NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.7427 8.1827 119.4083 57.2755 40.5948 175.5632 2 V 3.6026 8.5196 125.2133 64.0394 31.4607 176.3832 3 N 4.3896 9.1189 117.8567 56.3484 37.5708 176.7099 4 Q 4.0943 8.1989 120.1131 58.5867 28.7633 177.9115 5 Y 4.1871 8.1538 120.2987 60.7080 38.6850 177.9465 6 L 4.0243 8.3859 120.1616 57.6578 41.7295 178.9128 7 C 4.2206 8.3033 118.9800 62.4234 31.6012 175.6346 8 G 3.7448 8.1644 107.2597 48.0846 0.0000 175.4311 9 S 3.9148 7.5779 117.2352 61.8576 62.9047 176.8058 10 H 4.1995 7.8715 118.4865 58.5681 28.3721 177.8831 11 L 3.9385 7.8506 120.9173 57.9973 41.4059 180.0580 12 V 3.4714 7.4223 111.9415 64.1985 30.8714 178.5629 13 E 3.9599 7.7884 117.0394 59.1892 29.2742 179.1562 14 A 4.0229 7.9837 120.9524 54.8905 18.3671 179.6479 15 L 3.6384 8.2633 117.9173 57.8259 41.6787 178.8092 16 Y 4.2554 7.9561 119.6371 61.0580 38.4663 178.5547 17 L 3.9650 7.4219 117.4759 57.5129 41.8094 179.3876 18 V 3.6813 7.4433 117.2178 66.3818 31.9679 177.7962 19 C 4.2993 8.4238 116.5007 59.5192 27.9656 175.8005 20 G 3.7239 8.0334 107.2077 46.8354 0.0000 176.6535 21 E 4.2273 8.8781 124.2168 57.6330 29.5181 177.6296 22 R 3.9774 7.8660 117.8208 56.6770 30.5350 177.7653 23 G 3.8988 8.6933 105.0743 45.5422 0.0000 171.8979 24 F 4.8359 7.5785 111.0799 56.4181 39.9572 172.8135 25 F 4.5685 9.0056 119.9968 55.7943 40.6938 174.9326 26 Y 4.8671 8.7752 125.5439 56.0287 40.0765 174.8784 27 T 4.2221 7.9377 117.5045 58.8803 69.7506 171.5308 28 P 3.8685 0.0000 0.0000 63.6261 31.8439 176.2624 29 K 4.4561 7.7640 127.2783 55.5196 33.9735 176.4984 30 T 4.1541 8.3625 113.2624 61.5934 68.8070 174.0611 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 F 8.18 4.74 0.00 3.16 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 2 V 8.52 3.60 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 1.15 0.00 0.00 0.93 0.00 0.00 3 N 9.12 4.39 0.00 2.99 3.12 0.00 0.00 6.28 7.23 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 4 Q 8.20 4.09 0.00 2.29 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.95 0.00 0.00 0.00 0.00 0.00 2.51 2.44 0.00 5 Y 8.15 4.19 0.00 3.25 3.19 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 0.00 0.00 0.00 0.00 6 L 8.39 4.02 0.00 1.80 1.76 0.99 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.30 4.22 0.00 3.09 3.15 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 8 G 8.16 3.74 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 0.00 0.00 0.00 9 S 7.58 3.91 0.00 3.93 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.87 4.20 0.00 3.28 3.32 0.00 5.62 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 11 L 7.85 3.94 0.00 1.78 1.65 0.99 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.42 3.47 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 0.10 0.00 0.00 0.84 0.00 0.00 13 E 7.79 3.96 0.00 2.01 1.96 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 2.23 2.45 0.00 14 A 7.98 4.02 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 15 L 8.26 3.64 0.00 0.72 0.45 0.69 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.96 4.26 0.00 3.27 3.19 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 0.00 0.00 0.00 0.00 17 L 7.42 3.97 0.00 1.64 1.68 0.93 1.00 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 18 V 7.44 3.68 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 0.80 0.00 0.00 0.98 0.00 0.00 19 C 8.42 4.30 0.00 3.18 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 20 G 8.03 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.88 4.23 0.00 1.96 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 2.29 2.30 0.00 22 R 7.87 3.98 0.00 1.88 2.02 0.00 3.24 0.00 0.00 3.49 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 23 G 8.69 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 24 F 7.58 4.84 0.00 3.22 3.02 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 25 F 9.01 4.57 0.00 3.07 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 26 Y 8.78 4.87 0.00 3.19 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 27 T 7.94 4.22 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 1.23 0.00 0.00 28 P 0.00 3.87 0.00 2.05 2.10 0.00 3.47 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 29 K 7.76 4.46 0.00 1.84 1.84 0.00 1.56 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.39 7.81 30 T 8.36 4.15 4.21 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 1.17 0.00 0.00