NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.6479 8.3444 119.6996 56.7479 31.3324 175.4706 2 T 4.3726 7.7345 118.5134 58.6986 71.8140 176.0510 3 N 4.2319 9.8235 122.1998 55.1418 37.1867 175.5828 4 W 4.4495 7.7003 121.2827 60.1173 29.1135 178.0013 5 Q 4.0995 7.9695 117.6453 59.0324 28.0878 179.0307 6 K 4.0281 8.0617 120.0851 59.2297 32.2994 178.4069 7 L 4.1222 8.2426 121.1656 58.2691 41.9702 178.9186 8 E 4.1303 8.1381 118.3136 59.2872 29.4996 179.4132 9 V 3.6449 7.7280 118.5141 65.8965 31.5780 177.7905 10 F 4.2585 9.0669 120.9513 61.0596 39.2602 176.5532 11 W 3.7498 8.8825 128.0376 60.6414 30.4694 177.7755 12 A 4.0611 8.2028 120.4557 54.8364 17.7804 179.3990 13 K 3.8630 7.9732 118.0349 59.9970 32.2924 178.5434 14 H 3.9680 8.0879 118.3842 59.5016 29.8751 177.0359 15 M 3.9327 8.2429 120.9289 58.2540 31.7532 178.6450 16 W 4.4044 9.0722 128.8226 60.4437 30.8744 177.6035 17 N 4.7529 8.2448 118.6330 55.9098 38.2682 176.7036 18 F 4.0772 8.1887 122.2717 61.3712 39.4706 177.2865 19 I 3.4975 7.7330 119.4530 64.1306 36.9227 178.5992 20 S 4.0014 8.4856 115.7148 61.1420 62.7743 176.8640 21 G 3.5061 7.9568 109.2827 47.6348 0.0000 175.7597 22 I 3.5759 7.1731 122.3361 63.9110 36.5313 178.3587 23 Q 3.8506 8.0744 120.5024 59.1485 28.9167 177.6710 24 Y 4.0227 8.3106 120.8828 60.8667 38.7062 178.0808 25 L 3.7204 8.2636 118.5647 57.3511 41.7057 178.8763 26 A 4.1446 8.0942 120.7671 55.2274 18.4035 179.5508 27 G 3.6385 7.4766 101.3289 45.6115 0.0000 173.7456 28 L 4.5318 7.1805 121.5417 53.8411 41.8199 174.1340 29 S 4.6502 7.4067 114.1219 57.0913 65.2574 173.5363 30 T 4.1781 8.1033 116.6201 63.7920 68.9582 174.0544 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 Q 8.34 4.65 0.00 2.09 2.18 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 2.34 2.56 0.00 2 T 7.73 4.37 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 1.15 0.00 0.00 3 N 9.82 4.23 0.00 2.70 2.83 0.00 0.00 5.68 8.44 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 4 W 7.70 4.45 0.00 3.38 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 5 Q 7.97 4.10 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.82 0.00 0.00 0.00 0.00 0.00 2.48 2.58 0.00 6 K 8.06 4.03 0.00 1.82 1.90 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.53 7.81 7 L 8.24 4.12 0.00 1.92 2.04 1.10 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.14 4.13 0.00 2.25 2.02 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 2.22 2.29 0.00 9 V 7.73 3.64 2.35 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 1.05 0.00 0.00 1.06 0.00 0.00 10 F 9.07 4.26 0.00 3.20 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 11 W 8.88 3.75 0.00 3.68 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 12 A 8.20 4.06 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 13 K 7.97 3.86 0.00 1.99 1.98 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.65 7.81 14 H 8.09 3.97 0.00 2.79 2.89 0.00 5.67 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 15 M 8.24 3.93 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.00 0.00 16 W 9.07 4.40 0.00 3.51 3.11 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 17 N 8.24 4.75 0.00 3.07 2.88 0.00 0.00 6.55 7.77 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 18 F 8.19 4.08 0.00 3.15 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 19 I 7.73 3.50 1.55 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.54 0.08 0.00 0.00 20 S 8.49 4.00 0.00 3.87 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 21 G 7.96 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 22 I 7.17 3.58 1.70 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.14 0.75 0.00 0.00 23 Q 8.07 3.85 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.72 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 24 Y 8.31 4.02 0.00 3.05 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 25 L 8.26 3.72 0.00 1.75 1.63 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.09 4.14 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 27 G 7.48 3.64 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 0.00 0.00 0.00 28 L 7.18 4.53 0.00 1.15 1.01 0.68 0.78 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 29 S 7.41 4.65 0.00 3.93 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 30 T 8.10 4.18 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 1.19 0.00 0.00