NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 K 4.2531 8.3144 120.1339 55.9438 33.5141 174.8286 32 S 4.0928 8.3874 116.1874 57.4301 63.0066 172.3336 33 C 4.2725 8.7162 128.8451 62.0307 31.6931 172.3480 34 C 4.8366 7.5511 112.2750 56.8549 32.1437 173.2005 35 S 4.8582 8.4725 113.1595 58.8047 63.0671 174.5560 36 C 5.1483 7.9537 120.6623 59.9157 33.6058 173.7084 37 C 4.7195 7.2598 115.9594 57.2067 30.1223 171.3082 38 P 4.1648 0.0000 0.0000 63.7366 30.0141 177.0544 39 V 4.2117 8.5725 112.6836 62.1338 34.9355 172.2269 40 G 4.5353 8.7717 109.8998 46.3846 0.0000 173.1017 41 C 4.1872 7.5466 120.0849 58.3676 31.5494 174.1032 42 A 3.5332 8.7445 131.0522 55.3347 17.7339 177.9349 43 K 4.4130 8.0149 112.9440 57.3456 32.0649 178.2812 44 C 4.6034 8.8125 115.9881 60.2708 30.0248 174.9340 45 A 4.2725 8.1635 126.0810 54.4316 18.8708 179.5864 46 Q 4.5396 8.4705 111.5287 55.1272 30.3946 172.8338 47 G 4.0577 6.2834 111.7097 44.8202 0.0000 177.4967 48 C 4.6296 8.5391 121.9032 58.7276 32.4590 171.4659 49 I 4.1785 8.0932 114.8997 60.2439 37.5633 175.8840 50 C 4.4609 7.8977 121.9031 58.5902 31.5744 172.9764 51 K 4.5453 8.4227 125.2308 56.3308 34.9477 177.4784 52 G 3.4830 8.2711 100.9524 49.1054 0.0000 174.8961 53 A 4.3636 5.8000 124.7302 51.1528 21.9220 177.7487 54 S 4.5592 8.8085 104.4958 59.6843 65.2695 175.6111 55 D 4.5607 7.9613 118.1561 54.8028 41.3896 176.0916 56 K 4.4214 7.6037 118.8996 55.4948 35.1907 173.7676 57 C 5.3101 8.3817 122.1767 57.2857 32.1693 175.1521 58 S 4.6001 8.4189 115.4486 59.4750 62.9827 173.9924 59 C 4.8526 8.1864 112.6197 58.9033 30.3004 174.2087 60 C 4.6560 7.8904 115.3551 59.9849 29.9576 173.6579 61 A 4.1672 8.3425 128.6080 52.8431 17.7908 178.3207 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 31 K 8.31 4.25 0.00 1.76 1.81 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.38 7.81 32 S 8.39 4.09 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 33 C 8.72 4.27 0.00 2.97 2.93 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 34 C 7.55 4.84 0.00 3.08 2.95 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 35 S 8.47 4.86 0.00 3.99 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 36 C 7.95 5.15 0.00 2.91 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 C 7.26 4.72 0.00 3.17 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 P 0.00 4.16 0.00 2.17 1.93 0.00 3.80 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 39 V 8.57 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 0.96 0.00 0.00 0.93 0.00 0.00 40 G 8.77 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.55 4.19 0.00 2.87 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.74 3.53 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.01 4.41 0.00 1.80 1.83 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.57 7.81 44 C 8.81 4.60 0.00 2.90 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.16 4.27 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 Q 8.47 4.54 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.13 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 47 G 6.28 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 C 8.54 4.63 0.00 2.90 2.80 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 49 I 8.09 4.18 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 1.18 0.80 0.91 0.00 0.00 50 C 7.90 4.46 0.00 2.95 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 51 K 8.42 4.55 0.00 1.85 1.86 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.28 1.33 7.81 52 G 8.27 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 5.80 4.36 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 S 8.81 4.56 0.00 3.96 4.06 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 0.00 0.00 0.00 0.00 55 D 7.96 4.56 0.00 2.65 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.60 4.42 0.00 1.78 1.58 0.00 1.71 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.41 7.81 57 C 8.38 5.31 0.00 3.07 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.42 4.60 0.00 3.95 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 C 8.19 4.85 0.00 3.05 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 C 7.89 4.66 0.00 2.92 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 8.34 4.17 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