NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.2840 8.2229 123.5825 51.7693 20.5503 177.2945 1 N 4.8126 8.3371 112.0455 51.0198 38.6048 175.6318 2 Q 4.3854 8.1506 121.1031 56.4436 30.3827 175.4077 3 A 4.7337 8.6321 126.1886 51.1736 20.9195 176.1522 4 S 5.1121 9.0060 117.3231 56.2986 67.0617 173.4734 5 V 4.1720 8.4527 121.8147 62.8613 32.3462 174.9470 6 V 4.8747 8.7345 127.6623 60.5477 34.9288 174.3608 7 A 4.4549 8.7526 129.5907 52.4760 18.5957 177.6638 8 N 4.6011 9.3330 122.6521 55.4179 39.6658 174.2763 9 Q 4.6293 7.6277 114.3303 54.8209 31.9625 173.7808 10 L 4.2563 8.4836 121.9846 55.3604 43.0686 175.8716 11 I 4.4608 8.6686 127.2973 58.8079 39.1424 173.6901 12 P 4.6265 0.0000 0.0000 62.0601 32.0994 176.2987 13 I 3.6166 8.3544 122.4223 62.0205 38.6284 175.1525 14 N 4.3270 8.5012 124.3631 55.1804 36.8748 174.2671 15 T 4.7810 7.5356 112.3468 61.3822 72.3238 174.1939 16 A 4.6274 8.5343 127.1582 51.7294 19.4298 177.2586 17 L 4.2059 9.1178 123.1304 54.7064 42.9337 176.2142 18 A 4.9701 8.4389 124.5036 49.7840 22.0304 177.1876 19 L 3.9721 8.7052 119.8562 57.8571 41.9257 180.4182 20 V 3.7283 7.7070 116.6930 64.4151 31.6371 176.9350 21 M 4.2142 8.1497 119.7163 56.6645 32.2187 175.1965 22 M 5.2513 7.9374 118.8763 53.3668 34.5327 175.3996 23 R 4.8214 8.9435 120.3659 54.3633 33.0932 174.7974 24 S 5.3319 8.3559 113.3848 57.0064 65.8747 172.7288 25 E 4.6352 8.9304 120.6060 55.2519 33.6310 174.3708 26 V 4.5812 8.3291 124.5460 61.9696 31.6123 175.3103 27 V 4.6151 8.2257 120.0239 59.6835 35.4201 175.4597 28 T 4.6139 8.0972 117.0115 60.9686 71.6789 172.7417 29 P 4.4574 0.0000 0.0000 62.1792 32.1748 176.1490 30 V 3.8510 8.1999 119.4306 62.9320 32.8702 176.0239 31 G 4.2810 8.3769 114.5036 45.7949 0.0000 173.6348 32 I 4.0223 8.6752 125.9379 60.5059 38.1935 174.1262 33 P 4.7095 0.0000 0.0000 62.8783 31.8628 177.3277 34 A 3.9930 8.9281 124.8260 55.2074 18.0239 179.7008 35 E 4.1400 8.1140 114.3173 58.6598 30.1757 177.7593 36 D 4.7264 8.2211 119.5027 54.6018 40.7643 177.8216 37 I 3.7001 7.4851 122.0618 64.1038 37.3068 175.7892 38 P 4.4158 0.0000 0.0000 65.9848 30.9475 178.8110 39 R 3.9854 7.9346 114.7615 59.2321 30.3686 178.7244 40 L 4.1741 8.1969 118.3597 55.9663 41.6521 177.5654 41 V 3.9179 6.9361 119.4225 64.2016 31.7633 176.0450 42 S 3.9039 8.8522 120.0164 58.9485 62.5674 170.9028 43 M 4.4669 7.9362 121.0351 55.3778 33.4521 175.2518 44 Q 5.4709 8.3606 119.4774 54.0770 31.5403 175.5362 45 V 4.4681 8.2571 115.4313 60.9098 33.3771 176.0790 46 N 4.9222 8.7608 120.2055 52.6221 38.4095 174.1873 47 R 4.7550 7.5310 113.4834 55.0302 32.1390 174.5170 48 A 4.2536 8.6546 122.9374 52.2600 19.4759 177.1751 49 V 4.2316 8.9024 122.2141 60.2877 33.8269 173.4858 50 P 4.6812 0.0000 0.0000 61.9861 32.6959 175.9321 51 L 3.9988 8.4353 123.3477 56.9967 42.2266 177.8267 52 G 3.9714 8.9139 113.3471 45.7137 0.0000 173.7446 53 T 4.1719 7.5633 117.3648 63.4536 69.7476 174.1615 54 T 4.4061 8.3747 122.7922 63.2880 69.4682 174.2422 55 L 4.1260 8.9724 127.6015 55.0131 42.6940 176.5836 56 M 4.7694 8.4177 123.3314 52.7328 34.3596 175.3492 57 P 4.0339 0.0000 0.0000 65.6769 31.6316 178.3076 58 D 4.5629 7.9921 115.2902 55.1251 39.8616 176.6163 59 M 4.4470 8.0978 118.9922 55.0745 32.6785 175.5459 60 V 4.7398 7.3010 119.7515 60.4330 33.4305 174.7144 61 K 4.1396 8.7479 128.1468 57.6605 32.2566 177.6783 62 G 3.9217 9.0150 112.3220 45.2231 0.0000 172.4707 63 Y 4.1665 7.5781 121.4764 56.9166 39.0193 174.4612 64 A 4.3459 7.6990 129.0137 50.0254 22.2273 175.2547 65 A 3.8489 8.1560 123.2443 52.2724 18.7510 177.4254 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 0 A 8.22 4.28 1.26 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 0.00 0.00 1 N 8.34 4.81 0.00 2.84 2.69 0.00 0.00 6.66 6.57 0.00 0.00 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 Q 8.15 4.39 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.70 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 3 A 8.63 4.73 1.23 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 0.00 0.00 0.00 0.00 0.00 4 S 9.01 5.11 0.00 3.69 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.45 4.17 2.02 0.00 0.00 0.00 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 0.92 0.00 0.00 6 V 8.73 4.87 2.07 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 1.03 0.00 0.00 0.92 0.00 0.00 7 A 8.75 4.45 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 8 N 9.33 4.60 0.00 2.71 2.98 0.00 0.00 7.06 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 7.63 4.63 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.69 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 10 L 8.48 4.26 0.00 1.65 1.61 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.67 4.46 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.71 0.90 0.00 0.00 12 P 0.00 4.63 0.00 1.93 1.98 0.00 3.69 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 13 I 8.35 3.62 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 1.34 0.81 0.91 0.00 0.00 14 N 8.50 4.33 0.00 2.93 2.88 0.00 0.00 6.79 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 T 7.54 4.78 4.42 0.00 0.00 0.00 0.00 0.00 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 16 A 8.53 4.63 1.23 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 0.00 0.00 0.00 0.00 0.00 17 L 9.12 4.21 0.00 1.78 1.60 0.96 0.48 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 18 A 8.44 4.97 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 19 L 8.71 3.97 0.00 1.72 1.75 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.71 3.73 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 0.78 0.00 0.00 0.93 0.00 0.00 21 M 8.15 4.21 0.00 2.11 2.27 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.50 0.00 22 M 7.94 5.25 0.00 1.86 1.94 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 23 R 8.94 4.82 0.00 1.84 2.01 0.00 2.71 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.52 0.00 24 S 8.36 5.33 0.00 3.94 3.85 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 0.00 0.00 0.00 25 E 8.93 4.64 0.00 2.01 1.76 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 2.21 2.25 0.00 26 V 8.33 4.58 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 0.87 0.00 0.00 0.97 0.00 0.00 27 V 8.23 4.62 2.07 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 0.80 0.00 0.00 0.92 0.00 0.00 28 T 8.10 4.61 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 1.21 0.00 0.00 29 P 0.00 4.46 0.00 2.17 2.05 0.00 3.76 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 1.98 1.95 0.00 30 V 8.20 3.85 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 0.80 0.00 0.00 0.93 0.00 0.00 31 G 8.38 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 0.00 0.00 0.00 0.00 32 I 8.68 4.02 1.72 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.45 0.76 0.00 0.00 33 P 0.00 4.71 0.00 2.27 2.20 0.00 3.78 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.04 0.00 34 A 8.93 3.99 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.11 4.14 0.00 2.15 2.11 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 2.30 2.36 0.00 36 D 8.22 4.73 0.00 3.02 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 37 I 7.49 3.70 1.88 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 1.51 0.58 0.91 0.00 0.00 38 P 0.00 4.42 0.00 2.17 2.13 0.00 3.74 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 39 R 7.93 3.99 0.00 2.01 2.06 0.00 3.23 0.00 0.00 3.44 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 40 L 8.20 4.17 0.00 1.89 1.72 0.85 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 41 V 6.94 3.92 2.18 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 0.78 0.00 0.00 1.03 0.00 0.00 42 S 8.85 3.90 0.00 4.19 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 43 M 7.94 4.47 0.00 2.05 2.20 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 44 Q 8.36 5.47 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.02 0.00 0.00 0.00 0.00 0.00 2.51 2.22 0.00 45 V 8.26 4.47 2.21 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 0.75 0.00 0.00 1.01 0.00 0.00 46 N 8.76 4.92 0.00 2.85 3.03 0.00 0.00 6.67 7.03 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 47 R 7.53 4.75 0.00 1.79 1.89 0.00 3.03 0.00 0.00 3.22 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 48 A 8.65 4.25 1.24 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 0.00 0.00 0.00 49 V 8.90 4.23 2.07 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 1.01 0.00 0.00 0.91 0.00 0.00 50 P 0.00 4.68 0.00 2.10 1.95 0.00 3.66 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 51 L 8.44 4.00 0.00 1.57 1.58 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.91 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 53 T 7.56 4.17 4.22 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 1.19 0.00 0.00 54 T 8.37 4.41 4.22 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 1.24 0.00 0.00 55 L 8.97 4.13 0.00 1.65 1.49 0.85 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 56 M 8.42 4.77 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 57 P 0.00 4.03 0.00 2.27 2.41 0.00 3.59 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 2.18 2.10 0.00 58 D 7.99 4.56 0.00 2.80 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 59 M 8.10 4.45 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.40 0.00 60 V 7.30 4.74 2.05 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 1.08 0.00 0.00 0.80 0.00 0.00 61 K 8.75 4.14 0.00 1.80 1.76 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.40 7.81 62 G 9.01 3.92 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 0.00 0.00 0.00 63 Y 7.58 4.17 0.00 2.87 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.70 4.35 1.05 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 0.00 0.00 65 A 8.16 3.85 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