NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 52 D 4.5764 8.3649 120.1972 54.5061 42.6400 175.3696 53 T 4.3707 7.9697 119.1877 59.9812 70.3458 173.0647 54 W 4.4899 8.9489 135.0000 60.0138 31.7919 177.1725 55 T 3.7704 7.9628 113.2171 64.8904 66.8917 176.1815 56 G 3.5140 7.6890 106.5966 47.5523 0.0000 175.8203 57 V 3.5623 7.6614 120.2941 65.7405 31.5730 177.5978 58 E 3.5322 7.5697 117.9424 59.4364 28.9303 179.2215 59 A 3.9535 7.8321 120.4226 55.1522 18.3899 179.7510 60 L 3.9404 7.7956 117.4306 57.9629 41.8114 179.7554 61 I 3.8558 7.5229 112.7512 63.6627 37.3950 178.4903 62 R 3.9687 7.9978 120.4448 59.1331 29.8465 178.9463 63 I 3.7500 7.5055 119.3885 64.3380 37.1683 178.4585 64 L 4.0222 7.8262 119.6725 57.7857 41.4358 179.5966 65 Q 4.1545 8.1749 117.5517 59.0959 28.5503 178.5722 66 Q 4.1894 8.0170 120.2496 59.0228 28.8200 178.6646 67 L 4.0102 8.1120 119.7716 57.4511 41.5315 179.8018 68 L 3.6559 7.5406 117.7985 57.6104 41.6683 178.9550 69 F 4.4586 8.2125 117.7489 60.9958 38.9270 177.8185 70 I 3.7390 8.1117 119.1219 64.8242 37.0069 177.9140 71 H 4.0274 8.0984 118.8826 59.3461 29.7140 177.3285 72 F 4.4931 8.0632 119.5766 60.4578 38.4696 178.0522 73 R 4.0096 8.2403 117.8112 59.4276 29.8791 179.2364 74 I 3.9383 7.9307 119.7346 64.3565 37.2252 178.8287 75 G 3.5975 8.0377 106.3020 47.5541 0.0000 175.3994 76 C 4.3286 7.8785 120.3895 62.3383 31.7181 175.0418 77 R 4.3319 7.3708 112.7366 57.6085 29.1033 175.6389 78 H 4.6550 7.7479 116.4127 56.8004 32.2841 173.7245 79 S 4.5790 8.1910 115.1302 58.4035 64.9331 173.8466 80 R 3.8071 8.4418 121.2865 56.8450 25.7343 175.1541 81 I 4.1229 6.8847 118.9721 62.0559 39.0911 177.5004 82 G 4.0616 7.0880 111.1675 44.8628 0.0000 171.1834 83 I 3.1509 7.7854 124.0049 62.5002 34.6576 174.4478 84 I 4.7969 7.3301 124.0706 57.7254 37.8345 174.7373 85 Q 4.5777 7.6377 120.2807 57.4938 36.0474 176.4603 86 Q 4.0404 7.8216 120.6539 56.9076 29.7364 174.7278 87 R 4.3710 7.5946 117.5510 54.7161 30.1416 175.4921 88 R 4.4059 7.9844 124.7090 56.5154 32.0798 176.3545 89 T 4.3176 7.6983 111.8130 63.5911 69.2941 174.9437 90 R 4.2259 7.5557 121.2167 55.1491 31.0031 174.7148 91 N 4.5992 8.4763 122.9757 54.8438 38.9440 173.2739 92 G 4.1035 7.8129 118.7727 45.3147 0.0000 173.9394 93 A 4.3017 7.8496 122.1477 50.6191 20.5280 178.1108 94 S 4.0951 8.5208 113.8436 60.5347 62.6270 174.4576 95 K 4.4840 7.6392 124.9214 55.0131 33.6954 175.6955 96 S 4.2048 8.4581 120.1418 58.4584 62.6698 173.3930 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 52 D 8.36 4.58 0.00 2.67 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.97 4.37 4.28 0.00 0.00 0.00 0.00 0.00 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 54 W 8.95 4.49 0.00 3.60 3.06 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 T 7.96 3.77 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 1.19 0.00 0.00 56 G 7.69 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.66 3.56 2.16 0.00 0.00 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 0.00 0.00 1.15 0.00 0.00 58 E 7.57 3.53 0.00 1.74 1.61 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 0.00 1.52 1.47 0.00 59 A 7.83 3.95 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 60 L 7.80 3.94 0.00 1.88 1.71 0.92 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 61 I 7.52 3.86 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.67 0.92 0.00 0.00 62 R 8.00 3.97 0.00 1.87 2.01 0.00 3.08 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.81 0.00 63 I 7.51 3.75 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.05 0.91 0.00 0.00 64 L 7.83 4.02 0.00 1.71 1.70 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 8.17 4.15 0.00 2.40 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.07 0.00 0.00 0.00 0.00 0.00 2.44 2.77 0.00 66 Q 8.02 4.19 0.00 2.36 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 67 L 8.11 4.01 0.00 1.68 1.70 0.91 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 68 L 7.54 3.66 0.00 1.91 1.54 0.86 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 69 F 8.21 4.46 0.00 3.40 3.05 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 0.00 0.00 0.00 70 I 8.11 3.74 2.13 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.01 0.92 0.00 0.00 71 H 8.10 4.03 0.00 3.26 3.15 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 F 8.06 4.49 0.00 3.31 2.99 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 4.01 0.00 2.09 2.03 0.00 3.29 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 1.74 1.96 0.00 74 I 7.93 3.94 1.85 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 1.62 1.12 0.89 0.00 0.00 75 G 8.04 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 76 C 7.88 4.33 0.00 3.26 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 77 R 7.37 4.33 0.00 2.07 2.03 0.00 3.10 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 1.90 1.71 0.00 78 H 7.75 4.66 0.00 3.32 3.22 0.00 5.74 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.19 4.58 0.00 4.05 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 R 8.44 3.81 0.00 2.04 2.11 0.00 3.16 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 81 I 6.88 4.12 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.61 0.91 0.00 0.00 82 G 7.09 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 83 I 7.79 3.15 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 0.73 0.91 0.00 0.00 84 I 7.33 4.80 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.88 0.90 0.00 0.00 85 Q 7.64 4.58 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.03 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 86 Q 7.82 4.04 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.04 0.00 0.00 0.00 0.00 0.00 2.40 2.28 0.00 87 R 7.59 4.37 0.00 1.98 1.78 0.00 3.41 0.00 0.00 3.29 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.54 0.00 88 R 7.98 4.41 0.00 1.82 1.82 0.00 3.20 0.00 0.00 3.14 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 89 T 7.70 4.32 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 1.25 0.00 0.00 90 R 7.56 4.23 0.00 1.88 2.05 0.00 3.42 0.00 0.00 3.09 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 91 N 8.48 4.60 0.00 2.70 2.72 0.00 0.00 7.27 7.98 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 92 G 7.81 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 0.00 0.00 0.00 93 A 7.85 4.30 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 94 S 8.52 4.10 0.00 3.87 3.86 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 95 K 7.64 4.48 0.00 1.69 1.64 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.36 7.81 96 S 8.46 4.20 0.00 3.80 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00