NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2850 8.2644 123.5827 51.5952 20.1451 175.6529 3 K 4.4651 7.8731 120.0139 57.3205 36.6813 175.6649 4 H 4.2156 8.2566 112.0395 53.1675 32.0194 175.9224 5 P 4.1553 0.0000 0.0000 64.1644 31.0254 175.1698 6 V 4.5069 8.0092 121.5760 59.9227 34.7422 173.1289 7 P 4.3453 0.0000 0.0000 62.6104 31.8267 176.5546 8 K 4.1070 8.8277 124.8859 58.7690 32.5118 176.9292 9 K 4.5952 7.5383 115.5504 53.6304 35.3565 175.7632 10 K 3.8048 8.6971 123.4655 56.6008 32.1614 176.5014 11 T 3.8779 8.5114 117.5977 61.5185 69.0584 174.3364 12 S 4.3095 8.5815 121.2300 57.8159 63.5747 175.3640 13 K 3.8283 8.7043 120.1560 59.4745 31.5483 178.2212 14 A 4.1174 6.9765 121.4627 54.7319 17.8265 179.2466 15 R 3.8936 7.7786 119.2272 58.4897 30.6936 178.8607 16 R 4.0223 7.8355 118.7192 59.6548 29.7485 178.2454 17 D 4.2896 7.7493 116.8845 57.2019 40.7129 178.3542 18 A 3.8517 7.7290 119.5899 54.2737 18.4436 178.4740 19 R 4.2440 7.3511 115.5888 57.0263 30.8655 177.2950 20 R 3.9077 8.8101 117.7048 56.5211 30.1929 177.9092 21 S 4.1259 7.9610 113.7048 61.5076 62.8754 175.2067 22 H 4.6863 7.9491 115.9052 56.8498 29.1259 176.5443 23 H 4.1591 8.5353 116.4355 57.4342 28.7108 175.6453 24 A 4.0236 7.0367 121.8055 52.4730 18.6938 176.5526 25 L 4.6428 8.1541 121.1477 53.5661 44.2456 175.5230 26 T 4.5993 8.0159 116.0785 58.8760 69.7025 171.8618 27 P 4.2986 0.0000 0.0000 62.1711 31.6135 174.3033 28 P 4.3348 0.0000 0.0000 62.9555 31.7347 175.8996 29 T 4.2518 8.2878 111.8120 61.4550 69.7527 173.7610 30 L 5.0989 8.1310 123.2885 53.3655 46.1187 175.8063 31 V 4.6104 8.7094 113.4969 58.8297 36.2647 173.3700 32 P 4.6298 0.0000 0.0000 62.3926 32.2770 176.0658 33 C 4.0205 8.7804 122.1809 59.7290 28.4265 173.2533 34 P 4.2338 0.0000 0.0000 65.2000 30.8435 176.1017 35 E 4.4800 7.4614 114.3603 58.1027 31.5934 177.4795 36 C 4.4373 7.6515 115.4156 59.6643 29.3437 172.0994 37 K 4.1393 8.5063 119.6292 59.1167 32.9149 177.3227 38 A 4.1130 7.6637 120.2105 51.4184 19.9275 176.0887 39 M 4.7211 8.4504 118.4502 55.1654 33.5034 175.9559 40 K 4.6739 9.4024 122.1819 54.1584 36.3275 173.4500 41 P 4.8371 0.0000 0.0000 62.8940 31.5076 173.6822 42 P 3.9299 0.0000 0.0000 61.9255 32.3865 175.4685 43 H 4.2385 8.7982 117.6111 57.2619 26.0689 174.3316 44 T 4.6097 7.8268 109.1895 60.2912 71.4522 172.2160 45 V 4.3997 8.1702 120.6783 61.4812 33.4283 175.4269 46 C 4.4102 8.5198 127.9594 58.5749 32.1463 171.5301 47 P 4.8947 0.0000 0.0000 62.9884 30.7693 176.8494 48 E 4.8574 8.0502 112.5087 57.2850 32.8538 173.5848 49 C 4.8788 8.1841 117.2882 57.8661 33.0050 175.3956 50 G 4.2762 7.8833 106.4992 45.1917 0.0000 172.7533 51 Y 3.6625 8.0728 126.1314 57.1815 41.4121 175.6675 52 Y 4.7975 7.7348 113.8252 54.6312 37.9855 173.8565 53 A 4.5089 7.1835 131.4717 52.6941 18.5538 177.5881 54 G 4.1318 7.4986 106.9874 43.3092 0.0000 173.1998 55 R 4.4035 7.9807 121.0860 55.2766 28.8315 178.4559 56 K 4.0275 9.1379 115.4945 56.0161 28.8201 176.3240 57 V 3.8951 7.3705 118.9022 61.9013 30.3333 175.7609 58 L 4.3861 8.1375 128.3737 54.3020 42.9474 175.4533 59 E 4.7893 8.1027 117.4565 55.5644 31.1745 176.1205 60 V 3.7806 8.6792 111.1562 62.4731 31.5842 175.8009 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 A 8.26 4.29 1.30 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 3 K 7.87 4.47 0.00 1.72 1.68 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.31 1.55 7.81 4 H 8.26 4.22 0.00 3.22 2.41 0.00 5.81 0.00 0.00 0.00 0.00 7.33 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 4.16 0.00 2.03 2.04 0.00 3.65 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 6 V 8.01 4.51 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 1.02 0.00 0.00 7 P 0.00 4.35 0.00 2.08 1.98 0.00 3.73 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 8 K 8.83 4.11 0.00 1.70 1.83 0.00 1.60 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.52 7.81 9 K 7.54 4.60 0.00 1.73 1.65 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.32 7.81 10 K 8.70 3.80 0.00 1.71 1.75 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.44 7.81 11 T 8.51 3.88 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 12 S 8.58 4.31 0.00 4.02 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 13 K 8.70 3.83 0.00 1.83 1.91 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.45 7.81 14 A 6.98 4.12 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 15 R 7.78 3.89 0.00 1.81 1.97 0.00 3.25 0.00 0.00 3.15 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 16 R 7.84 4.02 0.00 1.94 2.12 0.00 3.14 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 17 D 7.75 4.29 0.00 2.95 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.73 3.85 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.35 4.24 0.00 1.89 2.08 0.00 3.26 0.00 0.00 3.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 20 R 8.81 3.91 0.00 1.84 1.85 0.00 3.33 0.00 0.00 3.16 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.25 0.00 21 S 7.96 4.13 0.00 3.84 3.93 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 22 H 7.95 4.69 0.00 3.28 3.37 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.54 4.16 0.00 3.24 3.39 0.00 5.89 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.04 4.02 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 25 L 8.15 4.64 0.00 1.61 1.56 0.93 0.85 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 26 T 8.02 4.60 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 1.22 0.00 0.00 27 P 0.00 4.30 0.00 2.22 2.07 0.00 3.83 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 28 P 0.00 4.33 0.00 2.20 2.11 0.00 3.76 0.00 0.00 3.71 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 29 T 8.29 4.25 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 1.22 0.00 0.00 30 L 8.13 5.10 0.00 1.49 1.54 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.71 4.61 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 0.83 0.00 0.00 0.97 0.00 0.00 32 P 0.00 4.63 0.00 1.92 1.98 0.00 3.69 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 33 C 8.78 4.02 0.00 3.00 2.96 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 0.00 0.00 0.00 34 P 0.00 4.23 0.00 2.15 2.17 0.00 3.67 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.89 0.00 35 E 7.46 4.48 0.00 2.07 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 2.25 2.40 0.00 36 C 7.65 4.44 0.00 2.95 2.91 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 37 K 8.51 4.14 0.00 1.70 1.80 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.41 7.81 38 A 7.66 4.11 1.30 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 39 M 8.45 4.72 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.48 0.00 40 K 9.40 4.67 0.00 1.72 1.68 0.00 1.63 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.40 7.81 41 P 0.00 4.84 0.00 2.13 2.10 0.00 3.87 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 2.01 2.01 0.00 42 P 0.00 3.93 0.00 2.12 1.95 0.00 3.83 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 43 H 8.80 4.24 0.00 3.36 3.43 0.00 5.64 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 7.83 4.61 4.27 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 1.30 0.00 0.00 45 V 8.17 4.40 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.73 0.00 0.00 46 C 8.52 4.41 0.00 3.01 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 47 P 0.00 4.89 0.00 2.22 2.12 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 48 E 8.05 4.86 0.00 2.00 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 2.20 2.24 0.00 49 C 8.18 4.88 0.00 3.02 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 0.00 0.00 0.00 0.00 50 G 7.88 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 0.00 0.00 0.00 0.00 51 Y 8.07 3.66 0.00 2.64 2.20 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 52 Y 7.73 4.80 0.00 3.06 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.18 4.51 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 7.50 4.13 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 0.00 55 R 7.98 4.40 0.00 1.99 1.30 0.00 2.96 0.00 0.00 3.32 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 56 K 9.14 4.03 0.00 1.90 2.17 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.27 1.32 7.81 57 V 7.37 3.90 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 0.80 0.00 0.00 0.98 0.00 0.00 58 L 8.14 4.39 0.00 1.67 1.64 1.01 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.10 4.79 0.00 2.02 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.28 0.00 60 V 8.68 3.78 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 0.68 0.00 0.00 0.93 0.00 0.00