NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.5639 8.1133 119.7251 56.0429 32.6113 177.1703 2 R 3.9073 8.1743 117.3826 58.9812 29.6838 177.2304 3 K 4.0120 8.8366 119.3303 59.0989 32.5047 179.0539 4 W 4.1776 8.1210 118.8644 59.8886 29.0436 178.5562 5 Q 4.0350 8.6507 118.4622 58.5629 27.8953 178.5275 6 K 3.9496 8.5326 121.4353 59.8161 32.3117 179.0019 7 T 4.0616 7.8022 110.0503 64.7064 68.8761 176.9497 8 G 3.6709 8.6713 109.0981 47.8845 0.0000 175.3965 9 H 4.3805 8.6390 118.4141 58.0982 28.8141 177.8173 10 A 4.0431 7.7062 123.0126 55.0432 18.2331 179.8044 11 V 3.5716 7.9058 116.7947 66.2600 31.5977 178.5203 12 R 3.9453 8.2611 117.7524 59.0410 29.8512 178.7449 13 A 4.0099 8.5350 121.0330 55.3966 18.3775 179.7420 14 I 3.7618 7.7701 117.9399 64.4752 36.9366 178.8656 15 G 3.6661 7.7677 105.4791 47.9811 0.0000 175.6674 16 R 4.1225 7.9939 119.5264 58.9374 30.1901 178.8602 17 L 4.1737 8.0825 117.9190 56.2103 42.5587 177.3319 18 S 4.7612 7.8838 113.0363 57.1103 62.3153 173.2013 19 S 4.7308 7.6958 114.5273 57.0609 65.3380 174.4400 20 S 4.2573 8.3281 114.5318 58.5198 62.4284 173.6297 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 R 8.11 4.56 0.00 1.95 2.13 0.00 3.13 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 2 R 8.17 3.91 0.00 1.93 2.03 0.00 3.32 0.00 0.00 3.61 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 3 K 8.84 4.01 0.00 1.65 1.68 0.00 1.58 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.50 7.81 4 W 8.12 4.18 0.00 3.55 3.16 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 0.00 0.00 0.00 0.00 5 Q 8.65 4.03 0.00 2.16 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.63 0.00 6 K 8.53 3.95 0.00 1.90 2.00 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.47 7.81 7 T 7.80 4.06 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 8 G 8.67 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.64 4.38 0.00 3.35 3.35 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 7.71 4.04 1.40 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 0.00 0.00 0.00 11 V 7.91 3.57 2.28 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 1.05 0.00 0.00 1.00 0.00 0.00 12 R 8.26 3.95 0.00 2.11 2.01 0.00 3.21 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.89 0.00 13 A 8.53 4.01 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 14 I 7.77 3.76 2.04 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 1.46 0.78 0.92 0.00 0.00 15 G 7.77 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 R 7.99 4.12 0.00 1.95 2.01 0.00 3.18 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 17 L 8.08 4.17 0.00 1.77 1.73 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 18 S 7.88 4.76 0.00 3.81 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 S 7.70 4.73 0.00 4.01 3.84 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.33 4.26 0.00 3.80 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00