NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2563 8.1727 121.7885 56.5532 34.3504 177.6290 3 V 3.4270 7.7532 117.8449 65.4997 31.5346 176.4485 4 K 3.9680 8.7819 119.0574 59.5969 32.3847 178.7876 5 Q 4.0236 7.9995 117.8084 58.9747 28.6444 178.6589 6 L 4.0238 8.0499 120.0229 57.7892 41.6432 179.3536 7 E 3.9450 8.5323 118.9635 59.4652 29.2756 178.9216 8 D 4.3599 7.9704 117.6503 56.8766 41.2071 178.3700 9 V 3.5606 7.9105 119.0584 65.9389 31.5844 178.0893 10 V 3.5706 7.9423 117.9063 66.2051 31.5299 177.7788 11 E 3.9609 8.1846 118.2098 59.4992 29.4185 179.0882 12 E 4.0531 8.5985 119.6559 59.1425 29.6834 178.8323 13 L 4.1001 8.2467 119.1856 57.3833 41.5424 179.2307 14 L 4.0275 7.7875 119.2494 58.0800 41.4553 179.7543 15 S 4.1913 7.6720 114.0916 61.3469 62.7236 176.8206 16 V 3.6637 7.6661 120.5625 66.2976 31.3201 177.9600 17 N 4.3820 8.3816 116.2015 56.2091 38.3589 176.7651 18 Y 4.0481 8.2637 121.0824 61.1417 38.9110 177.9223 19 H 3.9377 8.5699 117.2341 58.8724 28.7315 177.8019 20 L 3.9715 8.1105 120.6737 57.7719 41.3899 179.2219 21 E 3.9056 8.5215 118.9132 59.6480 29.3867 179.2060 22 N 4.1505 7.8719 116.2066 56.1971 38.4848 177.6484 23 V 3.5068 7.6071 119.4930 65.9367 31.6067 178.1125 24 V 3.5212 8.0027 118.0306 66.0877 31.4857 177.7582 25 A 3.9447 8.1203 120.4981 55.1823 18.1708 179.6418 26 R 3.8433 8.1565 117.2584 59.5113 30.1259 178.7692 27 L 4.0050 8.1479 119.0070 57.6067 41.6032 179.5108 28 K 3.9448 8.2806 118.9165 59.4401 31.6677 179.5037 29 K 4.2206 7.9933 118.5528 59.5087 32.3102 179.1644 30 L 3.9331 7.6224 120.9966 58.2337 42.2385 179.0970 31 V 3.8889 7.9891 110.5128 62.3296 31.5671 177.1006 32 G 3.8807 7.5768 107.0479 45.5971 0.0000 173.1522 33 E 4.1519 8.4448 126.2234 55.9149 29.5682 175.7015 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 K 8.17 4.26 0.00 1.80 1.87 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.44 7.81 3 V 7.75 3.43 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 1.08 0.00 0.00 0.93 0.00 0.00 4 K 8.78 3.97 0.00 1.80 1.84 0.00 1.74 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.47 7.81 5 Q 8.00 4.02 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 6 L 8.05 4.02 0.00 1.92 1.72 0.92 0.71 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 7 E 8.53 3.94 0.00 2.17 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 2.33 2.50 0.00 8 D 7.97 4.36 0.00 2.81 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 9 V 7.91 3.56 2.26 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 0.94 0.00 0.00 1.00 0.00 0.00 10 V 7.94 3.57 2.22 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 0.98 0.00 0.00 1.00 0.00 0.00 11 E 8.18 3.96 0.00 2.17 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 12 E 8.60 4.05 0.00 2.09 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 2.32 2.37 0.00 13 L 8.25 4.10 0.00 1.89 1.72 0.93 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 14 L 7.79 4.03 0.00 1.86 1.73 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 15 S 7.67 4.19 0.00 4.22 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 16 V 7.67 3.66 2.29 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 1.06 0.00 0.00 1.03 0.00 0.00 17 N 8.38 4.38 0.00 2.83 2.88 0.00 0.00 6.72 7.10 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 18 Y 8.26 4.05 0.00 3.07 3.17 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 19 H 8.57 3.94 0.00 3.38 3.30 0.00 5.68 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.11 3.97 0.00 1.84 1.71 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.52 3.91 0.00 2.02 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 2.32 2.64 0.00 22 N 7.87 4.15 0.00 2.73 2.71 0.00 0.00 6.70 7.28 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 23 V 7.61 3.51 2.22 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 1.05 0.00 0.00 0.97 0.00 0.00 24 V 8.00 3.52 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 1.01 0.00 0.00 0.98 0.00 0.00 25 A 8.12 3.94 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 26 R 8.16 3.84 0.00 1.97 2.02 0.00 3.08 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 27 L 8.15 4.00 0.00 1.83 1.69 0.91 0.90 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 28 K 8.28 3.94 0.00 2.02 2.01 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.56 7.81 29 K 7.99 4.22 0.00 2.01 2.06 0.00 1.30 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.67 1.55 7.81 30 L 7.62 3.93 0.00 1.77 1.90 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 31 V 7.99 3.89 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 0.82 0.00 0.00 1.04 0.00 0.00 32 G 7.58 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.44 4.15 0.00 1.88 1.82 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 2.27 2.23 0.00