NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8417 8.3093 115.8062 56.2955 39.8964 174.8233 2 V 4.3576 5.7330 117.7976 57.6993 34.2575 172.7659 3 N 4.9244 9.2969 118.2403 52.8349 38.8721 175.2377 4 Q 4.5354 7.6491 119.6409 55.9353 31.9539 174.6831 5 H 4.7999 8.1056 114.1497 55.9501 29.9582 174.8149 6 L 4.5383 8.3130 117.8178 53.8020 44.7071 174.2601 7 C 4.0489 7.5995 123.0473 55.9083 42.8047 173.7521 8 G 3.3039 8.1916 105.3149 46.0795 0.0000 177.8810 9 S 3.8917 7.9292 113.6943 60.2533 64.8943 177.0157 10 D 4.4450 8.1553 121.8091 56.0048 40.8965 178.3395 11 L 3.9701 9.1989 119.6314 58.0845 41.7185 180.0211 12 V 2.7988 8.8590 117.6663 65.7886 31.4496 177.8106 13 E 3.9562 8.0826 118.1072 59.3493 29.0004 179.2590 14 A 3.4260 9.0323 121.0903 54.9386 18.5791 179.5487 15 L 3.4110 7.6491 117.5568 57.9293 41.4376 179.5671 16 Y 4.3982 7.3761 119.2261 60.8470 38.7269 177.5734 17 L 3.2544 7.3167 119.3843 57.1067 42.1416 178.7047 18 V 3.6644 8.9614 117.7825 65.5982 31.4980 175.0470 19 C 4.7932 7.8963 114.0442 56.0941 46.7718 172.8027 20 G 3.5770 8.8908 108.9479 44.8180 0.0000 170.9420 21 E 4.7829 7.1977 121.1722 55.9066 37.4300 176.1873 22 R 4.5180 7.8643 116.2385 56.2247 31.3017 177.1756 23 G 3.2633 8.3141 103.7585 46.2410 0.0000 175.4189 24 F 3.5490 7.0607 111.4227 57.5598 39.2855 173.3404 25 F 5.0105 8.3718 120.7971 57.5235 40.3988 176.7240 26 Y 4.7257 7.4329 126.9254 57.2921 40.0184 172.5404 27 T 4.4804 7.2418 117.8051 64.5255 74.0899 175.3461 28 D 4.2941 7.9120 118.9580 54.7663 40.1891 175.7230 29 K 3.4921 7.7200 117.2103 56.7777 28.1453 175.2654 30 G 4.1978 7.7363 103.5490 45.0369 0.0000 171.8201 31 I 4.1087 7.4484 120.1819 61.5722 40.2807 174.5218 32 V 3.7027 8.8215 116.9707 63.1702 30.7394 172.7755 33 E 4.4095 7.6298 116.1704 57.3634 30.2726 176.6600 34 Q 4.5227 8.0276 114.6596 56.0341 30.4057 176.9353 35 C 4.8818 8.1458 117.7475 56.6464 44.1984 174.2532 36 C 4.6469 8.2381 116.9256 58.7714 44.7671 174.3266 37 T 3.9949 7.8501 110.6790 62.1395 67.7409 173.1935 38 S 4.8287 7.3512 112.6991 56.0019 65.3965 172.9703 39 I 4.1743 8.0196 122.6936 61.1349 38.2523 177.1839 40 C 5.1657 8.1774 119.7502 56.8458 37.9189 176.3971 41 S 4.4757 8.5929 116.2292 57.4394 64.5458 174.6107 42 L 3.8943 8.1072 127.5746 57.8871 42.0980 177.6197 43 Y 3.9683 7.9994 118.4580 60.8035 39.0350 177.5591 44 Q 4.1710 8.8012 120.6811 59.3511 29.1362 178.1018 45 L 4.3476 8.1669 119.4700 57.7720 41.4579 178.3448 46 E 4.5078 8.4096 116.0417 56.8593 29.3908 176.5436 47 N 4.8733 8.1334 116.6876 53.4842 39.9202 174.7470 48 Y 4.1101 8.1873 116.6412 60.9710 38.3979 175.3532 49 C 5.0129 8.1446 117.8136 55.8582 44.8078 172.7677 50 N 4.5489 8.6334 119.4012 53.5959 38.2549 175.3745 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 F 8.31 4.84 0.00 3.21 3.26 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 2 V 5.73 4.36 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 0.77 0.00 0.00 0.98 0.00 0.00 3 N 9.30 4.92 0.00 2.71 2.80 0.00 0.00 5.80 7.35 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 4 Q 7.65 4.54 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.04 0.00 0.00 0.00 0.00 0.00 2.07 2.24 0.00 5 H 8.11 4.80 0.00 3.31 3.47 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.31 4.54 0.00 1.65 1.75 1.16 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 7 C 7.60 4.05 0.00 3.13 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 8 G 8.19 3.30 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 0.00 9 S 7.93 3.89 0.00 4.01 4.05 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 10 D 8.16 4.45 0.00 2.79 2.73 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 11 L 9.20 3.97 0.00 1.80 1.71 0.87 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.86 2.80 1.94 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 1.06 0.00 0.00 0.04 0.00 0.00 13 E 8.08 3.96 0.00 2.24 1.95 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 2.27 2.29 0.00 14 A 9.03 3.43 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.65 3.41 0.00 0.32 0.13 0.56 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.38 4.40 0.00 3.32 3.17 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 17 L 7.32 3.25 0.00 1.33 1.29 0.70 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 18 V 8.96 3.66 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 0.87 0.00 0.00 0.77 0.00 0.00 19 C 7.90 4.79 0.00 3.12 3.28 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 20 G 8.89 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.20 4.78 0.00 1.97 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 2.31 0.00 22 R 7.86 4.52 0.00 1.88 1.92 0.00 3.27 0.00 0.00 3.36 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 23 G 8.31 3.26 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 0.00 24 F 7.06 3.55 0.00 3.46 3.35 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 25 F 8.37 5.01 0.00 3.45 3.37 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 0.00 0.00 0.00 0.00 26 Y 7.43 4.73 0.00 3.21 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 27 T 7.24 4.48 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 1.10 0.00 0.00 28 D 7.91 4.29 0.00 2.82 2.89 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 29 K 7.72 3.49 0.00 1.83 1.76 0.00 1.51 0.00 0.00 1.44 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.87 1.37 7.81 30 G 7.74 4.20 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 0.00 0.00 0.00 31 I 7.45 4.11 2.08 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.14 0.87 0.00 0.00 32 V 8.82 3.70 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 0.84 0.00 0.00 0.92 0.00 0.00 33 E 7.63 4.41 0.00 2.05 2.00 0.00 0.00 0.00 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 2.39 0.00 34 Q 8.03 4.52 0.00 2.23 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.92 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 35 C 8.15 4.88 0.00 3.01 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 36 C 8.24 4.65 0.00 3.00 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 37 T 7.85 3.99 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 1.26 0.00 0.00 38 S 7.35 4.83 0.00 3.88 3.81 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 39 I 8.02 4.17 1.85 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.87 0.90 0.00 0.00 40 C 8.18 5.17 0.00 2.95 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 41 S 8.59 4.48 0.00 3.91 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 42 L 8.11 3.89 0.00 1.52 1.66 0.90 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 43 Y 8.00 3.97 0.00 2.97 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 44 Q 8.80 4.17 0.00 2.29 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.63 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 45 L 8.17 4.35 0.00 1.87 1.85 1.05 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.41 4.51 0.00 2.19 1.89 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 2.37 2.38 0.00 47 N 8.13 4.87 0.00 2.49 2.78 0.00 0.00 6.91 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 8.19 4.11 0.00 3.36 3.34 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 49 C 8.14 5.01 0.00 3.22 3.12 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 50 N 8.63 4.55 0.00 2.79 2.72 0.00 0.00 6.79 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00