NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.4372 8.3349 116.7949 58.3747 63.1233 171.8703 5 I 3.7976 7.9853 125.3187 60.2309 37.8256 174.3002 6 L 4.7576 8.1176 125.3730 53.3199 44.3479 176.8356 7 S 4.5202 8.9294 117.8852 57.4420 65.5593 175.1776 8 Q 3.8955 8.6405 122.8810 59.5345 28.4230 178.6732 9 A 4.1186 7.9014 119.6561 55.3036 18.7781 178.9745 10 E 4.0628 8.3463 117.2219 59.7441 29.7022 179.7119 11 I 3.7307 8.5482 120.3775 64.4677 37.2593 178.1555 12 D 4.4130 8.6387 119.7935 57.2541 40.3328 178.7383 13 A 4.2298 7.9559 120.9542 53.8366 18.3450 177.9722 14 L 4.8141 7.6314 114.2064 55.2477 41.3680 176.8808 15 L 4.5758 7.9403 117.0464 56.1784 45.7126 176.0218 16 N 4.5440 7.7261 118.3206 53.2974 38.6139 174.6976 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 4 S 8.33 4.44 0.00 3.88 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.99 3.80 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.58 0.91 0.00 0.00 6 L 8.12 4.76 0.00 1.60 1.58 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.93 4.52 0.00 4.03 3.98 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.64 3.90 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.43 2.62 0.00 9 A 7.90 4.12 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 10 E 8.35 4.06 0.00 2.24 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 11 I 8.55 3.73 2.08 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.13 0.91 0.00 0.00 12 D 8.64 4.41 0.00 2.84 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.96 4.23 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 14 L 7.63 4.81 0.00 1.75 1.70 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.94 4.58 0.00 1.77 1.67 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 16 N 7.73 4.54 0.00 2.82 2.71 0.00 0.00 6.92 7.44 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