NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2890 8.2644 123.5821 52.0706 19.7622 175.6855 2 V 4.3098 7.9845 121.6725 58.5529 34.8604 172.8195 3 Q 4.2753 8.6036 121.5462 56.2429 29.9790 175.1614 4 Q 4.5706 8.2145 116.1309 55.6270 30.2612 174.5105 5 N 4.6975 7.6233 111.7893 52.4556 42.4691 173.9025 6 K 4.0039 8.6305 123.6368 55.8186 31.9203 174.3013 7 P 4.1380 0.0000 0.0000 63.0153 31.3002 176.9221 8 T 3.9821 8.5490 117.9962 62.0676 69.2661 174.2319 9 R 3.9041 8.5046 121.4842 59.4472 29.3759 178.4602 10 S 4.0214 8.1608 113.3496 61.2004 62.0101 175.5869 11 K 3.7426 8.0826 120.3413 60.1309 32.0225 177.5880 12 R 3.9718 7.7811 118.1894 59.8364 29.8788 177.9792 13 G 3.8534 8.1476 104.4621 48.5511 0.0000 175.0442 14 M 4.0586 7.9941 121.1173 58.2175 31.7023 178.9437 15 R 3.9954 7.9960 118.1239 58.9458 30.6969 177.7261 16 R 4.7077 8.0089 117.7843 55.4317 29.8626 178.3038 17 S 4.1541 7.4767 114.8683 61.9923 63.0070 175.7703 18 H 4.4134 7.9099 117.9814 57.1755 28.8238 176.4884 19 D 4.6304 7.6439 120.1152 54.3107 40.0284 175.7363 20 A 4.6148 7.6828 120.3786 50.3004 21.6492 177.0624 21 L 4.4254 8.0854 119.5265 54.2568 42.9557 176.2279 22 T 4.7074 7.9061 113.3680 59.8972 70.9179 176.0365 23 A 4.6494 8.0810 131.8602 51.9068 17.4082 179.5572 24 V 4.4107 8.0977 107.7661 61.9465 34.6668 175.2925 25 T 3.7542 8.8381 108.6383 62.0909 67.4788 169.2210 26 S 3.9790 7.4069 120.8495 58.5339 65.5252 171.5247 27 L 4.6802 7.8788 122.7948 55.4269 39.4231 176.5569 28 S 4.7907 8.8133 111.1926 57.1555 66.1697 172.9032 29 V 5.0234 8.2395 122.2047 59.7711 33.9008 174.8130 30 D 4.5546 8.3575 121.9146 54.0626 41.5845 176.5286 31 K 4.2070 8.5894 122.2871 59.3881 33.0526 178.9376 32 T 4.1252 8.2713 115.5163 65.7828 68.7352 174.4296 33 S 4.7655 7.6766 113.4325 56.1199 66.3976 174.4364 34 G 3.7460 8.2668 110.1018 45.3425 0.0000 174.8907 35 E 4.1719 7.6021 119.2894 54.9194 31.0198 177.8028 36 K 4.4760 8.7152 127.7591 56.3095 31.9195 175.1035 37 H 5.1374 9.2818 122.5651 52.8506 32.6925 172.4291 38 L 4.4048 8.2773 120.4065 54.3859 43.2068 176.3024 39 R 3.9023 8.5437 124.6329 58.5646 30.3841 176.6924 40 H 4.9917 10.8242 117.7327 57.0026 26.4737 174.2909 41 H 4.1486 8.2477 113.2583 54.7817 31.2707 173.9420 42 I 3.3383 6.7238 120.9293 59.3232 36.9181 175.1008 43 T 4.4758 8.5392 113.9682 60.0469 70.6665 175.3165 44 A 4.1701 8.5570 123.4456 54.4141 18.3420 177.7924 45 D 4.8861 8.3149 112.3964 52.7902 40.5347 176.1238 46 G 4.3319 8.0532 107.8912 47.0004 0.0000 173.3102 47 Y 4.9422 8.9983 118.2860 56.6590 42.0097 176.2610 48 Y 5.1035 8.1346 127.9201 58.2933 45.9180 176.8159 49 R 4.3074 8.1770 114.1948 55.4337 30.0118 175.8257 50 G 4.4002 7.7449 111.8998 43.8644 0.0000 173.2126 51 R 3.4093 8.3847 122.5368 57.9886 29.4981 176.9048 52 K 4.1230 7.5932 112.8590 57.4622 33.3097 175.1636 53 V 3.7938 7.7999 117.8330 60.6631 32.7889 171.9734 54 I 3.2378 8.3498 129.5578 60.3503 36.8056 173.9918 55 A 3.9051 8.7322 128.2676 53.4810 18.9312 177.1256 56 K 4.3277 8.5556 119.4059 57.3769 34.2917 174.4424 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 V 7.98 4.31 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 0.87 0.00 0.00 0.93 0.00 0.00 3 Q 8.60 4.28 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.61 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 4 Q 8.21 4.57 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.66 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 5 N 7.62 4.70 0.00 2.69 2.65 0.00 0.00 6.94 7.61 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 6 K 8.63 4.00 0.00 1.71 1.76 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.46 7.81 7 P 0.00 4.14 0.00 2.08 2.04 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 8 T 8.55 3.98 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 1.23 0.00 0.00 9 R 8.50 3.90 0.00 2.07 2.18 0.00 3.04 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 10 S 8.16 4.02 0.00 3.90 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 11 K 8.08 3.74 0.00 1.76 2.03 0.00 1.76 0.00 0.00 1.63 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.60 7.81 12 R 7.78 3.97 0.00 1.87 2.20 0.00 3.18 0.00 0.00 3.17 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 13 G 8.15 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.99 4.06 0.00 2.10 2.27 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.56 0.00 15 R 8.00 4.00 0.00 1.80 2.08 0.00 3.25 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 16 R 8.01 4.71 0.00 2.03 1.92 0.00 3.20 0.00 0.00 3.31 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.49 0.00 17 S 7.48 4.15 0.00 3.78 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 18 H 7.91 4.41 0.00 3.18 3.41 0.00 5.70 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 D 7.64 4.63 0.00 2.91 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 20 A 7.68 4.61 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 21 L 8.09 4.43 0.00 1.65 1.62 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 22 T 7.91 4.71 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 1.21 0.00 0.00 23 A 8.08 4.65 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.10 4.41 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 0.97 0.00 0.00 25 T 8.84 3.75 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 1.21 0.00 0.00 26 S 7.41 3.98 0.00 4.05 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 27 L 7.88 4.68 0.00 1.96 1.35 0.94 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.81 4.79 0.00 3.92 3.73 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 29 V 8.24 5.02 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 0.78 0.00 0.00 0.91 0.00 0.00 30 D 8.36 4.55 0.00 2.60 2.74 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 31 K 8.59 4.21 0.00 1.78 1.83 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.43 7.81 32 T 8.27 4.13 4.63 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 0.00 0.00 0.00 1.41 0.00 0.00 33 S 7.68 4.77 0.00 3.51 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 34 G 8.27 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 0.00 0.00 0.00 35 E 7.60 4.17 0.00 1.75 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 2.03 2.16 0.00 36 K 8.72 4.48 0.00 1.77 1.77 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.46 7.81 37 H 9.28 5.14 0.00 3.23 3.37 0.00 5.31 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.28 4.40 0.00 1.73 1.60 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 39 R 8.54 3.90 0.00 1.89 2.04 0.00 3.53 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 40 H 10.82 4.99 0.00 3.18 3.50 0.00 5.97 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 H 8.25 4.15 0.00 2.98 3.01 0.00 5.59 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 6.72 3.34 1.82 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.72 0.93 0.00 0.00 43 T 8.54 4.48 4.28 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 1.31 0.00 0.00 44 A 8.56 4.17 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.31 4.89 0.00 3.01 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 46 G 8.05 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 Y 9.00 4.94 0.00 2.98 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 48 Y 8.13 5.10 0.00 2.93 1.99 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 49 R 8.18 4.31 0.00 1.49 1.62 0.00 2.91 0.00 0.00 2.93 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.50 0.00 50 G 7.74 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.38 3.41 0.00 1.86 1.82 0.00 3.43 0.00 0.00 3.14 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.54 0.00 52 K 7.59 4.12 0.00 1.03 1.35 0.00 1.58 0.00 0.00 1.46 0.00 0.00 2.95 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.30 0.21 7.81 53 V 7.80 3.79 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 0.91 0.00 0.00 0.99 0.00 0.00 54 I 8.35 3.24 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.33 0.90 0.00 0.00 55 A 8.73 3.91 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 56 K 8.56 4.33 0.00 1.94 1.96 0.00 1.50 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.48 7.81