NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3887 8.0333 110.9470 61.5043 70.4345 174.7975 2 T 3.6580 8.4692 118.6928 66.2805 68.4758 174.8040 3 Y 4.1335 8.7061 122.7954 61.0702 38.8804 177.9318 4 A 4.0152 8.0408 121.0185 55.3298 18.3037 179.4157 5 D 4.3494 7.8425 116.2766 57.0407 41.0575 178.6472 6 F 4.4028 8.5244 121.7547 61.5494 39.3104 177.2192 7 I 3.0668 7.6578 118.1883 63.9022 36.9692 177.1014 8 A 4.1368 7.3732 120.8846 53.1152 18.8856 177.3796 9 S 4.3025 7.6585 112.3045 58.2704 63.3685 174.4394 10 G 3.8355 8.3424 108.4699 46.4419 0.0000 174.0327 11 R 4.6929 7.4942 118.0592 55.6635 30.6394 175.9019 12 T 3.9957 7.6491 106.7778 61.8484 70.3591 175.1880 13 G 3.9499 7.5721 110.6767 43.8864 0.0000 172.9392 14 R 3.9332 8.3933 118.4208 56.3885 30.2747 176.5872 15 R 4.4240 8.4516 122.2770 54.7999 30.9520 176.1779 16 N 4.6615 8.5122 120.3539 52.1878 39.7194 174.9686 17 A 4.2725 8.2168 123.1204 51.4769 19.2690 177.8074 18 I 3.8941 8.1297 114.5358 61.4142 38.0840 175.7936 19 H 4.9691 8.4002 115.2673 55.0662 30.3799 172.9379 20 D 4.2952 7.7399 124.7736 54.7771 41.8003 174.8607 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 T 8.03 4.39 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 2 T 8.47 3.66 4.30 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 1.24 0.00 0.00 3 Y 8.71 4.13 0.00 3.14 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 4 A 8.04 4.02 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.84 4.35 0.00 2.84 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 F 8.52 4.40 0.00 3.00 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 7 I 7.66 3.07 1.57 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 -0.13 0.74 0.00 0.00 8 A 7.37 4.14 1.25 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 0.00 0.00 0.00 9 S 7.66 4.30 0.00 3.88 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.34 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 0.00 0.00 0.00 11 R 7.49 4.69 0.00 1.81 1.92 0.00 3.20 0.00 0.00 3.30 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 12 T 7.65 4.00 3.95 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 0.34 0.00 0.00 13 G 7.57 3.95 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 0.00 0.00 0.00 14 R 8.39 3.93 0.00 1.82 1.91 0.00 3.21 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 15 R 8.45 4.42 0.00 1.82 1.90 0.00 3.24 0.00 0.00 3.31 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.86 0.00 16 N 8.51 4.66 0.00 2.73 2.77 0.00 0.00 7.14 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.22 4.27 1.25 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 0.00 0.00 0.00 18 I 8.13 3.89 1.85 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 1.47 0.64 0.90 0.00 0.00 19 H 8.40 4.97 0.00 3.19 3.37 0.00 5.49 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.74 4.30 0.00 2.53 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00