NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6576 8.3649 120.5307 54.2193 41.8046 174.5251 2 I 4.4557 7.8553 124.7092 57.8010 40.3608 173.3363 3 S 4.4445 8.7866 116.6860 58.8413 65.8845 174.3515 4 G 3.8781 8.8856 107.3162 46.4928 0.0000 173.2814 5 I 4.5000 7.7545 119.4924 58.9460 39.6049 174.7972 6 N 4.8571 8.5106 122.6883 51.9377 41.9079 173.1637 7 A 4.4475 8.4700 128.3084 51.3282 20.0515 177.0227 8 S 4.6122 8.3988 118.3358 57.5402 64.3738 174.0613 9 V 4.3512 8.0106 121.7162 60.1048 33.1967 175.7155 10 V 4.2734 7.9728 120.5977 60.2269 33.3921 175.4005 11 N 4.8004 8.4064 119.1691 52.4602 40.3455 173.7206 12 I 5.1325 7.9704 120.7479 59.2476 38.5641 177.8114 13 Q 3.9666 8.4271 124.4425 59.9805 28.8392 176.9575 14 K 3.9475 8.0107 120.3516 59.5423 32.3475 178.4676 15 E 3.9973 8.1126 118.3920 59.4240 29.3984 179.2882 16 I 3.7680 7.7089 119.9038 64.3342 37.1188 178.1251 17 D 4.3521 8.4597 120.2161 57.5049 40.7061 178.9144 18 R 3.8798 8.0469 119.0771 59.3725 30.0060 178.5842 19 L 4.0720 8.0398 118.9274 57.8421 41.6250 179.2175 20 N 4.3867 7.9900 116.1514 55.9934 38.3622 177.1972 21 E 3.9174 8.4397 121.1796 59.1180 29.7315 178.9575 22 V 3.5392 8.3936 118.4468 65.9732 31.3721 177.6965 23 A 3.9937 7.8825 119.2204 55.2225 18.6054 179.5335 24 K 4.0774 8.0277 116.7410 59.7856 32.1031 179.3489 25 N 4.3680 8.4465 116.9361 56.3531 38.3450 177.2687 26 L 4.0380 8.0143 119.8235 57.0452 41.3820 178.7363 27 N 4.2857 8.0683 116.7244 56.5476 38.2349 176.6485 28 E 4.1051 8.2797 118.5320 58.2669 29.6482 178.2584 29 S 4.5375 7.9429 114.0086 57.7296 63.8014 174.4465 30 L 4.2038 6.9905 122.1190 54.5381 42.0613 176.2389 31 I 4.2818 7.9757 122.3448 59.5047 39.1133 175.5463 32 D 4.5265 8.4918 124.9110 53.2217 39.9119 176.2949 33 L 3.9894 8.4413 127.3669 57.1157 42.0701 177.9166 34 Q 4.2022 7.8966 121.3772 55.9445 28.7381 175.3586 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 D 8.36 4.66 0.00 2.68 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.86 4.46 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 1.47 0.23 0.91 0.00 0.00 3 S 8.79 4.44 0.00 3.92 3.78 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 4 G 8.89 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 5 I 7.75 4.50 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 1.30 0.94 0.91 0.00 0.00 6 N 8.51 4.86 0.00 2.60 2.63 0.00 0.00 7.14 7.96 0.00 0.00 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 A 8.47 4.45 1.24 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 8 S 8.40 4.61 0.00 3.87 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 9 V 8.01 4.35 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 0.76 0.00 0.00 0.93 0.00 0.00 10 V 7.97 4.27 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 0.73 0.00 0.00 0.93 0.00 0.00 11 N 8.41 4.80 0.00 2.63 2.71 0.00 0.00 6.80 7.94 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 12 I 7.97 5.13 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 1.28 1.74 0.91 0.00 0.00 13 Q 8.43 3.97 0.00 2.33 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 14 K 8.01 3.95 0.00 1.83 1.79 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.48 7.81 15 E 8.11 4.00 0.00 2.25 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 2.40 2.46 0.00 16 I 7.71 3.77 1.99 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 1.52 1.29 0.91 0.00 0.00 17 D 8.46 4.35 0.00 2.83 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.05 3.88 0.00 1.94 2.12 0.00 3.14 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 19 L 8.04 4.07 0.00 1.91 1.70 0.92 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 20 N 7.99 4.39 0.00 2.84 2.86 0.00 0.00 6.64 8.76 0.00 0.00 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 E 8.44 3.92 0.00 2.02 2.09 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 2.30 2.31 0.00 22 V 8.39 3.54 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 0.95 0.00 0.00 0.95 0.00 0.00 23 A 7.88 3.99 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.03 4.08 0.00 1.97 1.87 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.59 7.81 25 N 8.45 4.37 0.00 2.96 2.88 0.00 0.00 7.09 7.51 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 26 L 8.01 4.04 0.00 1.86 1.71 0.92 0.66 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 27 N 8.07 4.29 0.00 2.92 2.89 0.00 0.00 6.84 7.01 0.00 0.00 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 8.28 4.11 0.00 1.96 2.01 0.00 0.00 0.00 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 2.54 0.00 29 S 7.94 4.54 0.00 3.98 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 30 L 6.99 4.20 0.00 1.72 1.60 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.98 4.28 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 1.30 0.56 0.91 0.00 0.00 32 D 8.49 4.53 0.00 2.67 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.44 3.99 0.00 1.67 1.76 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.90 4.20 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.55 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00