NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8874 8.2127 109.7351 45.7670 0.0000 173.0861 2 I 3.7182 7.8217 116.4296 61.6825 38.6727 172.4289 3 V 3.2824 7.9134 118.0421 65.4372 31.7257 175.9999 4 E 4.3727 7.9074 117.4358 57.7845 30.6092 177.3867 5 Q 3.9594 7.6087 118.9321 58.9590 28.9346 176.9762 6 C 4.4355 8.6871 117.0473 58.8490 40.4506 174.8943 7 C 4.2287 7.8217 119.1888 62.1376 31.6921 175.1635 8 T 4.1583 7.9936 116.0191 64.6929 68.2693 174.0857 9 S 4.7773 7.3889 114.8142 56.6526 67.0074 173.0593 10 I 4.4343 8.0086 121.5009 60.5464 38.4099 176.3551 11 C 5.1724 8.3322 119.0529 55.3694 44.6236 173.9124 12 S 4.9056 8.4169 117.4791 56.6807 64.9420 175.2193 13 L 3.8334 8.4229 123.1610 58.7278 41.6774 178.2236 14 Y 4.0039 8.1450 117.7687 61.3118 38.7523 177.7335 15 Q 4.2466 8.5001 118.2382 59.1339 28.9619 179.0889 16 L 4.2114 8.0502 119.1910 58.1689 41.5976 179.0438 17 E 4.1464 8.7569 118.0006 58.8849 29.4397 177.5524 18 N 4.6393 7.7371 114.8383 53.0955 39.2234 174.5354 19 Y 4.9286 8.0427 117.9927 56.7791 39.0115 174.1811 20 C 4.6819 7.6584 116.2088 59.1819 34.7163 172.8336 21 N 4.5627 8.7322 119.6725 53.3978 38.3999 175.1831 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 G 8.21 3.89 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 0.00 0.00 0.00 2 I 7.82 3.72 1.15 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.33 0.63 0.00 0.00 3 V 7.91 3.28 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.87 0.00 0.00 4 E 7.91 4.37 0.00 2.03 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 2.27 2.32 0.00 5 Q 7.61 3.96 0.00 2.50 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 6 C 8.69 4.44 0.00 2.98 3.09 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 0.00 0.00 0.00 7 C 7.82 4.23 0.00 3.02 2.96 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 8 T 7.99 4.16 4.40 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 9 S 7.39 4.78 0.00 3.99 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 10 I 8.01 4.43 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.53 0.93 0.00 0.00 11 C 8.33 5.17 0.00 2.95 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 12 S 8.42 4.91 0.00 4.03 4.02 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 13 L 8.42 3.83 0.00 1.79 1.73 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.14 4.00 0.00 3.09 2.93 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 0.00 15 Q 8.50 4.25 0.00 2.41 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.57 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 16 L 8.05 4.21 0.00 1.91 1.80 1.02 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.76 4.15 0.00 1.95 1.91 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 2.25 2.32 0.00 18 N 7.74 4.64 0.00 2.52 1.94 0.00 0.00 6.58 8.16 0.00 0.00 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 Y 8.04 4.93 0.00 3.03 2.87 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 0.00 0.00 0.00 20 C 7.66 4.68 0.00 2.92 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.73 4.56 0.00 2.72 2.69 0.00 0.00 6.79 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00