NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5756 8.3049 118.3347 55.1360 33.4541 173.9347 2 K 4.4837 8.0293 115.6587 54.6803 36.0472 171.1165 3 V 4.6629 9.0103 118.6903 62.6717 34.3320 175.1726 4 R 4.0677 9.1746 122.9761 56.7877 28.6450 175.5934 5 A 4.1890 8.2201 120.0876 54.7001 19.2446 178.0432 6 S 4.1313 8.0093 111.1168 58.4999 61.8377 172.4810 7 V 3.9538 7.7829 127.5427 58.6806 33.4086 177.9861 8 K 3.4675 7.6933 120.4386 56.2857 33.4254 174.1764 9 K 4.4802 8.1587 116.2847 55.9538 33.8996 176.3873 10 L 4.5855 8.2610 118.4299 55.0810 43.4791 175.8221 11 C 4.7357 7.5307 112.1810 56.6946 32.1581 174.7492 12 R 4.0259 8.5336 116.0479 58.1780 28.8526 176.5382 13 N 4.7942 8.0268 117.3233 53.6862 39.1525 173.8165 14 C 4.7047 7.4671 114.1767 57.7901 30.2793 172.3465 15 K 4.1961 7.9599 117.6856 57.3338 33.6583 172.2278 16 I 3.4788 8.1885 127.9613 60.9661 36.5418 173.8628 17 V 4.1921 8.4598 116.8364 59.8122 35.9512 173.0880 18 K 3.7872 8.8514 126.1293 57.3036 32.4221 177.1964 19 R 4.5293 7.9368 129.7225 54.0105 29.7484 173.1599 20 D 4.8583 7.7144 119.3336 53.6937 37.3151 177.2926 21 G 4.0043 8.5335 114.8049 45.4224 0.0000 172.9616 22 V 3.9264 7.6366 113.9019 60.1441 31.5578 175.4241 23 I 4.1175 8.1795 126.7618 61.6099 36.0933 176.0477 24 R 4.6522 8.3342 126.0490 54.8680 32.9951 175.3150 25 V 4.6597 8.8230 121.0230 61.3356 34.3733 174.1720 26 I 4.7299 8.3772 128.3412 59.7115 39.5741 173.9967 27 C 5.2999 8.6933 126.5156 57.7644 33.5688 173.6292 28 S 4.4966 8.4739 118.6084 58.5702 63.4945 175.1112 29 A 4.1785 7.1351 124.3275 53.4888 17.9575 176.7376 30 E 4.7618 7.4051 113.6635 53.6744 32.7194 175.9953 31 P 4.5663 0.0000 0.0000 65.3169 32.0131 178.8632 32 K 3.8950 8.3730 117.0501 59.9807 31.9290 177.8036 33 H 4.1446 7.5924 114.2561 58.4587 29.0617 175.9654 34 K 4.4264 7.8631 121.5674 56.8264 33.0262 175.7979 35 Q 4.9943 8.7858 123.3754 55.0523 32.2542 173.1271 36 R 4.8216 8.9482 120.3550 55.0373 34.2894 172.1203 37 Q 3.5839 9.4032 126.3395 55.9029 29.7283 173.2991 38 G 3.9492 8.8931 109.7556 45.8832 0.0000 173.9081 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 8.30 4.58 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 2 K 8.03 4.48 0.00 1.64 1.68 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.34 1.63 7.81 3 V 9.01 4.66 2.25 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 0.84 0.00 0.00 0.93 0.00 0.00 4 R 9.17 4.07 0.00 1.84 2.34 0.00 3.19 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 5 A 8.22 4.19 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.01 4.13 0.00 3.84 3.80 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 7 V 7.78 3.95 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 0.83 0.00 0.00 0.98 0.00 0.00 8 K 7.69 3.47 0.00 1.98 1.89 0.00 1.56 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.32 1.40 7.81 9 K 8.16 4.48 0.00 1.88 1.85 0.00 1.42 0.00 0.00 1.71 0.00 0.00 3.31 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.51 7.81 10 L 8.26 4.59 0.00 1.41 1.58 0.78 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 11 C 7.53 4.74 0.00 3.09 3.13 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 0.00 0.00 0.00 12 R 8.53 4.03 0.00 1.94 2.11 0.00 3.02 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 13 N 8.03 4.79 0.00 2.75 2.75 0.00 0.00 7.11 7.65 0.00 0.00 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 C 7.47 4.70 0.00 2.99 2.87 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.96 4.20 0.00 1.65 1.88 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.41 7.81 16 I 8.19 3.48 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 1.42 0.54 0.91 0.00 0.00 17 V 8.46 4.19 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 0.54 0.00 0.00 0.93 0.00 0.00 18 K 8.85 3.79 0.00 1.71 1.76 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.74 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.44 7.81 19 R 7.94 4.53 0.00 1.92 1.82 0.00 3.30 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 20 D 7.71 4.86 0.00 2.78 2.78 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 0.00 0.00 0.00 0.00 21 G 8.53 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.64 3.93 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 0.86 0.00 0.00 0.93 0.00 0.00 23 I 8.18 4.12 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 0.47 0.91 0.00 0.00 24 R 8.33 4.65 0.00 1.76 1.83 0.00 3.06 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 25 V 8.82 4.66 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 1.00 0.00 0.00 0.98 0.00 0.00 26 I 8.38 4.73 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 1.23 1.17 0.91 0.00 0.00 27 C 8.69 5.30 0.00 2.96 2.93 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 28 S 8.47 4.50 0.00 4.00 3.94 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 29 A 7.14 4.18 1.20 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 30 E 7.41 4.76 0.00 1.78 1.83 0.00 0.00 0.00 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 2.23 0.00 31 P 0.00 4.57 0.00 2.18 2.09 0.00 3.62 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 32 K 8.37 3.90 0.00 1.82 1.92 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.51 7.81 33 H 7.59 4.14 0.00 3.26 3.41 0.00 5.68 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 7.86 4.43 0.00 1.89 1.80 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.57 7.81 35 Q 8.79 4.99 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.37 0.00 0.00 0.00 0.00 0.00 2.44 2.31 0.00 36 R 8.95 4.82 0.00 1.81 1.77 0.00 3.21 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 37 Q 9.40 3.58 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.20 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 38 G 8.89 3.95 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 0.00 0.00 0.00