NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4045 8.3344 115.4126 58.3769 64.4159 171.8425 2 S 4.5372 8.2009 114.1120 56.0247 63.9037 172.7696 3 D 4.5793 8.4301 126.6111 54.2187 43.4918 175.9880 4 P 4.2952 0.0000 0.0000 66.0169 31.4400 178.7111 5 L 3.9634 7.9217 118.2856 57.4702 41.5075 179.3937 6 V 3.6401 7.6623 117.8558 65.6754 31.5590 178.0125 7 V 3.6859 7.6271 117.4612 64.9756 31.1454 177.9233 8 A 4.0423 8.0724 120.7952 55.0562 18.6696 179.1217 9 A 3.9543 8.1859 119.5021 55.4846 18.3235 180.0158 10 S 4.0074 8.1658 113.3227 62.0341 63.0252 176.7741 11 I 3.6738 7.4705 122.4471 64.6433 36.7398 178.5083 12 I 3.6691 7.5148 120.1709 64.3673 37.0151 178.1554 13 A 4.0290 7.9157 121.4622 55.5020 18.0860 179.8156 14 I 3.7438 8.0456 118.2806 64.2595 37.2421 178.2346 15 L 4.2231 7.9926 118.8776 56.5622 41.3637 178.7903 16 H 4.1979 8.0410 118.4698 59.2226 30.3714 176.5575 17 L 4.1401 7.9868 122.1148 58.1765 41.6696 179.1028 18 I 3.8809 7.5465 120.0591 64.2143 36.8635 177.7809 19 L 4.4694 7.6525 115.0315 55.0964 41.3870 177.1671 20 W 4.6629 7.8461 128.0852 59.0704 32.1147 177.1997 21 I 3.6333 7.7873 114.7476 62.4569 37.4769 175.6245 22 L 4.4679 7.8511 118.4756 57.0009 43.5186 177.7438 23 D 4.5511 7.8363 114.6832 55.7595 41.3771 176.3889 24 R 4.3708 7.2305 118.8187 55.1964 30.4549 174.2028 25 L 4.0835 7.7667 123.9006 55.0355 42.0920 175.4961 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 S 8.33 4.40 0.00 3.99 3.99 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 2 S 8.20 4.54 0.00 3.91 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 3 D 8.43 4.58 0.00 2.80 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.30 0.00 2.26 2.30 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 5 L 7.92 3.96 0.00 1.71 1.76 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 6 V 7.66 3.64 2.22 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 1.03 0.00 0.00 0.93 0.00 0.00 7 V 7.63 3.69 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.98 0.00 0.00 8 A 8.07 4.04 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.19 3.95 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.17 4.01 0.00 3.91 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 11 I 7.47 3.67 2.04 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 1.53 1.12 0.92 0.00 0.00 12 I 7.51 3.67 2.15 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 1.71 0.86 0.92 0.00 0.00 13 A 7.92 4.03 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.05 3.74 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 1.53 0.84 0.93 0.00 0.00 15 L 7.99 4.22 0.00 2.00 1.72 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 16 H 8.04 4.20 0.00 3.27 3.44 0.00 5.78 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 17 L 7.99 4.14 0.00 1.77 1.84 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 18 I 7.55 3.88 2.10 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.51 0.95 0.00 0.00 19 L 7.65 4.47 0.00 1.89 1.77 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 20 W 7.85 4.66 0.00 3.32 3.42 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.79 3.63 2.07 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.92 1.05 0.00 0.00 22 L 7.85 4.47 0.00 1.96 1.63 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 23 D 7.84 4.55 0.00 2.85 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 R 7.23 4.37 0.00 1.28 1.09 0.00 3.17 0.00 0.00 2.83 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.38 0.00 25 L 7.77 4.08 0.00 1.75 1.44 0.88 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00