NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 41 G 3.9695 8.3393 109.7363 45.3672 0.0000 174.4355 42 C 4.5439 7.5446 112.9870 53.2848 29.0294 171.2214 43 P 4.3037 0.0000 0.0000 63.8075 31.7295 177.8408 44 A 4.4781 8.1292 124.9477 51.4726 21.8793 175.4810 45 E 4.4586 8.7297 124.1679 55.6084 30.1816 174.6842 46 Q 3.5813 8.1842 120.4980 54.8411 29.4553 171.6996 47 R 4.7336 7.7522 118.3253 54.9821 33.9440 174.5497 48 A 4.5301 7.8689 116.9368 52.3519 20.4814 176.8202 49 S 4.6465 7.6046 115.8451 58.4253 64.6451 174.1274 50 P 4.3384 0.0000 0.0000 66.2244 31.1661 178.5749 51 L 3.9842 8.0509 118.4020 57.9501 41.3430 179.5437 52 T 3.9296 7.6060 114.1813 66.4895 68.2785 176.8229 53 S 4.1481 8.2415 118.9509 61.1272 62.9753 176.3806 54 I 3.6953 7.8006 121.8335 64.7520 36.8642 178.4412 55 I 3.7406 7.7689 120.5240 64.3065 36.5109 178.6144 56 S 4.1000 8.3507 115.1750 61.3622 62.6609 176.4465 57 A 3.9597 8.5500 124.7516 54.8134 18.1137 179.5514 58 V 3.5133 7.7517 116.8023 66.2190 31.5168 178.3210 59 V 3.6571 7.8239 117.8568 65.9541 31.3843 178.1988 60 G 3.6003 7.9666 105.2282 48.0753 0.0000 175.8074 61 I 3.7958 8.1286 123.0111 63.5773 37.0008 178.4597 62 L 3.9295 8.0679 121.7033 58.0600 41.9943 178.7460 63 L 3.9637 8.0586 120.3908 57.9469 41.9649 179.0258 64 V 3.4872 7.7577 118.2731 65.9345 31.5582 177.8667 65 V 3.5740 7.6392 117.7695 66.3180 31.3849 178.0202 66 V 3.6088 7.7258 117.6291 65.9213 31.1517 177.7432 67 L 4.0167 7.9096 120.0362 58.1037 41.9306 179.0196 68 G 3.7449 8.1648 105.7007 47.8883 0.0000 175.5942 69 V 3.6046 7.8384 120.7725 65.6554 31.5816 178.1713 70 V 3.5663 7.7257 117.6974 65.9901 31.3681 177.3655 71 F 4.3645 8.6279 120.7988 61.5433 39.1995 176.9375 72 G 3.7061 8.3853 105.1268 48.2565 0.0000 175.4165 73 I 3.7152 7.8094 122.7718 63.6636 37.0254 178.4160 74 L 3.9338 8.3863 120.0048 58.1479 41.5464 179.7303 75 I 3.5165 7.8120 119.7535 64.0622 36.6626 178.8712 76 K 3.8849 7.6355 118.6992 59.5131 32.0278 179.3009 77 R 4.0490 7.9014 116.9976 59.4605 30.1180 179.2343 78 R 3.9348 8.1253 116.6720 57.2811 30.2714 178.0281 79 Q 3.2125 7.8214 117.1119 55.1661 28.4997 172.4752 80 Q 3.9511 8.3942 118.4273 57.1451 29.2184 175.4689 81 K 3.7457 8.4003 121.5530 56.6941 28.8066 175.5290 82 I 4.5031 7.2232 125.3977 57.7591 37.0625 177.0788 83 R 4.6961 6.9204 111.7819 55.6947 30.4765 175.6004 84 K 4.1666 8.0844 124.9724 57.4384 33.1792 176.3408 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 41 G 8.34 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 0.00 0.00 0.00 42 C 7.54 4.54 0.00 3.11 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 43 P 0.00 4.30 0.00 2.20 2.15 0.00 3.86 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 44 A 8.13 4.48 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.73 4.46 0.00 1.92 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 0.00 2.20 2.20 0.00 46 Q 8.18 3.58 0.00 2.21 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.79 6.53 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 47 R 7.75 4.73 0.00 1.78 1.80 0.00 3.47 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 48 A 7.87 4.53 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.60 4.65 0.00 3.89 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.34 0.00 2.26 2.30 0.00 3.71 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 2.07 2.05 0.00 51 L 8.05 3.98 0.00 1.70 1.78 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.61 3.93 4.34 0.00 0.00 0.00 0.00 0.00 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 53 S 8.24 4.15 0.00 4.03 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 54 I 7.80 3.70 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 1.64 1.02 0.91 0.00 0.00 55 I 7.77 3.74 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 1.58 0.80 0.91 0.00 0.00 56 S 8.35 4.10 0.00 4.03 4.26 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 0.00 0.00 0.00 57 A 8.55 3.96 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.75 3.51 2.22 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 1.14 0.00 0.00 0.96 0.00 0.00 59 V 7.82 3.66 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.99 0.00 0.00 60 G 7.97 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.13 3.80 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 1.40 1.11 0.91 0.00 0.00 62 L 8.07 3.93 0.00 1.91 1.84 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.06 3.96 0.00 1.97 1.64 0.92 0.77 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 64 V 7.76 3.49 2.22 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 0.88 0.00 0.00 0.95 0.00 0.00 65 V 7.64 3.57 2.09 0.00 0.00 0.00 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 0.97 0.00 0.00 66 V 7.73 3.61 2.22 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 0.94 0.00 0.00 0.97 0.00 0.00 67 L 7.91 4.02 0.00 1.97 1.72 0.83 1.02 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 68 G 8.16 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.84 3.60 2.24 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 0.95 0.00 0.00 0.98 0.00 0.00 70 V 7.73 3.57 2.27 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 0.84 0.00 0.00 1.00 0.00 0.00 71 F 8.63 4.36 0.00 3.19 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.39 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.81 3.72 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.81 0.90 0.00 0.00 74 L 8.39 3.93 0.00 1.83 1.67 1.02 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.81 3.52 1.58 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 -0.14 0.74 0.00 0.00 76 K 7.64 3.88 0.00 1.87 1.83 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.43 7.81 77 R 7.90 4.05 0.00 1.85 1.97 0.00 3.32 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 78 R 8.13 3.93 0.00 1.79 1.96 0.00 3.42 0.00 0.00 3.19 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 79 Q 7.82 3.21 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.85 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 80 Q 8.39 3.95 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.54 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 81 K 8.40 3.75 0.00 1.93 1.83 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.43 7.81 82 I 7.22 4.50 1.87 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.58 0.91 0.00 0.00 83 R 6.92 4.70 0.00 1.86 1.89 0.00 2.98 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.49 0.00 84 K 8.08 4.17 0.00 1.70 1.67 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.35 7.81