NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5194 8.3049 120.3265 55.2119 32.3870 173.8532 2 N 4.9794 8.0183 118.0279 49.4939 43.0175 172.9114 3 K 4.7337 9.0732 120.7616 56.5217 34.0613 177.3820 4 K 4.2134 8.3836 120.1280 59.3023 32.8029 177.9539 5 N 4.7593 7.9852 112.5675 52.6338 38.8082 174.7963 6 I 4.1164 7.4816 119.7650 59.7419 36.1226 175.3500 7 L 4.2841 8.0295 125.0785 53.7540 42.9951 176.7368 8 P 4.7061 0.0000 0.0000 63.0052 32.0545 177.4851 9 Q 4.2694 8.6326 117.2363 57.3515 28.4869 176.9801 10 Q 3.9088 7.4203 119.2595 53.3385 29.0854 177.2924 11 G 3.8846 8.3342 105.1050 46.7400 0.0000 175.1212 12 Q 3.9732 7.7027 119.6254 58.4800 28.7850 176.7379 13 P 4.4691 0.0000 0.0000 64.1570 31.3826 178.2036 14 V 3.7817 7.5764 117.4212 64.8996 31.1477 177.2794 15 I 4.1407 7.5997 118.9973 63.0474 37.4091 178.2035 16 R 4.0310 7.7075 118.8318 58.8925 30.0715 178.4150 17 L 3.9636 7.9615 120.1272 59.1103 42.2598 178.2776 18 T 3.8380 7.7274 113.7548 67.1077 68.3038 175.7872 19 A 4.3170 8.2499 122.3506 54.3878 18.4621 179.9740 20 G 3.5087 7.7829 104.3417 47.6316 0.0000 175.5516 21 Q 4.1238 8.2987 122.3487 58.9159 28.8233 178.4464 22 L 4.0092 7.5279 118.7477 57.7348 41.5184 178.7976 23 S 4.3602 8.2155 110.7210 59.4649 62.2136 175.1933 24 S 4.3828 7.6694 115.3958 61.4409 62.4851 175.6723 25 Q 4.4462 7.6303 120.1675 57.4095 28.6732 177.5833 26 L 4.3875 7.7631 119.1589 56.0610 42.6085 178.0570 27 A 4.0085 7.4509 119.9119 55.4035 17.9500 179.3042 28 E 3.9644 7.8167 114.3573 58.6620 29.4447 178.2738 29 L 4.4973 7.6417 118.8584 53.1791 42.3910 176.7034 30 S 3.9554 7.7498 112.3109 58.7243 62.6889 173.5283 31 E 4.0158 8.7550 127.1616 56.7868 29.2186 177.2587 32 E 4.2063 8.5183 125.0580 54.4720 28.1723 174.4350 33 A 4.3085 7.7143 122.1429 51.4698 21.0175 176.6925 34 L 4.3682 8.4107 121.6947 55.5735 42.5018 176.9014 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 M 8.30 4.52 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 N 8.02 4.98 0.00 2.72 2.65 0.00 0.00 6.97 6.73 0.00 0.00 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 9.07 4.73 0.00 1.79 1.81 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.29 1.42 7.81 4 K 8.38 4.21 0.00 1.74 1.90 0.00 1.59 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.48 7.81 5 N 7.99 4.76 0.00 2.77 2.90 0.00 0.00 6.00 7.81 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 6 I 7.48 4.12 1.87 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 0.57 0.91 0.00 0.00 7 L 8.03 4.28 0.00 1.61 1.60 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 8 P 0.00 4.71 0.00 2.21 2.11 0.00 3.69 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.98 0.00 9 Q 8.63 4.27 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 7.16 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 10 Q 7.42 3.91 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.89 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 11 G 8.33 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 12 Q 7.70 3.97 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.47 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 13 P 0.00 4.47 0.00 2.15 2.08 0.00 3.54 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 14 V 7.58 3.78 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 1.12 0.00 0.00 0.93 0.00 0.00 15 I 7.60 4.14 1.87 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 1.84 1.30 0.91 0.00 0.00 16 R 7.71 4.03 0.00 1.85 1.96 0.00 3.13 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 17 L 7.96 3.96 0.00 1.94 1.66 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.73 3.84 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 19 A 8.25 4.32 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.78 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.30 4.12 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 22 L 7.53 4.01 0.00 1.77 1.69 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.22 4.36 0.00 3.93 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 S 7.67 4.38 0.00 4.06 4.03 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 0.00 0.00 0.00 25 Q 7.63 4.45 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 26 L 7.76 4.39 0.00 1.68 1.69 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 27 A 7.45 4.01 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.82 3.96 0.00 2.25 2.24 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 2.42 2.40 0.00 29 L 7.64 4.50 0.00 1.64 1.69 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 30 S 7.75 3.96 0.00 4.00 3.82 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 31 E 8.75 4.02 0.00 1.98 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 2.31 2.39 0.00 32 E 8.52 4.21 0.00 1.95 1.91 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 2.28 2.48 0.00 33 A 7.71 4.31 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.41 4.37 0.00 1.59 1.52 0.92 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