NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9725 8.2127 109.7420 45.0679 0.0000 174.0942 2 I 3.3758 8.1593 117.7798 63.1119 37.4765 172.5441 3 V 3.5444 8.4340 120.1332 66.0729 31.5205 177.3456 4 E 4.0541 8.0784 117.8341 59.3841 29.1617 179.1617 5 Q 3.9199 8.1597 117.5397 58.1246 28.9520 176.8339 6 C 5.2642 8.4400 115.8870 56.1140 41.8136 174.2659 7 C 4.3020 8.3662 117.8483 60.6340 29.0981 175.1277 8 T 4.2158 7.3848 109.0856 63.1859 69.1337 174.9850 9 S 4.6857 7.5509 114.9282 55.9556 66.1905 172.9896 10 I 4.0133 8.2438 121.9594 61.1255 38.4661 175.6799 11 C 5.1305 8.4445 123.9039 54.9290 42.2344 174.8400 12 S 4.5383 8.9113 119.8026 58.0078 64.8186 175.4754 13 L 3.9368 8.4618 122.3485 58.1800 41.0835 179.4612 14 Y 3.8940 7.9489 115.6260 60.9890 38.2138 177.9360 15 Q 4.2115 8.4260 119.2204 58.9683 28.7772 178.6580 16 L 4.3134 8.3926 120.3526 57.7719 41.6312 179.0729 17 E 3.9610 8.1964 119.2936 59.2032 29.2381 178.4837 18 N 4.3914 7.9871 115.3839 55.5433 38.5842 175.7249 19 Y 4.4295 7.8991 116.5938 57.4410 38.6002 175.5436 20 C 4.4525 7.2992 118.1280 59.5152 29.0756 173.4918 21 N 4.5445 8.5439 117.7970 53.7097 38.2881 175.4137 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 3.97 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 0.00 0.00 0.00 2 I 8.16 3.38 1.38 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.39 0.73 0.00 0.00 3 V 8.43 3.54 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 1.00 0.00 0.00 0.89 0.00 0.00 4 E 8.08 4.05 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 5 Q 8.16 3.92 0.00 2.24 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.77 0.00 0.00 0.00 0.00 0.00 2.62 2.66 0.00 6 C 8.44 5.26 0.00 2.91 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 7 C 8.37 4.30 0.00 3.10 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 7.38 4.22 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 1.22 0.00 0.00 9 S 7.55 4.69 0.00 3.97 3.94 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 4.01 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 1.43 0.71 0.93 0.00 0.00 11 C 8.44 5.13 0.00 2.99 3.04 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 0.00 0.00 0.00 0.00 12 S 8.91 4.54 0.00 4.20 4.07 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 13 L 8.46 3.94 0.00 1.50 1.56 0.87 0.78 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 14 Y 7.95 3.89 0.00 2.97 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 15 Q 8.43 4.21 0.00 2.34 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.83 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 16 L 8.39 4.31 0.00 1.88 1.77 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.20 3.96 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 18 N 7.99 4.39 0.00 2.62 2.61 0.00 0.00 6.99 7.41 0.00 0.00 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 7.90 4.43 0.00 3.04 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 20 C 7.30 4.45 0.00 2.99 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 21 N 8.54 4.54 0.00 2.72 2.73 0.00 0.00 6.82 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00