NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.3885 8.4293 118.7738 56.5142 29.7432 175.6174 2 E 4.5517 8.3640 127.8315 55.4725 30.3722 176.6797 3 C 4.5571 8.3722 118.5139 58.1313 36.4802 173.1452 4 G 4.6269 9.1868 110.1985 43.0113 0.0000 170.3030 5 P 4.3914 0.0000 0.0000 63.8132 31.9604 176.2655 6 N 4.1447 8.7342 118.2590 53.7524 36.0929 173.3122 7 E 5.0853 7.4487 117.5949 55.0327 32.4555 175.3790 8 V 4.7830 8.4954 113.6322 59.9168 36.6926 173.8168 9 F 4.9897 8.8510 125.5143 56.8212 40.9418 174.5766 10 N 5.3331 8.9634 123.1910 51.7073 41.9990 175.1441 11 T 4.4511 8.8713 112.1369 62.3323 69.4761 175.9261 12 C 4.9746 7.4458 118.4242 56.0833 46.0325 172.4315 13 G 4.4186 8.8878 110.8808 42.8847 0.0000 168.6366 14 S 4.4763 8.8197 114.6159 58.4492 62.9231 175.1685 15 A 3.9820 8.8741 128.7001 54.7300 18.3315 178.4303 16 C 4.8213 7.8598 111.5168 56.3236 40.9467 173.5947 17 A 4.3754 7.8802 121.4475 50.4410 18.8731 176.6518 18 P 4.7463 0.0000 0.0000 63.6181 32.3633 175.4419 19 T 4.5755 9.0220 110.0313 61.2238 71.5092 173.3215 20 C 4.3778 8.8712 120.3643 59.4473 43.9594 175.3642 21 A 4.1338 7.5196 122.5188 54.2811 18.6560 177.8412 22 Q 4.4802 7.7145 120.5200 53.5623 28.7275 174.4997 23 P 4.5928 0.0000 0.0000 63.1045 31.7650 176.6806 24 K 4.3720 7.7105 118.4477 55.1751 33.9958 175.6647 25 T 4.4457 7.9793 118.8605 60.7534 69.3358 173.6855 26 R 4.2782 8.3383 114.3766 55.8556 29.9933 173.3906 27 I 3.1982 7.9560 122.0859 62.0906 37.0026 174.3125 28 C 4.6281 8.2086 119.8339 57.6935 45.1123 173.1625 29 T 3.9741 7.0510 111.0711 61.8106 69.6540 173.1292 30 M 4.3143 8.6073 123.3545 53.1308 29.5499 174.2856 31 Q 4.7825 7.4801 119.2180 55.2253 31.9627 173.5599 32 C 4.4961 8.8499 123.5138 57.3960 42.6717 172.8672 33 R 4.6562 8.8491 118.9681 54.8765 32.6691 174.0786 34 I 4.7260 8.8008 127.4264 59.8764 38.4152 175.7063 35 G 3.4355 7.6029 114.0968 45.9716 0.0000 170.2761 36 C 4.9602 7.6261 117.2990 56.6011 42.5773 173.2266 37 Q 4.5199 9.2463 119.2987 55.0229 32.6340 172.5038 38 C 4.9804 8.5900 116.3832 56.0051 39.6460 174.4003 39 Q 4.3606 8.8616 122.8492 55.2446 30.2607 175.2151 40 E 3.9845 8.7843 120.9211 60.8041 28.8385 175.5045 41 G 3.3942 8.1827 113.9631 44.8478 0.0000 172.0838 42 F 5.1037 8.0948 117.9093 55.5066 43.0742 174.3215 43 L 4.9055 9.1290 120.7243 52.8669 45.7415 175.7939 44 R 4.6622 8.6266 123.5756 56.1025 31.4106 174.7563 45 N 5.0821 9.4994 124.6266 51.2636 39.3708 176.6706 46 G 3.9293 8.6655 109.7655 48.8852 0.0000 173.3447 47 E 4.2350 8.2272 119.6958 58.0669 29.8286 175.9979 48 G 3.9638 7.7447 102.4587 45.9365 0.0000 173.7216 49 A 4.6205 9.5087 122.4264 49.7894 21.5941 176.4354 50 C 4.9015 8.9259 120.9628 56.5428 35.7175 173.0873 51 V 4.6977 9.1319 117.6307 58.7829 34.4402 175.6228 52 L 4.5694 8.8240 123.7820 54.7425 42.5673 176.7297 53 P 4.2716 0.0000 0.0000 65.5227 31.6980 177.8929 54 E 4.2135 8.1084 114.5817 57.4707 29.8239 176.5988 55 N 4.8254 7.4831 116.1009 52.8970 39.7072 173.8465 56 C 4.3519 7.8635 123.9983 57.0310 44.6229 173.0853 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 E 8.43 4.39 0.00 2.20 1.92 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 2.13 2.32 0.00 2 E 8.36 4.55 0.00 2.17 2.06 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 2.24 2.43 0.00 3 C 8.37 4.56 0.00 3.00 3.25 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 4 G 9.19 4.63 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 0.00 0.00 0.00 5 P 0.00 4.39 0.00 2.10 2.02 0.00 3.88 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.94 0.00 6 N 8.73 4.14 0.00 1.91 1.42 0.00 0.00 7.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 7.45 5.09 0.00 2.03 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.29 0.00 8 V 8.50 4.78 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 0.77 0.00 0.00 0.96 0.00 0.00 9 F 8.85 4.99 0.00 3.05 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 10 N 8.96 5.33 0.00 2.79 2.69 0.00 0.00 6.44 6.68 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 11 T 8.87 4.45 4.30 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 1.29 0.00 0.00 12 C 7.45 4.97 0.00 2.97 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 G 8.89 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 0.00 0.00 0.00 0.00 14 S 8.82 4.48 0.00 3.99 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 15 A 8.87 3.98 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 16 C 7.86 4.82 0.00 3.04 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 17 A 7.88 4.38 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 18 P 0.00 4.75 0.00 2.09 2.07 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 19 T 9.02 4.58 4.51 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 1.26 0.00 0.00 20 C 8.87 4.38 0.00 3.15 3.16 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 0.00 0.00 0.00 0.00 21 A 7.52 4.13 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 22 Q 7.71 4.48 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.87 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 23 P 0.00 4.59 0.00 2.17 2.15 0.00 3.70 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 1.98 1.98 0.00 24 K 7.71 4.37 0.00 1.71 1.74 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.32 1.38 7.81 25 T 7.98 4.45 4.33 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 1.21 0.00 0.00 26 R 8.34 4.28 0.00 1.89 1.91 0.00 3.24 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.50 0.00 27 I 7.96 3.20 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 1.30 0.30 0.96 0.00 0.00 28 C 8.21 4.63 0.00 2.99 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 29 T 7.05 3.97 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 30 M 8.61 4.31 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.53 0.00 31 Q 7.48 4.78 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 6.72 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 32 C 8.85 4.50 0.00 2.91 3.04 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 0.00 0.00 0.00 33 R 8.85 4.66 0.00 1.80 1.90 0.00 3.18 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.68 0.00 34 I 8.80 4.73 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.73 1.13 0.00 0.00 35 G 7.60 3.44 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 0.00 36 C 7.63 4.96 0.00 2.69 2.90 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 37 Q 9.25 4.52 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.86 0.00 0.00 0.00 0.00 0.00 2.45 2.32 0.00 38 C 8.59 4.98 0.00 2.99 3.20 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 0.00 0.00 0.00 39 Q 8.86 4.36 0.00 2.45 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.03 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 40 E 8.78 3.98 0.00 1.95 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 2.27 2.31 0.00 41 G 8.18 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.09 5.10 0.00 2.96 2.85 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 43 L 9.13 4.91 0.00 1.63 1.52 1.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.63 4.66 0.00 1.90 1.79 0.00 3.14 0.00 0.00 3.36 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 45 N 9.50 5.08 0.00 2.76 2.92 0.00 0.00 6.49 6.78 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 46 G 8.67 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.23 4.23 0.00 1.94 1.97 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 2.27 2.30 0.00 48 G 7.74 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.51 4.62 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 50 C 8.93 4.90 0.00 2.79 3.03 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 0.00 0.00 0.00 51 V 9.13 4.70 2.12 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 0.70 0.00 0.00 1.04 0.00 0.00 52 L 8.82 4.57 0.00 1.69 1.61 1.05 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.27 0.00 2.19 2.28 0.00 3.61 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.89 0.00 54 E 8.11 4.21 0.00 2.07 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 0.00 2.25 2.38 0.00 55 N 7.48 4.83 0.00 2.68 2.88 0.00 0.00 6.90 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 56 C 7.86 4.35 0.00 3.11 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