NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 S 4.4497 8.1933 115.4128 58.1548 65.5777 173.1725 23 V 3.4531 7.3065 116.9359 61.3606 32.4062 175.0038 24 G 3.9426 10.3210 112.3287 45.8363 0.0000 172.2134 25 E 5.1402 7.6766 116.0402 54.8691 33.9195 174.7095 26 M 4.6901 8.7436 116.6946 55.4403 34.4769 174.8652 27 S 3.8657 9.2180 115.4808 61.1459 60.4601 172.2807 28 G 4.1747 8.1768 100.8880 46.3045 0.0000 173.2115 29 R 4.6686 7.6962 116.2421 53.5998 33.6800 174.9601 30 S 4.5632 8.5627 116.0760 58.3411 63.1586 173.2233 31 V 4.6592 8.1414 126.3517 61.4460 33.4715 174.7341 32 S 4.7155 8.2895 119.1995 57.2245 65.8439 173.2965 33 Q 4.3509 8.5540 122.1022 55.4010 29.9110 174.8781 34 Q 4.5394 8.1681 123.5501 54.2038 32.2053 174.7721 35 T 4.0540 8.4467 121.7549 63.4224 69.1002 174.5685 36 S 4.2653 8.5160 123.0345 58.3712 63.7599 174.5599 37 D 4.7559 8.3574 124.6613 52.2430 42.3425 177.1274 38 Q 3.9705 8.5109 118.9758 59.6451 28.8272 177.4759 39 Y 4.1083 8.1277 119.8175 60.5077 38.9066 177.6374 40 A 3.7267 8.9462 122.1463 55.2138 18.3122 179.3362 41 N 4.2320 7.9257 113.7909 56.3978 38.7221 176.9223 42 N 4.3956 8.1019 118.4833 56.5057 39.1293 176.8128 43 L 3.7615 7.8001 121.7748 57.9563 41.8488 178.7242 44 A 4.1215 7.9436 120.1206 54.2602 18.2412 178.2543 45 G 3.8933 7.2787 104.2315 45.0373 0.0000 173.6806 46 R 3.8412 7.6485 120.5607 56.8483 30.2552 175.8573 47 T 4.7527 8.2512 113.7327 59.6790 71.9854 172.5963 48 E 4.6247 8.3621 121.8952 53.8915 32.5078 175.3564 49 S 4.2260 8.6488 120.7787 57.7552 63.6144 172.4465 50 P 4.4734 0.0000 0.0000 62.5387 31.9100 175.2170 51 Q 4.6245 8.1655 120.4136 53.8549 31.0793 175.5204 52 G 3.8386 8.3890 112.5712 44.9996 0.0000 173.3525 53 S 4.3868 8.2536 114.4726 58.7794 63.6033 174.1240 54 S 4.6271 8.1326 111.8899 59.1061 67.8359 176.6864 55 L 3.9797 8.1654 122.9253 58.0517 42.0133 177.8001 56 A 4.1215 8.0664 120.1545 54.4916 18.7483 177.7097 57 S 4.8009 7.3210 109.9227 57.3309 63.1367 174.1428 58 R 4.5725 7.3111 116.6977 55.6053 34.2146 175.8837 59 I 3.9072 8.2663 121.4366 61.4466 36.4757 175.4384 60 I 4.5161 8.0910 126.3927 59.4154 38.9828 175.4934 61 E 4.6691 8.2800 122.9184 54.3797 33.4471 174.9854 62 R 4.0752 8.4985 122.4703 55.4264 30.4620 176.1909 63 L 3.9335 8.6532 125.3005 55.7754 41.9406 177.5349 64 S 4.4287 8.6876 117.9771 59.8739 63.8451 173.7574 65 S 4.6054 7.6288 113.2283 57.0835 65.6109 172.9380 66 V 4.2901 7.9776 119.7101 60.3801 33.0869 175.5567 67 A 4.2360 8.4252 128.2066 52.3124 20.0594 178.2372 68 H 4.1025 8.6174 119.6088 59.5766 29.6832 177.4996 69 S 4.3617 8.1148 115.0557 60.8191 62.7523 176.1872 70 V 3.8823 7.7423 122.0233 65.5838 31.5110 177.6317 71 I 3.8321 7.5691 119.0961 64.3458 36.9238 178.3800 72 G 3.6807 7.7010 104.9272 47.8893 0.0000 175.0283 73 F 4.1969 7.8669 122.5568 61.3632 39.2727 176.7913 74 I 3.6617 8.5622 119.3367 64.9070 36.7732 178.3795 75 Q 4.0483 8.6631 119.3218 58.3930 28.6377 178.7668 76 R 4.0158 7.8552 120.0054 58.7611 30.2858 177.3092 77 M 4.3397 7.0674 114.3708 54.7170 32.6424 175.9706 78 F 4.7645 7.9732 124.1448 57.7436 39.9692 174.6585 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 22 S 8.19 4.45 0.00 4.02 4.09 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 0.00 0.00 0.00 0.00 23 V 7.31 3.45 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 0.67 0.00 0.00 0.93 0.00 0.00 24 G 10.32 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 E 7.68 5.14 0.00 2.10 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.23 0.00 26 M 8.74 4.69 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 27 S 9.22 3.87 0.00 4.01 3.95 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 28 G 8.18 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.70 4.67 0.00 2.00 1.78 0.00 3.21 0.00 0.00 3.10 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 30 S 8.56 4.56 0.00 3.88 3.76 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 31 V 8.14 4.66 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 0.85 0.00 0.00 0.97 0.00 0.00 32 S 8.29 4.72 0.00 3.86 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 Q 8.55 4.35 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 34 Q 8.17 4.54 0.00 1.99 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.70 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 35 T 8.45 4.05 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 1.22 0.00 0.00 36 S 8.52 4.27 0.00 3.86 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.36 4.76 0.00 2.99 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 38 Q 8.51 3.97 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.95 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 39 Y 8.13 4.11 0.00 3.11 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.95 3.73 1.34 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 0.00 0.00 0.00 41 N 7.93 4.23 0.00 2.83 2.87 0.00 0.00 7.05 7.28 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 42 N 8.10 4.40 0.00 2.89 2.71 0.00 0.00 6.82 6.63 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 43 L 7.80 3.76 0.00 1.13 1.23 0.85 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 44 A 7.94 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 45 G 7.28 3.89 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 0.00 0.00 0.00 46 R 7.65 3.84 0.00 1.83 1.87 0.00 3.19 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 47 T 8.25 4.75 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 1.24 0.00 0.00 48 E 8.36 4.62 0.00 1.88 1.80 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 2.18 2.27 0.00 49 S 8.65 4.23 0.00 4.02 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 50 P 0.00 4.47 0.00 2.06 2.03 0.00 3.64 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 2.02 2.06 0.00 51 Q 8.17 4.62 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.04 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 52 G 8.39 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.25 4.39 0.00 3.99 3.89 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 54 S 8.13 4.63 0.00 3.98 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 55 L 8.17 3.98 0.00 1.61 1.74 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.07 4.12 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 57 S 7.32 4.80 0.00 4.03 3.94 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.31 4.57 0.00 1.92 1.81 0.00 3.30 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.72 0.00 59 I 8.27 3.91 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 0.47 0.93 0.00 0.00 60 I 8.09 4.52 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 1.42 0.78 0.91 0.00 0.00 61 E 8.28 4.67 0.00 1.89 1.78 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 2.20 2.28 0.00 62 R 8.50 4.08 0.00 1.77 1.85 0.00 3.27 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 63 L 8.65 3.93 0.00 1.68 1.65 0.94 0.96 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 64 S 8.69 4.43 0.00 3.98 3.99 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 65 S 7.63 4.61 0.00 3.95 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.98 4.29 2.10 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 0.89 0.00 0.00 0.95 0.00 0.00 67 A 8.43 4.24 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 0.00 0.00 0.00 0.00 0.00 0.00 68 H 8.62 4.10 0.00 3.23 3.29 0.00 5.68 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.11 4.36 0.00 4.08 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 70 V 7.74 3.88 2.28 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 1.20 0.00 0.00 0.97 0.00 0.00 71 I 7.57 3.83 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.64 0.92 0.00 0.00 72 G 7.70 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.87 4.20 0.00 3.22 3.29 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 74 I 8.56 3.66 2.20 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.89 1.12 0.00 0.00 75 Q 8.66 4.05 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.98 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 76 R 7.86 4.02 0.00 1.98 1.88 0.00 3.20 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 77 M 7.07 4.34 0.00 1.37 0.96 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 78 F 7.97 4.76 0.00 3.02 2.71 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