NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 H 4.7508 8.3027 120.6743 56.0885 31.8859 171.2862 3 V 4.7297 7.9047 123.8788 60.6206 33.3821 173.0428 4 W 4.7477 10.4283 130.1970 54.1380 31.6167 173.6631 5 P 4.9343 0.0000 0.0000 61.9677 31.8967 177.7431 6 V 3.5510 8.5130 123.4062 65.4166 31.0808 178.9301 7 Q 4.0274 8.0474 117.6410 58.7184 28.3922 177.9657 8 D 4.4600 8.0154 120.3028 56.9573 41.2926 178.2630 9 A 3.3886 8.3011 121.5799 54.6103 17.9343 179.7156 10 K 3.8242 7.9155 117.1233 59.7828 32.4968 178.7758 11 A 4.2275 8.0439 119.5765 54.0232 18.6296 178.0316 12 R 4.7324 8.2486 116.9873 55.5826 31.2977 178.1743 13 F 4.4478 8.3749 123.0584 61.1037 39.4111 175.9186 14 S 4.0314 8.1636 114.2626 61.3862 62.6074 176.1285 15 E 3.9536 8.0928 121.7946 58.9869 29.5071 178.2647 16 F 3.3433 8.0542 121.1150 60.8773 39.3118 176.9552 17 L 3.4219 7.5622 120.0518 58.1169 41.7901 178.6724 18 D 4.2918 8.1076 118.6768 57.1525 40.5835 178.6715 19 A 3.9784 8.3660 121.9038 55.1195 17.9088 179.0072 20 C 4.6058 7.7449 118.5636 62.2886 31.3122 175.9973 21 I 3.8263 7.3745 119.8132 63.8003 36.9124 177.7130 22 T 4.2914 8.0894 109.2221 62.4710 69.2169 175.1818 23 E 4.3768 9.5663 119.6889 57.0959 32.0012 176.1766 24 G 4.3027 7.2813 103.8667 42.4014 0.0000 169.7756 25 P 4.7241 0.0000 0.0000 63.4599 31.9880 176.1735 26 Q 4.8093 8.6168 122.1640 54.2290 31.6879 174.9431 27 I 4.9192 9.0728 125.3662 60.3907 39.4395 175.0384 28 V 5.1582 9.0516 125.4403 60.0260 33.9799 174.7722 29 S 5.3502 9.1510 118.1056 56.7001 66.5179 172.9413 30 R 4.5692 8.4348 118.9477 55.1550 33.9590 175.8697 31 R 3.8550 9.7867 120.0165 57.2561 27.8224 177.3829 32 G 3.8694 8.5254 102.7672 45.5784 0.0000 173.7588 33 A 4.7737 7.8059 123.1034 49.5724 21.1727 176.5557 34 E 4.4386 8.7320 121.6042 56.9539 30.3074 176.0708 35 E 4.6660 9.0326 120.8821 57.6987 32.2414 175.7186 36 A 4.8001 7.6790 118.4427 50.9650 23.1536 175.0830 37 V 4.8630 8.0179 117.6849 60.0826 34.7159 174.5993 38 L 4.3137 9.0563 126.8746 53.8763 43.2223 175.1801 39 V 4.7229 7.9353 125.7461 60.1099 34.3139 173.5081 40 P 4.3523 0.0000 0.0000 62.5180 32.1018 177.3932 41 I 3.9083 8.4623 121.5035 64.1320 37.8751 178.6983 42 G 3.5755 8.0498 106.3411 47.6119 0.0000 175.0869 43 E 3.9568 8.2127 121.4053 58.7264 29.6281 178.5431 44 W 4.2583 8.4106 128.2594 60.7804 30.7574 178.1749 45 R 3.7360 8.3912 118.1863 59.3008 29.5873 179.3715 46 R 3.8763 8.3650 118.3036 59.0111 30.0105 179.0569 47 L 3.9095 7.9992 119.0240 57.7848 41.3547 179.5295 48 Q 3.6204 7.5137 116.8034 58.7928 28.6524 178.3895 49 A 4.0255 7.8992 120.7020 54.9220 18.3937 179.3682 50 A 3.9916 7.5554 117.9762 54.8772 18.6897 177.9294 51 A 4.2873 7.8012 122.3650 52.3348 19.2247 176.8879 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 2 H 8.30 4.75 0.00 3.36 3.70 0.00 5.79 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 V 7.90 4.73 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 0.90 0.00 0.00 0.95 0.00 0.00 4 W 10.43 4.75 0.00 3.11 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 5 P 0.00 4.93 0.00 2.20 1.99 0.00 4.06 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.94 0.00 6 V 8.51 3.55 2.07 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 0.87 0.00 0.00 0.90 0.00 0.00 7 Q 8.05 4.03 0.00 2.27 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.96 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 8 D 8.02 4.46 0.00 3.02 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 9 A 8.30 3.39 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.92 3.82 0.00 1.72 1.98 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.39 7.81 11 A 8.04 4.23 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.25 4.73 0.00 2.36 2.29 0.00 3.24 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 13 F 8.37 4.45 0.00 3.30 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 14 S 8.16 4.03 0.00 3.94 3.91 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 0.00 0.00 0.00 15 E 8.09 3.95 0.00 2.14 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 0.00 2.75 2.52 0.00 16 F 8.05 3.34 0.00 1.66 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 7.56 3.42 0.00 1.08 1.43 0.73 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 18 D 8.11 4.29 0.00 2.69 2.68 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 19 A 8.37 3.98 1.55 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 0.00 0.00 20 C 7.74 4.61 0.00 2.53 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 21 I 7.37 3.83 1.81 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.63 0.88 0.00 0.00 22 T 8.09 4.29 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 1.22 0.00 0.00 23 E 9.57 4.38 0.00 2.06 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 2.23 2.22 0.00 24 G 7.28 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 0.00 0.00 0.00 0.00 25 P 0.00 4.72 0.00 1.96 2.03 0.00 3.64 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 2.06 2.16 0.00 26 Q 8.62 4.81 0.00 1.24 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.87 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 27 I 9.07 4.92 2.01 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.73 1.06 0.00 0.00 28 V 9.05 5.16 2.07 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 0.90 0.00 0.00 0.94 0.00 0.00 29 S 9.15 5.35 0.00 4.05 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 30 R 8.43 4.57 0.00 1.92 1.81 0.00 3.28 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 31 R 9.79 3.86 0.00 1.93 1.98 0.00 3.28 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 32 G 8.53 3.87 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 0.00 0.00 0.00 33 A 7.81 4.77 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 34 E 8.73 4.44 0.00 2.00 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 0.00 2.35 2.36 0.00 35 E 9.03 4.67 0.00 1.98 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 2.44 2.42 0.00 36 A 7.68 4.80 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.02 4.86 2.11 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 0.73 0.00 0.00 0.95 0.00 0.00 38 L 9.06 4.31 0.00 1.32 0.85 0.85 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.94 4.72 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 1.03 0.00 0.00 0.91 0.00 0.00 40 P 0.00 4.35 0.00 2.22 1.93 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 41 I 8.46 3.91 1.89 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.93 0.00 0.00 42 G 8.05 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 43 E 8.21 3.96 0.00 2.08 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 0.00 2.46 2.41 0.00 44 W 8.41 4.26 0.00 3.42 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 45 R 8.39 3.74 0.00 1.90 1.95 0.00 3.23 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.04 0.00 46 R 8.37 3.88 0.00 1.86 1.94 0.00 3.12 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 47 L 8.00 3.91 0.00 1.61 1.52 0.98 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 48 Q 7.51 3.62 0.00 1.82 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.97 0.00 0.00 0.00 0.00 0.00 1.16 1.76 0.00 49 A 7.90 4.03 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 50 A 7.56 3.99 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 51 A 7.80 4.29 1.17 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 0.00 0.00