 53.6066 36.0722 175.8510 35 S 4.6907 8.0863 106.7333 58.6230 63.4081 173.2663 36 T 5.0000 7.5555 120.2123 62.3304 72.3451 173.7496 37 E 4.7548 8.9700 125.8134 54.7272 33.6877 173.3111 38 Y 5.2549 8.7760 124.5926 56.7797 40.0820 174.6502 39 R 5.0547 8.5881 123.9172 54.7485 33.0921 176.0879 40 G 4.2702 8.1409 108.0371 46.8388 0.0000 171.2418 41 T 4.9621 7.9220 116.6794 62.0052 70.8031 174.5561 42 L 4.5446 8.7892 129.2578 54.4792 41.8656 177.4352 43 V 3.7305 8.4488 126.9748 65.3702 31.8143 175.8717 44 S 4.7499 7.6866 112.5778 57.9343 66.3974 172.1736 45 T 5.0706 8.1982 116.1512 62.5258 73.0943 172.1493 46 D 4.9607 8.3993 120.9342 51.3391 42.7383 175.9376 47 N 4.6401 8.9607 115.9976 56.4574 38.4127 175.7240 48 Y 4.4298 10.6589 113.1519 57.8049 38.2904 176.3408 49 F 3.8549 8.8504 118.8240 57.1503 37.4597 174.2690 50 N 5.0524 7.9767 118.5749 52.6139 38.6345 174.5606 51 L 4.9705 8.4411 123.4910 53.9059 44.3363 175.1275 52 Q 4.2750 8.5167 121.6957 54.3798 30.7740 173.8564 53 L 4.9809 8.4276 129.3936 53.2580 44.7404 174.8404 54 N 4.9672 9.1834 125.4716 51.7892 40.9501 174.1798 55 E 4.0449 8.1385 120.9884 57.3499 28.0031 175.2620 56 A 4.6359 7.5902 119.9039 51.9525 20.7111 177.9186 57 E 4.8944 9.1653 121.2434 54.5377 33.3665 173.9260 58 E 4.6472 9.3443 129.4493 56.0245 31.0168 175.0779 59 F 5.0107 9.5809 125.9937 55.5697 42.2798 174.6385 60 V 4.5428 8.5145 122.6151 61.2559 34.1360 175.3759 61 A 3.8724 9.8287 132.4797 53.3214 16.6171 177.2385 62 G 3.9966 8.5264 103.8240 47.3330 0.0000 174.0553 63 V 4.4720 8.0560 119.6763 60.2445 33.8313 175.0610 64 S 3.7811 8.6057 121.7907 58.6610 62.7196 173.1615 65 H 4.6560 9.0983 124.0882 55.7313 29.3362 173.4914 66 G 3.7770 8.3497 106.6623 45.1046 0.0000 172.9725 67 T 4.9585 8.0587 114.6408 61.6610 70.4051 174.2297 68 L 4.8251 8.1288 125.5806 52.0130 44.6003 178.1322 69 G 4.2952 8.6106 114.0445 46.3361 0.0000 176.3523 70 E 4.7242 9.2254 125.6929 55.5452 30.8073 174.3275 71 I 4.7122 8.7207 116.7780 59.0738 41.6278 174.1805 72 F 5.1054 8.9577 121.6240 56.0300 40.7311 174.6071 73 I 4.5135 8.7731 125.5455 59.6090 39.6404 175.5279 74 R 4.4593 8.6500 127.5526 55.9773 30.8928 177.5316 75 S 4.2101 8.7752 120.1454 61.8893 62.5990 174.7882 76 N 3.7887 7.8433 117.8199 56.1726 38.8995 175.9297 77 N 4.6675 8.3738 114.6474 54.2843 39.1785 174.9034 78 V 4.2986 8.4289 120.2209 62.1587 32.4561 174.9601 79 L 4.3730 9.5311 130.6734 57.0532 42.5299 175.6201 80 Y 5.0052 6.9676 113.9882 56.3925 41.5679 172.3632 81 I 5.4575 8.7193 119.6234 59.5166 40.3117 175.4593 82 R 4.7547 9.2248 123.1437 54.0205 32.3623 174.6478 83 E 4.2669 8.8359 123.3378 56.3049 30.6314 175.6335 84 L 4.5451 9.0746 128.0935 52.5440 42.8259 175.1786 85 P 4.3749 0.0000 0.0000 63.2670 30.9709 175.9966 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 18 F 8.18 4.29 0.00 3.08 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 19 L 7.84 3.38 0.00 1.92 1.65 0.03 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 20 K 7.91 3.89 0.00 1.75 1.84 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.62 1.49 7.81 21 G 7.87 3.62 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 0.00 0.00 0.00 22 L 8.08 4.20 0.00 1.81 1.71 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 23 V 6.97 3.77 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 0.93 0.00 0.00 24 N 8.63 4.19 0.00 2.86 2.78 0.00 0.00 6.80 7.43 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 25 H 8.55 4.93 0.00 3.17 3.20 0.00 5.80 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.38 4.85 0.00 1.90 1.81 0.00 3.12 0.00 0.00 3.34 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 27 V 9.06 4.98 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 0.78 0.00 0.00 1.03 0.00 0.00 28 G 9.89 4.32 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 0.00 29 V 8.93 4.77 2.25 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 1.07 0.00 0.00 1.01 0.00 0.00 30 K 8.69 4.61 0.00 1.31 0.74 0.00 1.29 0.00 0.00 1.35 0.00 0.00 2.83 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.44 0.99 7.81 31 L 7.73 4.31 0.00 0.96 0.97 0.78 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.12 4.16 0.00 1.75 1.87 0.00 1.92 0.00 0.00 1.95 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.47 7.81 33 F 6.58 4.92 0.00 3.12 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 34 N 9.72 4.50 0.00 2.88 2.91 0.00 0.00 6.75 7.57 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 35 S 8.09 4.69 0.00 3.80 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 36 T 7.56 5.00 3.93 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 0.81 0.00 0.00 37 E 8.97 4.75 0.00 1.82 1.65 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 2.14 2.25 0.00 38 Y 8.78 5.25 0.00 3.04 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 39 R 8.59 5.05 0.00 1.92 1.81 0.00 2.24 0.00 0.00 2.81 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.54 0.00 40 G 8.14 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 0.00 0.00 0.00 0.00 41 T 7.92 4.96 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 1.23 0.00 0.00 42 L 8.79 4.54 0.00 1.77 1.59 0.99 0.95 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 43 V 8.45 3.73 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 0.88 0.00 0.00 0.90 0.00 0.00 44 S 7.69 4.75 0.00 3.91 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 45 T 8.20 5.07 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 46 D 8.40 4.96 0.00 2.79 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 47 N 8.96 4.64 0.00 2.88 3.13 0.00 0.00 6.84 7.46 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 48 Y 10.66 4.43 0.00 3.38 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 49 F 8.85 3.85 0.00 3.10 3.38 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 50 N 7.98 5.05 0.00 2.86 3.11 0.00 0.00 6.75 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 51 L 8.44 4.97 0.00 1.76 1.76 0.97 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 8.52 4.28 0.00 1.97 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 1.58 1.16 0.00 53 L 8.43 4.98 0.00 1.63 1.35 0.90 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 54 N 9.18 4.97 0.00 2.81 2.72 0.00 0.00 7.22 7.51 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 55 E 8.14 4.04 0.00 2.14 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 2.23 0.00 56 A 7.59 4.64 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 57 E 9.17 4.89 0.00 2.14 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 0.00 2.07 2.22 0.00 58 E 9.34 4.65 0.00 2.30 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.22 0.00 59 F 9.58 5.01 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 60 V 8.51 4.54 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 0.93 0.00 0.00 0.49 0.00 0.00 61 A 9.83 3.87 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 62 G 8.53 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 63 V 8.06 4.47 2.34 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 1.09 0.00 0.00 0.98 0.00 0.00 64 S 8.61 3.78 0.00 3.37 3.54 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 65 H 9.10 4.66 0.00 3.18 3.25 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 66 G 8.35 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 67 T 8.06 4.96 4.25 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 1.32 0.00 0.00 68 L 8.13 4.83 0.00 1.50 1.54 0.94 0.96 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 69 G 8.61 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 0.00 0.00 0.00 0.00 70 E 9.23 4.72 0.00 1.98 1.81 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 2.38 2.29 0.00 71 I 8.72 4.71 1.75 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.14 0.81 0.00 0.00 72 F 8.96 5.11 0.00 2.81 3.03 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 73 I 8.77 4.51 1.91 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 1.09 1.10 0.98 0.00 0.00 74 R 8.65 4.46 0.00 1.92 1.92 0.00 3.62 0.00 0.00 3.45 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.62 0.00 75 S 8.78 4.21 0.00 3.61 3.86 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 76 N 7.84 3.79 0.00 2.77 2.94 0.00 0.00 6.92 8.00 0.00 0.00 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 N 8.37 4.67 0.00 2.99 2.96 0.00 0.00 6.55 7.80 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 78 V 8.43 4.30 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 0.82 0.00 0.00 1.08 0.00 0.00 79 L 9.53 4.37 0.00 1.52 1.45 0.95 0.90 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 80 Y 6.97 5.01 0.00 3.05 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 81 I 8.72 5.46 2.03 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.95 1.00 0.00 0.00 82 R 9.22 4.75 0.00 1.83 2.05 0.00 2.81 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.60 0.00 83 E 8.84 4.27 0.00 1.98 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 2.28 2.34 0.00 84 L 9.07 4.55 0.00 1.60 1.56 0.90 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.37 0.00 2.16 2.04 0.00 3.76 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 1.96 1.95 0.00