NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 K 4.2350 8.3031 120.1339 56.1572 33.4667 174.6546 21 G 3.7043 8.3109 108.7742 45.0890 0.0000 171.8819 22 S 4.4488 8.3321 115.5838 57.4051 64.7188 173.0603 23 V 3.7831 8.1118 122.4624 62.6754 31.9386 175.5327 24 V 4.3609 8.0591 125.8971 60.8158 33.7952 174.8452 25 I 3.9940 8.3465 127.7897 61.3854 37.0134 176.0993 26 V 4.2098 7.9885 117.9242 60.5717 32.5163 175.3541 27 G 4.0024 7.4599 107.2674 45.9059 0.0000 172.3634 28 R 4.6744 8.2444 113.8837 54.8671 32.0765 174.2776 29 I 4.4700 8.1342 119.0203 59.4989 40.0411 175.0716 30 V 4.3215 8.4189 124.9526 61.1724 32.8886 175.0860 31 L 4.4118 8.4414 126.6961 55.8988 42.4365 177.4843 32 S 4.4127 8.0568 111.0861 58.5427 63.3295 174.3583 33 G 3.8247 7.7858 110.6124 45.3151 0.0000 173.3465 34 K 4.6611 8.1586 121.2893 53.0782 35.2109 174.2658 35 P 4.2237 0.0000 0.0000 63.4716 31.7241 175.8843 36 A 4.6320 8.0571 123.1418 50.4657 22.1652 175.8187 37 I 3.9932 8.2345 122.2897 60.3157 37.3445 176.3492 38 I 3.7501 8.3377 127.5575 60.4966 37.2934 174.5804 39 P 4.4404 0.0000 0.0000 62.6718 31.8987 175.8581 40 K 4.8624 8.1720 118.6159 55.2792 35.2799 176.2567 41 K 4.1721 8.4135 117.5536 57.2327 33.0105 176.0442 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 20 K 8.30 4.23 0.00 1.76 1.86 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.45 7.81 21 G 8.31 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.33 4.45 0.00 3.87 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.11 3.78 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 0.76 0.00 0.00 0.93 0.00 0.00 24 V 8.06 4.36 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 0.90 0.00 0.00 0.98 0.00 0.00 25 I 8.35 3.99 1.87 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 0.65 0.96 0.00 0.00 26 V 7.99 4.21 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 0.77 0.00 0.00 0.93 0.00 0.00 27 G 7.46 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.24 4.67 0.00 1.87 1.86 0.00 2.98 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.65 0.00 29 I 8.13 4.47 1.87 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 1.30 0.67 0.91 0.00 0.00 30 V 8.42 4.32 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 0.83 0.00 0.00 0.93 0.00 0.00 31 L 8.44 4.41 0.00 1.67 1.70 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 32 S 8.06 4.41 0.00 3.98 3.97 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 33 G 7.79 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.16 4.66 0.00 1.72 1.70 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.17 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.36 7.81 35 P 0.00 4.22 0.00 2.03 2.02 0.00 3.64 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 36 A 8.06 4.63 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 I 8.23 3.99 1.87 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 0.58 0.91 0.00 0.00 38 I 8.34 3.75 1.87 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 0.46 0.91 0.00 0.00 39 P 0.00 4.44 0.00 2.17 2.06 0.00 3.70 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 40 K 8.17 4.86 0.00 1.83 1.84 0.00 1.51 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.28 1.41 7.81 41 K 8.41 4.17 0.00 1.68 1.68 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.46 7.81