NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5523 8.1633 120.3272 54.9952 34.6093 176.7789 2 K 3.9412 8.3433 120.5679 57.1810 31.2225 177.9406 3 A 4.0569 10.0300 134.0757 55.3527 19.8896 179.6651 4 K 3.9229 7.8134 114.6300 59.8032 32.5756 177.7100 5 E 4.0670 8.1012 117.7700 59.4614 29.7508 178.5407 6 L 3.7180 7.2663 115.5791 56.6832 42.4486 177.4328 7 R 3.7350 8.6244 121.5561 57.3235 27.6809 175.2036 8 E 4.5196 7.4663 113.2215 54.9237 31.8454 171.2841 9 K 3.6884 8.0822 123.1347 56.0032 31.7383 175.7586 10 S 4.0174 8.1621 119.4497 61.7095 62.7028 176.6323 11 V 3.5331 7.6754 122.8761 65.9367 31.4890 177.5084 12 E 4.0242 8.2691 118.1504 59.0593 29.0313 178.7836 13 E 4.2624 8.0765 118.5142 58.8057 29.3979 178.7370 14 L 3.9948 7.9983 121.1168 58.4547 41.9564 178.6636 15 N 4.5725 7.6702 113.0866 55.2823 38.5335 176.9213 16 T 4.1739 8.1508 118.3542 65.6009 68.6191 176.3834 17 E 5.0805 7.9081 121.0428 58.0626 29.9620 178.2872 18 L 3.9630 8.0325 120.8439 58.0227 41.2546 178.9583 19 L 3.9554 7.4910 119.0948 57.9327 41.6540 178.6177 20 N 4.1617 7.8579 115.8863 57.2059 38.6569 176.8579 21 L 4.1914 7.9599 119.2784 56.6641 41.6157 176.2104 22 L 3.8425 7.9713 126.8084 56.3504 43.2076 176.4872 23 R 4.2925 9.0238 129.6753 57.7339 28.5606 178.6424 24 E 4.1092 7.4066 114.9710 58.3394 30.1840 177.5191 25 Q 4.3763 7.9340 117.1945 56.8322 32.9351 176.2970 26 F 4.4584 8.4330 119.2044 61.6221 39.2764 176.6493 27 N 3.9996 8.5901 116.2403 56.2232 38.3458 177.1255 28 L 4.2053 7.9428 119.6287 58.2137 41.4303 179.8849 29 R 4.0581 8.1550 117.1573 58.8185 29.6482 178.9988 30 M 4.0645 7.5542 118.0475 57.8250 32.5692 177.7632 31 Q 4.4307 9.0315 121.8840 58.7469 28.9871 178.4172 32 A 4.3757 8.0321 121.3891 54.4930 18.5287 178.8277 33 A 4.2636 7.3017 114.1672 52.9755 19.2690 177.8510 34 S 4.6304 7.7847 113.7321 57.8527 65.0582 175.2397 35 G 3.6908 7.7053 117.4294 45.1546 0.0000 175.9907 36 Q 2.8588 9.4556 124.7643 56.8551 27.8658 172.4494 37 L 3.5867 8.3460 119.6365 57.5523 41.1507 173.5348 38 Q 5.5571 7.9629 128.7454 58.3325 29.0565 174.5044 39 Q 4.4050 7.2273 118.9581 55.4578 27.8159 177.4235 40 S 4.2572 7.8159 115.6376 61.4219 63.8989 175.5621 41 H 4.3421 8.2221 118.1727 58.2102 27.9360 177.1288 42 L 3.9415 6.9320 121.5552 57.7413 41.7841 178.4592 43 L 4.1181 8.1771 119.8279 57.3958 41.5263 179.2042 44 K 3.9058 7.8795 119.1648 59.3746 32.2206 176.9509 45 Q 4.6165 7.7075 116.3924 56.0929 31.1790 174.9599 46 V 3.6211 9.0370 123.6941 64.5175 31.5297 174.1273 47 R 4.2658 7.2920 117.7420 59.6310 30.2721 180.0742 48 R 4.6087 7.6547 117.5153 56.1257 30.0016 176.7875 49 D 4.7618 7.9337 115.0423 54.7662 47.3800 178.3063 50 V 3.5786 8.9419 119.1640 65.5568 30.6449 177.8780 51 A 3.9540 7.9316 120.7979 54.9851 18.3160 179.3145 52 R 4.2089 7.9695 117.0040 58.7835 29.9891 179.1581 53 V 3.5579 7.7154 116.0617 66.1566 31.6210 178.0872 54 K 4.1356 8.1633 117.8593 59.2791 31.6173 179.6159 55 T 3.8261 9.0849 116.8364 66.1024 68.4217 175.0569 56 L 4.4478 8.0162 118.7684 55.2220 42.5486 176.4680 57 L 4.1455 9.2885 125.4516 56.6347 42.4393 176.0048 58 N 4.2256 7.5819 115.8152 56.6697 38.8041 176.7624 59 E 4.2693 8.2317 117.7138 58.9536 29.6842 178.5404 60 K 4.2483 7.5901 120.1632 57.8640 32.0625 174.9178 61 A 4.1370 8.1800 121.8037 54.6165 17.6063 177.4947 62 G 5.0050 8.0118 123.5436 48.0010 0.0000 170.9904 63 A 4.0965 7.4451 127.4041 52.8534 19.6685 175.7784 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 1 M 8.16 4.55 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.63 0.00 2 K 8.34 3.94 0.00 1.94 1.57 0.00 1.57 0.00 0.00 1.82 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.56 7.81 3 A 10.03 4.06 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 4 K 7.81 3.92 0.00 1.65 1.85 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.48 7.81 5 E 8.10 4.07 0.00 1.99 2.04 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 0.00 2.65 2.42 0.00 6 L 7.27 3.72 0.00 1.89 1.66 0.92 0.94 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 7 R 8.62 3.73 0.00 1.87 1.90 0.00 3.24 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 8 E 7.47 4.52 0.00 2.02 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.31 0.00 9 K 8.08 3.69 0.00 2.05 1.79 0.00 1.65 0.00 0.00 1.87 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.47 7.81 10 S 8.16 4.02 0.00 4.04 4.07 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 11 V 7.68 3.53 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 0.89 0.00 0.00 0.93 0.00 0.00 12 E 8.27 4.02 0.00 2.44 2.13 0.00 0.00 0.00 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 2.32 0.00 13 E 8.08 4.26 0.00 2.19 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 0.00 2.66 2.25 0.00 14 L 8.00 3.99 0.00 1.81 1.92 0.92 0.53 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 15 N 7.67 4.57 0.00 2.70 2.86 0.00 0.00 7.18 7.37 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 16 T 8.15 4.17 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 17 E 7.91 5.08 0.00 2.18 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 2.26 2.42 0.00 18 L 8.03 3.96 0.00 1.70 1.90 0.93 0.67 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 19 L 7.49 3.96 0.00 2.07 2.16 0.96 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 20 N 7.86 4.16 0.00 2.93 2.91 0.00 0.00 7.12 7.99 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 21 L 7.96 4.19 0.00 1.81 1.67 1.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.97 3.84 0.00 1.66 1.82 0.99 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 23 R 9.02 4.29 0.00 2.08 2.25 0.00 3.58 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.61 0.00 24 E 7.41 4.11 0.00 2.40 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 2.36 2.28 0.00 25 Q 7.93 4.38 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.91 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 26 F 8.43 4.46 0.00 3.06 3.08 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 27 N 8.59 4.00 0.00 2.85 2.77 0.00 0.00 7.12 6.76 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 28 L 7.94 4.21 0.00 1.86 1.73 0.90 1.03 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 29 R 8.16 4.06 0.00 2.20 2.07 0.00 3.16 0.00 0.00 3.36 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 30 M 7.55 4.06 0.00 1.78 1.94 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.12 0.00 31 Q 9.03 4.43 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 32 A 8.03 4.38 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.30 4.26 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.78 4.63 0.00 4.07 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 7.71 3.69 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 0.00 0.00 0.00 36 Q 9.46 2.86 0.00 2.35 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 5.77 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 37 L 8.35 3.59 0.00 1.71 1.65 1.01 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 7.96 5.56 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 7.71 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 39 Q 7.23 4.40 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.70 0.00 0.00 0.00 0.00 0.00 2.44 2.27 0.00 40 S 7.82 4.26 0.00 4.05 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 41 H 8.22 4.34 0.00 3.45 3.62 0.00 5.65 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 6.93 3.94 0.00 1.47 1.90 0.90 0.96 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 43 L 8.18 4.12 0.00 1.96 1.70 0.92 0.66 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 44 K 7.88 3.91 0.00 1.88 2.10 0.00 1.61 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.61 7.81 45 Q 7.71 4.62 0.00 2.25 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 5.73 0.00 0.00 0.00 0.00 0.00 2.42 2.59 0.00 46 V 9.04 3.62 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 1.02 0.00 0.00 1.05 0.00 0.00 47 R 7.29 4.27 0.00 2.06 1.95 0.00 3.18 0.00 0.00 3.10 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 48 R 7.65 4.61 0.00 1.85 1.92 0.00 3.25 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 49 D 7.93 4.76 0.00 2.84 2.60 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 50 V 8.94 3.58 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 1.01 0.00 0.00 0.97 0.00 0.00 51 A 7.93 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 52 R 7.97 4.21 0.00 1.97 2.03 0.00 3.42 0.00 0.00 3.23 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.59 0.00 53 V 7.72 3.56 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 0.83 0.00 0.00 1.04 0.00 0.00 54 K 8.16 4.14 0.00 2.13 1.84 0.00 1.72 0.00 0.00 1.64 0.00 0.00 3.10 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.54 7.81 55 T 9.08 3.83 4.40 0.00 0.00 0.00 0.00 0.00 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 56 L 8.02 4.45 0.00 1.75 1.64 0.95 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 57 L 9.29 4.15 0.00 1.95 1.79 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 58 N 7.58 4.23 0.00 3.18 2.91 0.00 0.00 7.04 7.53 0.00 0.00 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 E 8.23 4.27 0.00 2.13 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 0.00 2.31 2.63 0.00 60 K 7.59 4.25 0.00 1.76 2.05 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.57 1.60 7.81 61 A 8.18 4.14 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.01 5.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.45 4.10 1.18 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 0.00 0.00 0.00