NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 54 A 4.3107 8.2493 123.5821 52.3943 19.7555 178.6824 55 S 4.3311 8.8808 119.8994 60.1233 63.4000 173.0033 56 T 3.7777 8.0233 117.9200 65.4717 67.2794 176.5560 57 K 4.0569 7.9989 120.7566 58.9180 32.0421 178.8352 58 K 4.0280 8.1596 119.4126 59.1997 32.0240 179.2183 59 L 4.1610 7.8046 119.0784 57.5390 41.7151 179.3914 60 S 4.1521 8.1886 114.3514 61.4871 63.1019 176.3414 61 E 3.9858 7.9740 122.2444 59.1257 29.2163 179.0646 62 C 4.0917 7.6368 117.3949 62.5924 31.7740 175.7061 63 L 4.0436 7.9106 120.5946 57.2831 41.0786 179.3615 64 K 3.8981 8.4125 120.2428 59.5577 32.1192 178.9423 65 R 3.9038 7.7725 117.6240 59.4926 30.0105 179.0779 66 I 3.7778 7.7179 119.3164 64.2858 37.0828 178.7827 67 G 3.5881 8.1599 106.4337 47.9269 0.0000 175.5709 68 D 4.3195 8.2606 121.8408 56.8239 40.8453 178.0442 69 E 4.0838 8.7411 120.3076 59.6692 29.5413 178.8989 70 L 3.9645 8.3217 120.3103 58.0638 42.0396 178.4442 71 D 4.2783 8.5168 118.4616 57.3631 41.0801 178.0686 72 S 4.0628 8.8812 114.7968 61.3243 62.3446 175.7213 73 N 4.2822 8.1822 119.7097 56.9182 38.6721 176.8668 74 M 4.0368 7.9998 119.9942 58.5944 32.2357 178.2986 75 E 3.8972 8.4111 119.0281 59.6140 29.3728 179.5930 76 L 3.9439 7.5200 118.9581 58.3416 42.4097 178.8889 77 Q 4.1159 7.9433 116.0714 58.1874 28.8127 178.4229 78 R 4.1183 8.1910 120.4791 59.3307 30.1889 177.8805 79 M 4.2207 7.6109 115.7898 56.9884 32.1335 176.4986 80 I 4.1812 7.6890 118.1014 61.0812 37.9539 174.7565 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 54 A 8.25 4.31 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.88 4.33 0.00 4.14 4.10 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 56 T 8.02 3.78 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 57 K 8.00 4.06 0.00 1.86 1.79 0.00 1.76 0.00 0.00 1.82 0.00 0.00 3.13 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.63 1.53 7.81 58 K 8.16 4.03 0.00 1.98 1.83 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.47 7.81 59 L 7.80 4.16 0.00 1.69 1.70 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.19 4.15 0.00 4.06 4.12 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.97 3.99 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 62 C 7.64 4.09 0.00 3.22 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.91 4.04 0.00 1.75 1.70 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.41 3.90 0.00 2.09 1.88 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.49 7.81 65 R 7.77 3.90 0.00 2.07 1.96 0.00 3.19 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.04 0.00 66 I 7.72 3.78 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 1.45 0.72 0.91 0.00 0.00 67 G 8.16 3.59 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 0.00 0.00 0.00 68 D 8.26 4.32 0.00 2.83 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 69 E 8.74 4.08 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 70 L 8.32 3.96 0.00 1.80 1.89 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 71 D 8.52 4.28 0.00 2.93 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.88 4.06 0.00 3.96 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 73 N 8.18 4.28 0.00 2.89 2.96 0.00 0.00 7.22 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 M 8.00 4.04 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.72 0.00 75 E 8.41 3.90 0.00 2.24 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 76 L 7.52 3.94 0.00 1.65 1.89 0.92 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 77 Q 7.94 4.12 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.72 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 78 R 8.19 4.12 0.00 2.05 1.90 0.00 3.11 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 79 M 7.61 4.22 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.56 0.00 80 I 7.69 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 1.16 0.58 0.98 0.00 0.00