NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 L 4.3536 8.0433 120.6290 54.4730 42.5922 181.5204 1 C 4.2552 8.1942 131.2478 60.1332 40.0093 173.8832 2 S 3.8958 8.2128 114.5597 59.9179 63.8268 173.5323 3 L 4.2731 8.0113 123.3707 53.7838 41.4285 175.4679 4 D 4.2853 9.1333 129.5781 55.7107 39.7675 173.0085 5 N 4.3501 8.2859 109.0186 53.3481 37.8005 174.2836 6 G 3.8641 8.7457 100.9077 45.7026 0.0000 174.6234 7 D 4.4806 8.2795 115.7144 54.5086 40.3698 173.3601 8 C 4.6186 7.8696 114.4550 56.6838 41.0425 173.7522 9 D 4.5152 8.4800 123.0100 56.9561 42.1936 177.4302 10 Q 4.3890 7.5719 111.7752 55.6615 30.6603 179.3803 11 F 4.6996 6.2432 126.9208 58.7216 40.3322 172.8923 12 C 5.5324 8.9069 121.9097 55.2873 45.2009 172.6471 13 H 5.0804 9.4100 122.1523 54.0651 33.0038 172.5090 14 E 4.9789 8.8790 120.7626 55.0210 30.8661 175.2522 15 E 4.5424 8.7739 125.2347 55.3659 31.5806 176.8294 16 Q 3.5515 9.2519 123.4058 57.2224 26.0799 172.7915 17 N 4.2301 8.4900 110.7910 54.3566 37.7400 173.2322 18 S 4.6141 7.6537 109.1725 55.6292 65.7745 172.8612 19 V 4.3260 8.4270 127.5332 63.0822 32.2422 175.4343 20 V 4.4237 9.0050 127.1632 60.3030 33.8863 174.2381 21 C 5.3634 8.9103 123.1164 56.3287 36.1307 172.8804 22 S 4.8146 8.7658 114.6939 57.7522 66.5427 172.0150 23 C 5.0895 8.5834 116.3540 54.5877 38.8745 173.9966 24 A 4.5466 8.8909 124.0388 51.5345 18.7442 177.3091 25 R 4.1842 8.4545 120.0556 58.0499 30.5552 176.7984 26 G 4.0163 9.2341 112.4710 45.0577 0.0000 172.2701 27 Y 5.2663 7.6586 116.0317 56.2237 41.3524 175.1909 28 T 4.7429 8.8096 111.6040 59.5895 72.0460 172.9802 29 L 4.6061 8.5609 126.3676 54.8158 42.8824 176.4380 30 A 4.2573 9.2644 128.5061 51.7424 19.3037 178.0093 31 D 4.4233 8.8326 119.0821 57.5439 40.9058 177.9812 32 N 4.4601 8.1912 113.5401 52.9081 37.5095 175.2234 33 G 4.0077 8.4527 107.1681 46.6760 0.0000 174.1688 34 K 4.4920 8.6906 117.7168 57.6271 35.2909 176.9287 35 A 4.7393 8.2675 121.0013 52.0966 19.9226 176.5030 36 C 5.2791 9.1997 118.0551 55.2784 41.3768 173.5630 37 I 4.6286 8.8515 125.4428 58.7546 38.9599 173.6436 38 P 4.0020 0.0000 0.0000 63.0219 31.1987 176.5614 39 T 4.0000 8.5790 119.4011 64.6807 68.0321 174.1448 40 G 3.9879 7.2923 107.5175 43.9290 0.0000 170.1011 41 P 4.1337 0.0000 0.0000 63.1860 32.6613 175.0060 42 Y 3.6137 7.5497 114.3951 58.6416 34.6319 168.8049 43 P 4.3371 0.0000 0.0000 62.0552 32.7396 176.2377 44 C 4.1765 8.3871 114.8474 59.7849 29.8901 174.3991 45 G 3.9596 8.8753 108.7813 45.7038 0.0000 173.2240 46 K 4.5816 7.4385 118.2809 54.1314 33.7278 176.5206 47 Q 4.1885 8.6378 123.1800 56.1802 29.3473 175.9165 48 T 4.4981 8.3103 111.2299 60.9210 70.2030 174.6288 49 L 4.4818 8.4961 123.9118 55.8536 43.0817 176.4119 50 E 4.2883 7.9155 121.5864 56.6047 30.5623 174.8723 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 L 8.04 4.35 0.00 1.91 0.84 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 1 C 8.19 4.26 0.00 3.14 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.21 3.90 0.00 3.86 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 3 L 8.01 4.27 0.00 1.63 1.76 0.92 1.16 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 4 D 9.13 4.29 0.00 2.86 2.61 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 0.00 0.00 0.00 5 N 8.29 4.35 0.00 2.97 2.79 0.00 0.00 7.57 7.90 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 6 G 8.75 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 0.00 0.00 0.00 7 D 8.28 4.48 0.00 2.81 2.79 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 8 C 7.87 4.62 0.00 3.09 2.97 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 9 D 8.48 4.52 0.00 2.70 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.57 4.39 0.00 1.49 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.94 0.00 0.00 0.00 0.00 0.00 1.83 1.95 0.00 11 F 6.24 4.70 0.00 3.11 2.94 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 12 C 8.91 5.53 0.00 3.05 2.95 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 13 H 9.41 5.08 0.00 3.12 3.15 0.00 5.82 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.88 4.98 0.00 1.83 1.90 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 2.22 2.31 0.00 15 E 8.77 4.54 0.00 2.02 1.84 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 2.23 2.26 0.00 16 Q 9.25 3.55 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.93 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 17 N 8.49 4.23 0.00 2.84 2.87 0.00 0.00 6.91 7.63 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 18 S 7.65 4.61 0.00 3.78 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 19 V 8.43 4.33 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 0.87 0.00 0.00 0.94 0.00 0.00 20 V 9.00 4.42 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 0.86 0.00 0.00 0.98 0.00 0.00 21 C 8.91 5.36 0.00 2.99 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 22 S 8.77 4.81 0.00 4.01 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 23 C 8.58 5.09 0.00 2.84 2.88 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 0.00 0.00 0.00 24 A 8.89 4.55 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.45 4.18 0.00 1.86 1.94 0.00 3.24 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 1.66 1.68 0.00 26 G 9.23 4.02 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 0.00 0.00 0.00 27 Y 7.66 5.27 0.00 2.92 2.82 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 0.00 0.00 0.00 28 T 8.81 4.74 4.26 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 1.22 0.00 0.00 29 L 8.56 4.61 0.00 1.68 1.63 1.04 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 30 A 9.26 4.26 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 31 D 8.83 4.42 0.00 2.68 2.76 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 32 N 8.19 4.46 0.00 2.81 2.93 0.00 0.00 5.99 7.00 0.00 0.00 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 G 8.45 4.01 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 34 K 8.69 4.49 0.00 1.66 1.93 0.00 1.66 0.00 0.00 1.88 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.58 7.81 35 A 8.27 4.74 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 36 C 9.20 5.28 0.00 2.57 2.80 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 0.00 0.00 0.00 37 I 8.85 4.63 1.90 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 1.26 1.09 0.92 0.00 0.00 38 P 0.00 4.00 0.00 1.81 1.69 0.00 3.68 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 39 T 8.58 4.00 4.21 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 1.18 0.00 0.00 40 G 7.29 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 0.00 0.00 0.00 41 P 0.00 4.13 0.00 1.70 1.86 0.00 3.91 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 42 Y 7.55 3.61 0.00 3.19 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 43 P 0.00 4.34 0.00 1.71 1.72 0.00 3.61 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.82 0.00 44 C 8.39 4.18 0.00 3.19 3.07 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 45 G 8.88 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 46 K 7.44 4.58 0.00 1.84 1.78 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.61 7.81 47 Q 8.64 4.19 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.83 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 48 T 8.31 4.50 4.46 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 49 L 8.50 4.48 0.00 1.64 1.76 0.91 0.87 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 50 E 7.92 4.29 0.00 1.88 1.81 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 2.21 2.37 0.00