NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2186 8.3149 119.9974 56.2954 33.8695 175.2256 2 K 3.9435 8.5381 121.2169 55.6256 32.1021 174.9084 3 A 4.7957 9.1870 127.3933 50.2039 22.9341 174.2250 4 L 4.7980 8.0195 119.0676 52.5240 44.6948 175.8842 5 L 4.1518 8.2936 119.2244 54.8744 41.9760 176.3826 6 A 4.2450 7.9702 124.4604 51.7961 21.8336 174.7934 7 L 4.3968 8.0279 121.1298 53.6260 42.3306 177.0573 8 A 4.0683 8.6022 128.9601 55.2920 18.5286 178.1245 9 L 4.0579 7.9599 119.2947 58.0959 41.7855 178.1621 10 H 4.0937 8.3581 115.2621 59.4644 28.7527 177.0016 11 H 4.2209 8.7568 118.2149 59.1203 28.5992 177.3455 12 L 3.9278 8.5052 121.7290 58.2220 41.8163 178.8462 13 A 4.1783 7.9055 118.7715 55.1365 18.4641 178.8147 14 H 4.2953 9.3960 117.5477 59.6006 30.0618 177.3676 15 L 3.8297 8.0727 120.9100 57.8778 41.4325 179.5339 16 A 4.0752 8.4356 121.2071 54.5177 18.3097 179.5504 17 L 3.8871 8.0802 119.3770 59.4326 39.8372 179.4169 18 H 4.2806 8.0483 116.0653 58.0302 28.9141 176.9524 19 L 4.1697 7.6670 122.0340 57.8031 40.5819 179.2354 20 A 3.9657 8.2973 120.9306 54.8875 17.7929 179.3439 21 L 4.1961 7.9529 115.7334 58.0280 41.6751 179.7860 22 A 4.3283 9.0457 119.4987 55.0733 18.2932 179.2296 23 L 4.1844 7.6690 116.2542 57.3968 42.1512 179.0437 24 K 4.2394 9.2331 118.7442 57.9717 32.2381 176.9445 25 K 4.0404 8.9526 121.4201 55.8759 32.1565 176.3286 26 A 4.2840 8.5148 128.4876 52.3483 18.9570 176.4436 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 K 8.31 4.22 0.00 1.88 1.89 0.00 1.54 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.47 7.81 2 K 8.54 3.94 0.00 1.85 1.81 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.50 7.81 3 A 9.19 4.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 8.02 4.80 0.00 1.63 1.62 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.29 4.15 0.00 1.63 1.60 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 6 A 7.97 4.25 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 7 L 8.03 4.40 0.00 1.70 1.59 0.90 1.17 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 8 A 8.60 4.07 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 9 L 7.96 4.06 0.00 1.77 1.69 0.95 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 10 H 8.36 4.09 0.00 3.25 3.41 0.00 5.73 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 H 8.76 4.22 0.00 3.34 3.46 0.00 5.62 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.51 3.93 0.00 1.79 1.66 0.93 1.12 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 13 A 7.91 4.18 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 14 H 9.40 4.30 0.00 3.24 3.50 0.00 5.80 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 L 8.07 3.83 0.00 1.86 1.66 0.84 0.89 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 16 A 8.44 4.08 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 17 L 8.08 3.89 0.00 1.91 2.12 0.95 0.85 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 18 H 8.05 4.28 0.00 3.44 3.61 0.00 5.68 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 19 L 7.67 4.17 0.00 1.56 1.69 0.88 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.30 3.97 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 21 L 7.95 4.20 0.00 1.79 1.76 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 22 A 9.05 4.33 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 23 L 7.67 4.18 0.00 1.88 1.72 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 24 K 9.23 4.24 0.00 1.82 1.83 0.00 1.81 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.58 7.81 25 K 8.95 4.04 0.00 1.80 1.74 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.38 7.81 26 A 8.51 4.28 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