NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3329 8.1233 123.5811 51.1420 20.6400 178.1676 3 K 3.5968 8.2896 116.6944 59.2582 32.3169 176.0722 4 A 4.1990 8.3255 121.2376 53.0499 19.9235 178.6575 5 A 3.9521 8.2474 119.0681 54.8483 18.4466 179.4735 6 A 3.9031 8.0917 118.6893 55.5955 18.1686 179.5352 7 A 3.9435 7.9812 116.8083 55.1015 18.5848 179.3648 8 A 4.0796 7.8787 118.7013 55.5035 18.7156 180.0159 9 I 3.7296 8.0259 118.6287 64.2206 36.5974 178.7519 10 K 4.3047 8.2711 118.8623 58.7908 31.7074 179.0789 11 A 3.9289 7.8976 121.4296 55.0336 18.5035 179.2253 12 I 3.5243 7.6251 116.2821 64.1285 38.0685 178.2358 13 A 4.0826 8.5383 121.5979 54.7636 17.6027 179.4487 14 A 4.0166 7.4835 116.4755 55.2380 18.5595 179.9199 15 I 3.7961 8.0986 118.6578 64.2994 37.0784 178.4824 16 I 3.9075 8.3601 121.2093 64.6250 36.7825 178.3540 17 K 4.0125 7.7424 118.2917 59.1023 31.9679 178.3685 18 A 4.3249 7.5614 119.9426 54.7815 18.7654 179.5109 19 G 3.5498 8.4475 103.5272 46.8192 0.0000 174.9355 20 G 3.8118 8.6361 107.8221 45.7763 0.0000 173.3901 21 F 4.3508 8.5974 121.9954 57.6017 38.8805 175.7905 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 A 8.12 4.33 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 3 K 8.29 3.60 0.00 1.83 1.91 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.49 7.81 4 A 8.33 4.20 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 5 A 8.25 3.95 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 6 A 8.09 3.90 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 7 A 7.98 3.94 1.30 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 8 A 7.88 4.08 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 9 I 8.03 3.73 1.89 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 1.61 0.73 0.88 0.00 0.00 10 K 8.27 4.30 0.00 1.93 1.85 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.52 7.81 11 A 7.90 3.93 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 12 I 7.63 3.52 1.81 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.17 0.88 0.00 0.00 13 A 8.54 4.08 1.28 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 0.00 0.00 0.00 14 A 7.48 4.02 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.10 3.80 2.01 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.63 1.06 0.00 0.00 16 I 8.36 3.91 2.03 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.33 0.90 0.00 0.00 17 K 7.74 4.01 0.00 1.70 2.05 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.53 7.81 18 A 7.56 4.32 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.45 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.64 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 21 F 8.60 4.35 0.00 2.89 2.97 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 0.00 0.00 0.00