NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2924 8.2644 123.5821 51.5093 19.9515 176.2958 2 I 3.6659 8.1041 119.8040 59.3096 38.4975 172.2597 3 C 5.0758 9.0828 120.6615 53.5737 44.9150 172.7720 4 T 3.9961 7.4475 116.2453 62.8976 68.5744 173.6040 5 G 3.7807 8.1929 108.3146 43.1120 0.0000 173.0513 6 A 4.0589 8.5786 126.6862 52.7638 18.8363 176.8122 7 D 4.4343 8.3539 115.3523 55.0958 39.2285 173.8210 8 R 4.9726 7.5027 116.4705 53.5890 34.2240 172.2844 9 P 4.9091 0.0000 0.0000 62.4633 31.9837 176.8440 10 C 4.4599 8.2137 122.1656 57.1885 35.4267 172.7121 11 A 4.7289 8.1004 120.9282 49.9517 21.4115 176.3318 12 A 3.9304 8.4295 121.7538 55.6988 18.8118 178.1024 13 C 4.3194 8.2816 109.3584 57.8678 40.2011 175.0797 14 C 5.0709 7.8086 117.3706 53.7781 41.9422 172.0228 15 P 4.9020 0.0000 0.0000 61.9442 33.1947 175.8918 16 C 4.5600 8.5341 117.2829 56.6314 35.8082 174.3300 17 C 4.5603 8.2772 118.0264 56.2652 41.4635 171.8307 18 P 4.4676 0.0000 0.0000 66.0131 30.7127 174.7109 19 G 3.6821 8.6466 116.8160 45.3973 0.0000 172.8095 20 T 4.6705 7.2966 109.4429 60.2970 70.8628 174.7871 21 S 4.8061 8.3717 117.7594 56.8056 67.4069 172.4416 22 C 4.8154 8.7929 123.3888 56.1650 39.3560 172.9196 23 K 4.7446 8.6725 124.3970 55.1828 35.3352 176.2235 24 A 4.8759 8.6824 127.0383 51.3500 19.2881 175.2004 25 E 4.8578 8.2067 118.3787 54.3050 33.2748 177.3368 26 S 4.1626 8.6493 113.5529 61.3547 62.5000 174.9594 27 N 4.3644 8.1339 116.8118 54.3206 36.9876 175.4862 28 G 4.0354 7.9228 106.8119 45.0628 0.0000 173.7818 29 V 4.1916 8.5620 119.7422 61.3978 33.1883 174.3413 30 S 5.0394 7.8884 120.4556 57.0946 65.8431 172.6462 31 Y 5.0217 8.4530 119.5042 56.4520 42.6717 174.1965 32 C 5.0423 9.8967 119.8891 57.0854 37.0480 173.0167 33 R 5.0221 8.4816 121.1195 54.6003 33.3332 174.5321 34 K 4.1756 8.8870 125.8014 57.2253 33.0681 176.3474 35 D 4.6336 8.2638 122.0726 54.9546 41.5994 175.4959 36 E 4.7448 8.5440 118.9693 53.8222 32.8970 174.6757 37 P 4.4404 0.0000 0.0000 63.1516 31.6909 176.0027 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 A 8.26 4.29 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 2 I 8.10 3.67 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 1.47 0.73 0.91 0.00 0.00 3 C 9.08 5.08 0.00 3.06 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 4 T 7.45 4.00 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 1.28 0.00 0.00 5 G 8.19 3.78 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 0.00 0.00 0.00 6 A 8.58 4.06 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 7 D 8.35 4.43 0.00 2.81 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 8 R 7.50 4.97 0.00 2.29 1.73 0.00 3.16 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 9 P 0.00 4.91 0.00 1.99 2.01 0.00 3.92 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 10 C 8.21 4.46 0.00 2.72 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 11 A 8.10 4.73 1.13 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 0.00 0.00 12 A 8.43 3.93 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 13 C 8.28 4.32 0.00 3.08 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 14 C 7.81 5.07 0.00 2.95 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 15 P 0.00 4.90 0.00 2.11 2.18 0.00 3.69 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 2.05 1.99 0.00 16 C 8.53 4.56 0.00 3.05 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 17 C 8.28 4.56 0.00 3.02 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 18 P 0.00 4.47 0.00 2.18 2.10 0.00 3.75 0.00 0.00 3.66 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 G 8.65 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.30 4.67 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 1.24 0.00 0.00 21 S 8.37 4.81 0.00 3.70 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.79 4.82 0.00 2.98 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 23 K 8.67 4.74 0.00 1.80 1.86 0.00 1.40 0.00 0.00 1.68 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.44 7.81 24 A 8.68 4.88 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 25 E 8.21 4.86 0.00 2.28 1.96 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 2.27 2.42 0.00 26 S 8.65 4.16 0.00 3.84 3.90 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 N 8.13 4.36 0.00 2.91 2.99 0.00 0.00 6.34 7.21 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 28 G 7.92 4.04 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 0.00 0.00 0.00 29 V 8.56 4.19 2.31 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 0.41 0.00 0.00 0.98 0.00 0.00 30 S 7.89 5.04 0.00 3.65 3.75 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.45 5.02 0.00 2.88 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 32 C 9.90 5.04 0.00 2.97 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 33 R 8.48 5.02 0.00 1.88 1.73 0.00 3.17 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 34 K 8.89 4.18 0.00 1.80 1.82 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.71 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.44 7.81 35 D 8.26 4.63 0.00 2.54 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.54 4.74 0.00 1.91 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 2.20 2.19 0.00 37 P 0.00 4.44 0.00 2.17 2.02 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00