NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 S 4.4838 8.1933 116.7948 58.2526 64.3176 174.0336 23 S 4.0254 8.5198 116.4046 60.6907 62.8088 174.8051 24 D 4.4405 8.7522 121.9075 56.8983 41.7326 176.0966 25 P 4.3771 0.0000 0.0000 65.4753 31.2821 178.6150 26 L 4.0162 7.9983 118.0888 57.6962 41.4427 179.6443 27 V 3.5863 7.4478 117.1132 65.9225 31.4354 178.3020 28 V 3.5761 7.7649 117.3579 65.9084 31.3353 177.6562 29 A 3.9926 8.1229 120.3635 55.1602 18.1604 179.5162 30 A 3.9674 8.0734 119.3188 55.2907 18.5453 180.0903 31 S 4.0973 7.9595 113.4787 61.7677 62.8794 176.9104 32 I 3.7477 7.7897 122.5637 64.4063 36.8418 178.5346 33 I 3.8196 7.6653 120.9594 64.3252 36.9845 178.6422 34 G 3.6872 7.9508 106.1630 47.8946 0.0000 175.8368 35 I 3.7575 7.7069 121.6383 64.1179 37.2453 178.4870 36 L 4.0240 7.9201 119.8879 58.0667 41.4714 179.0703 37 H 4.2973 8.3766 118.1269 59.3403 29.8148 177.3600 38 L 4.0173 7.9241 120.6931 57.7068 41.4379 179.4304 39 I 3.7531 8.0206 119.6080 64.3730 37.1086 178.1615 40 A 4.0438 7.9764 121.1999 54.9749 18.2497 179.3775 41 W 4.0981 8.1544 126.2533 60.8143 30.7852 178.1036 42 I 3.5502 8.2170 119.6859 64.3679 36.3290 178.1622 43 L 3.9364 7.8352 119.9932 58.2205 41.9611 178.4714 44 D 4.4122 7.8759 117.9981 57.4099 40.8075 178.6859 45 R 3.7799 7.3846 117.6211 58.6837 30.0172 177.0568 46 L 4.1778 7.5601 123.8422 55.2974 42.2468 176.2619 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 22 S 8.19 4.48 0.00 3.90 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.52 4.03 0.00 3.92 3.93 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.75 4.44 0.00 2.71 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.38 0.00 2.19 2.08 0.00 3.65 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 2.11 2.18 0.00 26 L 8.00 4.02 0.00 1.70 1.71 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.45 3.59 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 0.99 0.00 0.00 0.97 0.00 0.00 28 V 7.76 3.58 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.93 0.00 0.00 29 A 8.12 3.99 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 30 A 8.07 3.97 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 31 S 7.96 4.10 0.00 4.01 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 32 I 7.79 3.75 2.02 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 0.81 0.92 0.00 0.00 33 I 7.67 3.82 2.00 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 1.46 0.93 0.92 0.00 0.00 34 G 7.95 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 7.71 3.76 2.01 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 1.68 0.98 0.93 0.00 0.00 36 L 7.92 4.02 0.00 1.89 1.75 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 37 H 8.38 4.30 0.00 3.21 3.41 0.00 5.61 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.92 4.02 0.00 1.93 1.72 0.91 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 39 I 8.02 3.75 2.08 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.05 0.95 0.00 0.00 40 A 7.98 4.04 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 W 8.15 4.10 0.00 3.39 3.39 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 42 I 8.22 3.55 2.10 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.92 0.93 0.00 0.00 43 L 7.84 3.94 0.00 1.73 1.89 0.91 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 44 D 7.88 4.41 0.00 2.67 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.38 3.78 0.00 1.47 1.63 0.00 2.98 0.00 0.00 2.78 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.50 0.00 46 L 7.56 4.18 0.00 1.68 1.65 0.89 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00