NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9835 8.3549 109.7475 45.6777 0.0000 173.5944 2 I 3.6929 7.1158 121.7553 62.7779 37.3782 173.8813 3 V 3.5910 8.5669 121.1998 65.0628 32.9392 175.8384 4 E 4.7134 7.4702 119.5495 54.6329 29.1759 174.2567 5 Q 4.5778 7.5493 123.4870 56.7192 34.5783 174.7427 6 C 5.3951 7.9129 114.3269 57.9878 41.3582 175.7939 7 C 3.9716 7.4954 113.7535 62.0755 27.8053 174.6107 8 T 4.3043 7.6597 108.1989 62.3555 69.6768 175.0677 9 S 4.2661 7.8743 114.6428 57.2001 65.6706 173.4884 10 I 3.5484 8.6894 127.0959 61.2848 36.6839 176.4239 11 C 4.4177 8.5689 122.6224 56.8207 35.8120 174.4390 12 S 4.4687 8.1723 115.9143 57.8699 63.8990 175.3420 13 L 3.9728 8.1535 124.0023 57.7610 41.5483 179.1154 14 Y 4.2369 7.5733 116.3272 61.1867 37.5997 178.1676 15 Q 4.0447 8.2050 118.4996 59.0158 28.5348 178.5150 16 L 4.4650 8.0260 118.7768 56.8337 41.8298 178.7739 17 E 4.2049 8.1778 118.8287 58.2800 29.7745 177.5532 18 N 4.6383 7.7124 114.9510 52.9737 37.2593 175.1761 19 Y 4.6233 7.4020 114.4220 58.5065 39.5024 175.9245 20 C 4.5139 7.4262 116.8892 58.4667 29.3280 173.1990 21 N 4.4841 8.6521 119.1706 54.1250 38.4836 174.7160 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 8.35 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 0.00 0.00 0.00 2 I 7.12 3.69 1.65 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.15 0.76 0.00 0.00 3 V 8.57 3.59 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 1.06 0.00 0.00 0.89 0.00 0.00 4 E 7.47 4.71 0.00 1.98 1.92 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 2.23 2.27 0.00 5 Q 7.55 4.58 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 7.17 0.00 0.00 0.00 0.00 0.00 2.18 2.27 0.00 6 C 7.91 5.40 0.00 3.13 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 7.50 3.97 0.00 3.22 2.99 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 0.00 0.00 0.00 8 T 7.66 4.30 4.25 0.00 0.00 0.00 0.00 0.00 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 7.87 4.27 0.00 3.97 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 10 I 8.69 3.55 1.88 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 0.41 0.91 0.00 0.00 11 C 8.57 4.42 0.00 3.01 3.10 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 0.00 0.00 0.00 12 S 8.17 4.47 0.00 4.09 3.85 0.00 0.00 0.00 0.00 0.00 0.00 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 8.15 3.97 0.00 1.36 1.31 0.83 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.57 4.24 0.00 3.07 2.99 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 0.00 0.00 0.00 15 Q 8.21 4.04 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.97 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 16 L 8.03 4.46 0.00 1.85 1.77 0.99 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.18 4.20 0.00 2.34 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.21 0.00 18 N 7.71 4.64 0.00 2.62 2.81 0.00 0.00 6.73 7.05 0.00 0.00 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 7.40 4.62 0.00 3.28 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 7.43 4.51 0.00 3.14 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.65 4.48 0.00 2.70 2.72 0.00 0.00 6.88 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