NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2722 8.1127 120.8600 56.5994 32.2764 177.1750 2 M 3.8642 8.0012 116.8010 56.6951 31.8475 176.7037 3 K 3.9945 8.7503 120.1475 60.0747 33.4686 178.5944 4 Q 3.9812 7.9901 118.9687 58.6577 28.5511 178.8592 5 I 3.7151 8.0415 121.1984 64.4141 37.2396 178.1501 6 E 3.7321 8.0789 119.7997 59.0172 29.4107 178.5421 7 D 4.3865 8.2455 119.5542 56.9631 40.7806 178.5410 8 K 3.9659 7.8264 119.8200 59.1709 32.2454 178.6101 9 L 3.9567 8.6214 120.0103 58.2965 41.6650 179.6351 10 E 4.0567 8.0580 117.4358 59.2112 29.3135 179.0975 11 E 4.0132 8.1726 119.6972 59.0108 29.6503 178.8264 12 I 3.7220 8.0041 120.1886 64.3225 37.1948 178.3929 13 L 3.8733 7.9353 119.8621 57.7192 41.3207 179.7945 14 S 4.3124 8.2886 115.0986 61.7661 62.8718 176.8962 15 K 3.9855 8.2142 121.0587 59.3542 31.6131 179.2477 16 L 3.9559 8.3248 119.7923 58.1581 41.5286 179.2697 17 Y 4.2028 7.9405 116.4739 61.3444 37.8292 177.8155 18 H 4.2394 8.7205 119.4896 59.2240 29.8273 177.3662 19 I 3.6621 8.4353 121.9274 64.5462 37.0351 178.1168 20 E 3.9716 8.4681 119.6087 59.7216 29.1944 179.3306 21 N 4.4490 8.3145 116.3624 56.1061 38.5890 177.4435 22 E 3.9619 8.2272 120.2792 59.1967 29.4598 179.2148 23 L 3.9875 8.3154 119.3158 57.7259 41.6520 179.4598 24 A 4.0036 8.0300 120.7694 55.0552 18.2764 179.6878 25 R 3.8913 8.3888 117.6672 59.5056 30.0960 178.9051 26 I 3.7408 7.7186 119.9314 63.9867 37.1548 178.2381 27 K 3.9336 8.4162 121.0120 59.2845 31.7844 178.8064 28 K 3.9249 8.0871 119.9151 59.5254 31.7994 178.7188 29 L 4.0040 8.0895 119.3420 57.9505 41.3314 179.5805 30 L 4.0582 7.9079 117.8544 57.3066 41.6579 179.2731 31 G 3.7727 7.9415 104.7665 46.1931 0.0000 174.4874 32 E 4.5886 7.7277 117.5144 55.9938 30.4977 176.0960 33 R 4.2017 7.3716 121.6232 56.4033 29.6068 175.4494 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 R 8.11 4.27 0.00 1.86 1.99 0.00 3.16 0.00 0.00 3.33 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 2 M 8.00 3.86 0.00 2.25 2.06 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.72 0.00 3 K 8.75 3.99 0.00 2.07 2.05 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.59 7.81 4 Q 7.99 3.98 0.00 2.38 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.95 0.00 0.00 0.00 0.00 0.00 2.45 2.03 0.00 5 I 8.04 3.72 2.07 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.04 0.91 0.00 0.00 6 E 8.08 3.73 0.00 2.27 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 7 D 8.25 4.39 0.00 2.89 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 7.83 3.97 0.00 1.99 1.88 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.47 7.81 9 L 8.62 3.96 0.00 1.82 1.72 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.06 4.06 0.00 2.15 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 0.00 2.52 2.48 0.00 11 E 8.17 4.01 0.00 2.19 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 0.00 2.31 2.35 0.00 12 I 8.00 3.72 2.03 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 1.51 0.58 0.88 0.00 0.00 13 L 7.94 3.87 0.00 1.71 1.69 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.29 4.31 0.00 4.02 3.98 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 0.00 0.00 0.00 15 K 8.21 3.99 0.00 1.96 1.88 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.70 7.81 16 L 8.32 3.96 0.00 1.59 1.56 0.82 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 17 Y 7.94 4.20 0.00 3.17 2.84 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 0.00 0.00 0.00 18 H 8.72 4.24 0.00 3.26 3.54 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 I 8.44 3.66 2.02 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 1.53 0.69 0.91 0.00 0.00 20 E 8.47 3.97 0.00 2.36 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 0.00 2.34 2.44 0.00 21 N 8.31 4.45 0.00 2.79 2.86 0.00 0.00 7.02 7.75 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 22 E 8.23 3.96 0.00 2.13 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 2.24 2.22 0.00 23 L 8.32 3.99 0.00 1.81 1.71 0.92 0.95 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 24 A 8.03 4.00 1.40 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 25 R 8.39 3.89 0.00 1.99 2.07 0.00 3.09 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 26 I 7.72 3.74 2.01 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 1.40 0.57 0.91 0.00 0.00 27 K 8.42 3.93 0.00 1.87 2.01 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.45 7.81 28 K 8.09 3.92 0.00 2.06 1.95 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.43 1.35 7.81 29 L 8.09 4.00 0.00 1.91 1.70 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.91 4.06 0.00 1.63 1.73 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 31 G 7.94 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 7.73 4.59 0.00 2.36 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.15 0.00 33 R 7.37 4.20 0.00 2.01 2.09 0.00 3.21 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.40 0.00