NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 38 L 4.1212 8.1731 120.6299 55.6373 42.9894 176.7977 39 G 3.7959 9.6655 109.5924 43.4437 0.0000 171.3252 40 K 4.4068 8.3947 116.9521 57.3009 36.2756 174.3498 41 T 3.5109 8.7562 113.6255 62.1648 67.6297 172.4114 42 R 4.1604 7.8152 115.6033 57.3012 30.3318 176.1647 43 W 4.6876 8.5840 119.1409 55.5720 31.8135 175.4963 44 T 4.7959 8.1046 111.4090 60.0392 71.0009 174.4030 45 R 3.9902 8.6581 124.6818 59.3764 30.0956 178.9035 46 E 3.9580 8.2058 118.5827 59.4510 29.7365 178.4580 47 E 4.0904 8.2485 118.7952 59.1796 29.7073 178.1994 48 D 4.5403 8.6933 119.3046 57.4533 40.9148 178.3228 49 E 4.0007 8.6076 120.0109 59.1914 29.6949 178.5810 50 K 3.9123 8.2518 119.6065 59.4813 32.2446 178.3507 51 L 4.0498 8.5915 120.7916 58.0925 42.0478 178.4849 52 K 3.6550 8.4603 119.9558 59.5209 32.0375 178.2180 53 K 3.8558 8.2362 119.5926 59.6738 32.0518 178.5675 54 L 3.9279 7.9130 118.9765 57.7398 41.4990 179.7329 55 V 3.2125 7.9264 118.4123 66.0609 31.1392 178.0304 56 E 3.8844 7.8469 117.0094 59.0832 29.3095 178.9500 57 Q 4.0183 8.1354 119.3534 59.2619 29.3123 177.5683 58 N 4.5101 8.2000 116.3997 55.8614 39.2661 175.0352 59 G 4.0775 6.7527 104.4088 43.7908 0.0000 173.9088 60 T 3.6170 7.8454 117.4925 62.6782 68.7891 174.3076 61 D 4.6093 6.7455 130.9778 53.2556 39.9655 176.9920 62 D 4.2576 8.5665 118.4496 54.2450 41.2375 177.0078 63 W 4.3576 8.7139 126.6374 58.5220 29.1247 178.3265 64 K 3.9450 8.0039 120.2365 59.4463 31.5539 178.6424 65 V 3.3224 7.0579 116.0558 65.9550 31.7393 177.7618 66 I 3.6750 7.5091 118.7742 64.2571 37.0611 177.9240 67 A 4.0923 8.4416 122.0432 55.4737 17.9071 179.3594 68 N 4.2511 7.5250 113.5097 56.6583 38.6333 176.7688 69 Y 4.7572 7.4399 116.6617 58.7689 39.2762 175.8836 70 L 4.7192 7.6326 120.6178 51.2449 41.7934 173.8885 71 P 4.2635 0.0000 0.0000 63.7553 32.2928 175.6039 72 N 4.6954 8.8861 122.4658 54.2485 38.5941 174.7836 73 R 4.1382 7.2541 118.0134 55.1425 28.8794 176.8930 74 T 4.1548 8.0948 114.3473 60.9727 70.8619 174.4768 75 D 4.4675 8.6846 121.6229 56.9354 39.0211 178.9984 76 V 3.3951 7.6808 119.0253 65.7115 31.4938 177.8898 77 Q 4.0044 7.6371 116.6867 59.1157 28.3516 178.4931 78 C 4.1769 8.2332 117.1219 62.7657 28.4105 175.6399 79 Q 2.5200 7.3874 121.1932 58.9078 28.2944 178.0182 80 H 4.0538 7.9352 116.1412 58.3108 28.9116 176.2197 81 R 4.0089 7.5710 119.7023 56.0596 30.9814 176.1400 82 W 4.8437 7.4791 128.1160 58.4265 38.9200 175.5405 83 Q 4.5650 8.6396 119.1510 55.4416 28.1738 176.8812 84 K 4.4988 7.4333 115.0546 57.3597 38.7501 176.4511 85 V 4.2173 7.0919 110.9415 62.2301 35.5692 175.4184 86 L 3.6900 7.2000 119.5598 55.3458 41.8761 177.8973 87 N 4.4498 7.6244 119.3921 52.3727 39.8911 171.3931 88 P 4.5133 0.0000 0.0000 61.3168 30.1046 177.2025 89 E 4.1151 8.3133 124.9606 57.2986 29.3238 177.0842 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 38 L 8.17 4.12 0.00 1.66 1.68 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 39 G 9.67 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 0.00 0.00 0.00 40 K 8.39 4.41 0.00 1.86 1.77 0.00 1.75 0.00 0.00 1.77 0.00 0.00 2.90 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.39 7.81 41 T 8.76 3.51 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 42 R 7.82 4.16 0.00 2.02 2.05 0.00 3.04 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 43 W 8.58 4.69 0.00 3.22 3.37 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 44 T 8.10 4.80 4.27 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 1.24 0.00 0.00 45 R 8.66 3.99 0.00 1.99 2.03 0.00 3.29 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.82 0.00 46 E 8.21 3.96 0.00 2.06 1.98 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 2.41 2.40 0.00 47 E 8.25 4.09 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 2.59 0.00 48 D 8.69 4.54 0.00 3.03 2.81 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 0.00 0.00 0.00 0.00 49 E 8.61 4.00 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 50 K 8.25 3.91 0.00 2.03 2.08 0.00 1.74 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.51 7.81 51 L 8.59 4.05 0.00 2.18 2.01 1.22 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.46 3.65 0.00 2.18 2.12 0.00 1.81 0.00 0.00 2.02 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.86 1.96 7.81 53 K 8.24 3.86 0.00 1.88 1.98 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.48 7.81 54 L 7.91 3.93 0.00 1.93 1.80 1.09 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 55 V 7.93 3.21 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.65 0.00 0.00 56 E 7.85 3.88 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 57 Q 8.14 4.02 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 58 N 8.20 4.51 0.00 2.75 2.83 0.00 0.00 7.51 7.48 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 59 G 6.75 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 T 7.85 3.62 4.18 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 1.16 0.00 0.00 61 D 6.75 4.61 0.00 2.45 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 0.00 0.00 0.00 62 D 8.57 4.26 0.00 2.71 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.71 4.36 0.00 3.45 3.19 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 0.00 0.00 0.00 0.00 64 K 8.00 3.95 0.00 1.84 1.90 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.48 7.81 65 V 7.06 3.32 2.06 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 0.69 0.00 0.00 0.85 0.00 0.00 66 I 7.51 3.67 2.16 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.66 1.13 0.00 0.00 67 A 8.44 4.09 1.48 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 68 N 7.53 4.25 0.00 2.41 2.80 0.00 0.00 6.91 8.22 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 69 Y 7.44 4.76 0.00 3.12 2.92 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 70 L 7.63 4.72 0.00 1.80 1.63 1.20 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 71 P 0.00 4.26 0.00 2.02 2.00 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 72 N 8.89 4.70 0.00 2.78 2.86 0.00 0.00 7.04 7.61 0.00 0.00 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 R 7.25 4.14 0.00 1.97 2.01 0.00 2.24 0.00 0.00 2.82 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.31 0.00 74 T 8.09 4.15 4.25 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 1.26 0.00 0.00 75 D 8.68 4.47 0.00 3.04 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 7.68 3.40 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.89 0.00 0.00 77 Q 7.64 4.00 0.00 2.49 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.56 0.00 0.00 0.00 0.00 0.00 2.47 2.65 0.00 78 C 8.23 4.18 0.00 3.09 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 7.39 2.52 0.00 0.93 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 7.00 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 80 H 7.94 4.05 0.00 3.23 3.24 0.00 5.72 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 R 7.57 4.01 0.00 0.69 1.09 0.00 2.71 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.97 0.00 82 W 7.48 4.84 0.00 3.44 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 83 Q 8.64 4.56 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.67 0.00 0.00 0.00 0.00 0.00 2.76 2.89 0.00 84 K 7.43 4.50 0.00 1.66 1.67 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.23 1.19 7.81 85 V 7.09 4.22 1.91 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 0.66 0.00 0.00 0.76 0.00 0.00 86 L 7.20 3.69 0.00 0.48 0.17 0.84 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 87 N 7.62 4.45 0.00 2.40 2.49 0.00 0.00 7.02 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 P 0.00 4.51 0.00 2.28 2.14 0.00 3.70 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.31 0.00 89 E 8.31 4.12 0.00 1.96 1.90 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 2.54 2.22 0.00