NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3234 8.2644 123.5879 52.5073 19.0221 175.7247 3 R 4.1815 7.9708 118.8961 54.7046 30.1018 173.9745 4 K 3.9798 7.9995 117.8239 56.4095 31.7967 176.8522 5 A 3.4445 7.9520 125.3932 55.3291 18.6622 178.1266 6 L 4.6383 7.7716 113.7071 55.1607 41.7463 176.6946 7 I 4.4654 8.6040 120.5869 61.4236 37.2038 176.4549 8 E 4.4117 8.0575 116.5594 56.5644 29.5818 178.2184 9 K 3.5013 7.6202 123.0357 59.5600 32.4743 178.2249 10 A 4.0071 7.8950 121.0302 54.5388 18.3383 178.6517 11 K 3.9260 7.4606 113.8796 56.5556 33.2696 180.0664 12 R 3.0768 8.4955 116.1625 57.6254 31.1535 176.5979 13 T 3.8119 8.8655 117.7456 63.6600 68.9904 171.3559 14 P 4.6727 0.0000 0.0000 61.5727 33.3835 175.0918 15 K 3.9773 8.2299 119.5900 56.5566 28.9449 176.3597 16 F 4.9961 7.6058 116.4873 55.3377 42.8761 175.4854 17 K 4.0307 9.0289 124.6950 59.0687 32.6197 178.9963 18 V 3.5953 8.0456 119.2310 66.4464 31.4254 177.1098 19 R 4.2526 8.1085 113.9638 56.9500 29.6758 176.3498 20 A 4.3582 7.6622 122.4347 51.4804 19.3107 177.0040 21 Y 4.9509 7.6922 120.1443 55.1552 40.8928 174.7555 22 T 3.0624 8.0136 106.0667 60.9238 69.8269 170.4395 23 R 4.3470 8.4873 125.6613 54.8743 30.5428 175.8840 24 C 4.4518 8.6060 123.2706 59.4554 32.3661 174.1941 25 V 4.0522 8.4186 129.2807 60.7767 31.2863 175.3496 26 R 4.6859 7.7394 121.9796 58.0961 37.4123 174.5112 27 C 4.5183 8.2984 110.2379 58.0164 31.3097 174.6325 28 G 4.0021 8.0946 105.6203 44.4217 0.0000 173.4891 29 R 3.7724 8.1077 119.8896 57.2559 30.3590 176.5729 30 A 5.0377 8.2876 130.4946 50.7771 19.4674 175.8307 31 R 4.5376 8.0255 118.4492 57.0389 33.3596 173.7203 32 S 3.7174 8.5608 115.4582 59.1290 62.0932 172.6416 33 V 4.6091 7.6967 121.5482 61.2656 30.3097 175.0449 34 Y 4.2747 8.8737 124.5047 58.8923 38.6598 177.9250 35 R 4.0821 8.6339 119.0490 58.6509 30.9680 178.8138 36 F 4.0431 8.4890 117.2039 59.9624 39.5480 175.2556 37 F 4.6910 8.6800 116.0649 56.4740 41.4657 176.1118 38 G 4.0984 7.9647 108.7154 45.9624 0.0000 173.1128 39 L 4.9865 7.6106 118.2276 52.8127 44.3668 175.3803 40 C 5.0806 8.1096 114.7144 56.5590 31.2194 174.8833 41 R 3.7171 8.5894 118.5231 59.2932 28.4588 179.0791 42 I 3.6861 7.5376 120.0936 64.2061 37.4780 177.6953 43 C 4.2901 7.8181 118.3201 62.2057 28.2063 175.3656 44 L 3.5242 7.6481 121.9771 58.2910 41.3891 179.2582 45 R 3.7066 7.2406 117.7488 60.0217 29.8361 177.5928 46 E 3.9358 8.4118 118.6225 59.3776 29.2605 179.0689 47 L 3.9961 8.5069 118.2339 58.2332 41.8560 179.4575 48 A 3.8923 7.4173 118.4422 55.9825 18.3022 179.2979 49 H 4.2695 7.9632 112.6729 58.8036 28.7060 177.3154 50 K 4.3086 9.0169 121.6960 56.6522 32.3128 177.7511 51 G 4.4740 7.8331 118.7203 46.4630 0.0000 173.7896 52 Q 4.1734 7.8287 118.9723 57.4136 29.0468 176.6288 53 L 4.7382 7.5795 119.8474 51.3462 41.6426 173.0907 54 P 4.1755 0.0000 0.0000 64.4137 31.6906 175.9323 55 G 4.2358 9.1326 114.2443 45.7518 0.0000 172.4185 56 V 3.5179 6.7976 122.1647 62.7272 30.8839 174.6219 57 R 4.5566 8.0691 126.8958 53.8885 32.5878 174.8970 58 K 4.2276 8.3984 118.4327 55.1458 31.9170 177.0173 59 A 4.3447 8.4883 127.8141 52.2420 19.1079 176.4367 60 S 4.7066 8.5036 115.0191 57.1853 65.5273 174.2816 61 W 4.4908 8.3175 123.1519 57.2963 27.2202 174.0479 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 4.32 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 3 R 7.97 4.18 0.00 1.88 1.93 0.00 3.39 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.73 0.00 4 K 8.00 3.98 0.00 2.00 1.80 0.00 1.77 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.37 7.81 5 A 7.95 3.44 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 6 L 7.77 4.64 0.00 1.70 1.78 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.60 4.47 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.03 0.91 0.00 0.00 8 E 8.06 4.41 0.00 2.14 2.30 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 2.41 2.30 0.00 9 K 7.62 3.50 0.00 1.17 1.68 0.00 1.73 0.00 0.00 1.57 0.00 0.00 3.27 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.93 1.37 7.81 10 A 7.90 4.01 1.28 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 11 K 7.46 3.93 0.00 1.71 1.92 0.00 1.91 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.62 1.35 7.81 12 R 8.50 3.08 0.00 1.86 1.64 0.00 3.49 0.00 0.00 3.19 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 13 T 8.87 3.81 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 14 P 0.00 4.67 0.00 2.15 2.19 0.00 3.68 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 15 K 8.23 3.98 0.00 1.28 0.74 0.00 1.55 0.00 0.00 1.41 0.00 0.00 2.91 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.90 1.06 7.81 16 F 7.61 5.00 0.00 3.12 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.03 4.03 0.00 1.97 2.13 0.00 1.54 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.50 7.81 18 V 8.05 3.60 2.19 0.00 0.00 0.00 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 0.97 0.00 0.00 19 R 8.11 4.25 0.00 1.97 2.10 0.00 3.35 0.00 0.00 3.35 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.82 0.00 20 A 7.66 4.36 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 21 Y 7.69 4.95 0.00 3.01 2.85 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 22 T 8.01 3.06 4.34 0.00 0.00 0.00 0.00 0.00 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 23 R 8.49 4.35 0.00 2.03 2.11 0.00 3.47 0.00 0.00 3.45 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.54 0.00 24 C 8.61 4.45 0.00 3.14 2.94 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 25 V 8.42 4.05 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 0.80 0.00 0.00 0.95 0.00 0.00 26 R 7.74 4.69 0.00 1.76 1.92 0.00 3.20 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 27 C 8.30 4.52 0.00 3.10 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 28 G 8.09 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 29 R 8.11 3.77 0.00 1.93 1.91 0.00 3.22 0.00 0.00 3.36 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.85 0.00 30 A 8.29 5.04 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 31 R 8.03 4.54 0.00 1.76 1.79 0.00 3.38 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 32 S 8.56 3.72 0.00 4.27 4.14 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.70 4.61 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.10 0.00 0.00 34 Y 8.87 4.27 0.00 3.20 3.20 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 35 R 8.63 4.08 0.00 1.98 2.04 0.00 3.18 0.00 0.00 3.31 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 36 F 8.49 4.04 0.00 3.03 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.68 4.69 0.00 3.24 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 38 G 7.96 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.61 4.99 0.00 1.82 1.54 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.11 5.08 0.00 3.14 3.09 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 0.00 0.00 0.00 0.00 41 R 8.59 3.72 0.00 2.06 2.53 0.00 2.78 0.00 0.00 3.22 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 42 I 7.54 3.69 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.71 0.90 0.00 0.00 43 C 7.82 4.29 0.00 2.92 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 44 L 7.65 3.52 0.00 1.32 1.50 0.31 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.24 3.71 0.00 1.79 2.13 0.00 3.15 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 1.70 1.66 0.00 46 E 8.41 3.94 0.00 2.12 1.90 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 2.33 2.59 0.00 47 L 8.51 4.00 0.00 1.62 1.73 0.93 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.42 3.89 1.28 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 49 H 7.96 4.27 0.00 3.39 3.35 0.00 5.65 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.02 4.31 0.00 1.89 1.79 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.60 7.81 51 G 7.83 4.47 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 0.00 52 Q 7.83 4.17 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.02 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 53 L 7.58 4.74 0.00 1.70 1.87 0.43 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.18 0.00 2.22 2.13 0.00 3.94 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.03 0.00 55 G 9.13 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 0.00 0.00 0.00 0.00 56 V 6.80 3.52 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 1.33 0.00 0.00 57 R 8.07 4.56 0.00 1.95 1.84 0.00 3.30 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 58 K 8.40 4.23 0.00 1.81 1.78 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.39 7.81 59 A 8.49 4.34 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.50 4.71 0.00 3.85 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 W 8.32 4.49 0.00 3.33 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00