NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2700 8.2993 121.7865 56.2869 32.2023 174.6835 2 V 3.5212 7.7106 124.2729 59.5969 32.3533 175.4828 3 G 3.6563 8.5416 111.2652 45.7187 0.0000 174.7805 4 R 3.7373 8.6628 128.0790 59.0943 30.1083 177.2675 5 N 4.6652 8.1248 113.1005 53.9394 39.6069 173.3945 6 D 5.0351 8.9060 119.0213 52.1314 43.7796 173.3541 7 P 4.3887 0.0000 0.0000 63.2987 31.5569 175.1088 8 C 4.0447 8.8629 124.8310 59.1986 31.8824 173.1957 9 P 4.3514 0.0000 0.0000 65.3168 31.0307 177.1438 10 C 4.0589 7.9726 113.5293 59.5417 29.3523 174.0914 11 G 3.8272 8.0478 107.4992 46.6038 0.0000 174.9790 12 S 4.3591 9.0932 116.6714 60.9433 63.5757 174.5376 13 G 3.5426 7.7890 112.1961 45.3259 0.0000 173.7141 14 K 4.3565 7.6574 120.3788 54.8397 33.4665 176.5761 15 K 4.6110 8.3833 121.4965 56.3019 32.4405 176.3455 16 Y 4.3236 8.0942 119.8281 61.4639 38.8765 178.6388 17 K 3.9468 8.1331 120.6291 59.6398 32.7678 177.6951 18 Q 4.3770 7.8107 116.7668 56.0967 28.2146 175.2334 19 C 4.7500 8.0268 117.9052 60.0342 37.8171 174.4557 20 H 4.4374 8.1773 115.0720 57.9086 29.4679 177.9051 21 G 3.4463 7.1395 106.3777 48.0924 0.0000 173.2538 22 R 4.0994 7.2916 121.3433 56.2361 30.1525 176.0949 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 K 8.30 4.27 0.00 1.74 1.82 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.46 7.81 2 V 7.71 3.52 1.75 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 -0.60 0.00 0.00 0.61 0.00 0.00 3 G 8.54 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 R 8.66 3.74 0.00 1.98 2.06 0.00 3.26 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.94 0.00 5 N 8.12 4.67 0.00 2.74 2.81 0.00 0.00 6.83 8.48 0.00 0.00 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 D 8.91 5.04 0.00 2.57 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 P 0.00 4.39 0.00 2.10 2.12 0.00 3.85 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 8 C 8.86 4.04 0.00 3.29 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 9 P 0.00 4.35 0.00 2.19 2.11 0.00 3.94 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.84 0.00 10 C 7.97 4.06 0.00 3.12 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 11 G 8.05 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 9.09 4.36 0.00 3.89 3.94 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 13 G 7.79 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.66 4.36 0.00 1.85 1.77 0.00 1.82 0.00 0.00 1.82 0.00 0.00 3.13 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.46 7.81 15 K 8.38 4.61 0.00 1.90 2.02 0.00 1.60 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.70 1.52 7.81 16 Y 8.09 4.32 0.00 3.01 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 17 K 8.13 3.95 0.00 1.91 1.97 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.54 7.81 18 Q 7.81 4.38 0.00 2.32 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 19 C 8.03 4.75 0.00 2.98 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 20 H 8.18 4.44 0.00 2.96 3.04 0.00 5.72 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 7.14 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.29 4.10 0.00 1.92 1.80 0.00 3.34 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.82 0.00