NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3155 8.1631 117.3742 62.9960 69.9257 173.4674 2 G 3.4904 8.5015 114.9620 45.1726 0.0000 172.0981 3 A 4.3811 8.1096 124.8635 52.7617 21.2088 176.8953 4 G 4.3531 7.4670 112.4092 44.8056 0.0000 175.8647 5 T 3.8284 8.7535 120.3649 66.2053 68.5705 173.7398 6 P 4.4436 0.0000 0.0000 65.9499 30.9315 177.7899 7 S 4.3643 8.2185 113.3576 59.5289 63.1588 175.7007 8 Q 4.2459 8.5808 120.7295 57.9084 28.2743 178.2075 9 G 3.6842 7.4585 105.9875 47.3707 0.0000 175.0570 10 K 4.4329 7.8051 117.3395 56.2109 33.4428 178.1522 11 K 4.3899 7.4866 121.0510 55.1546 30.3105 176.0522 12 N 5.0660 8.0350 119.8640 52.4713 38.3436 174.9302 13 T 4.4628 7.9083 114.9134 63.1020 70.1482 174.3205 14 T 4.3595 8.3792 123.2091 62.7409 69.1269 172.6278 15 T 4.2893 7.6373 115.2289 62.9356 71.3883 172.9647 16 H 5.0067 8.2077 119.5496 55.0740 29.9963 174.7882 17 T 4.8061 9.9128 113.6638 58.8944 72.7936 173.1014 18 K 4.1901 8.7923 123.0023 57.4859 32.7345 175.3808 19 C 4.1794 9.2840 128.9468 58.7418 32.1345 174.1213 20 R 3.6582 8.3777 126.8252 59.4852 29.9475 177.6081 21 R 3.6504 7.1672 116.4540 58.7904 30.0980 176.5936 22 C 4.3948 7.8768 108.6959 57.3751 30.6974 174.5660 23 G 3.8965 8.1095 108.7229 45.4268 0.0000 173.3148 24 E 4.3381 7.6117 119.1728 54.7635 31.3143 176.3630 25 K 4.5919 8.1985 124.9716 55.9954 29.8975 176.5009 26 S 4.7611 7.8565 113.8997 57.8547 66.2989 174.1451 27 Y 4.4630 9.0855 123.7147 57.4944 39.1418 174.4169 28 H 4.5052 8.8940 128.9075 55.8193 29.1748 175.3579 29 T 3.4054 8.7850 121.8987 64.5719 67.1763 175.3127 30 K 4.1538 8.1030 119.8095 58.8388 32.4979 178.0415 31 K 4.0656 8.0363 115.7949 56.1101 32.8879 176.5093 32 K 3.1943 8.8352 118.7343 56.7203 30.0888 175.1354 33 V 4.7424 6.8017 116.5907 61.5542 35.8005 173.1825 34 C 5.3017 9.5331 129.3253 58.8196 32.2992 174.1583 35 S 4.4226 8.9339 120.7616 60.3473 62.9025 175.1042 36 S 4.5553 8.3946 114.5956 59.9963 63.1711 174.3003 37 C 4.4132 8.2092 113.2078 57.8641 30.7563 175.0939 38 G 4.0209 8.3996 109.0124 44.6323 0.0000 172.9473 39 F 4.3444 8.1721 122.2132 60.2033 39.4913 175.6831 40 G 3.9592 8.6956 115.4100 45.9155 0.0000 173.6718 41 K 4.3524 8.3571 118.6939 56.8249 34.3171 176.1577 42 S 4.6626 7.7723 110.6994 56.0160 65.2624 173.3486 43 A 4.1732 8.7594 130.2879 55.0901 18.4991 178.4548 44 K 4.2493 7.7111 113.5881 55.9835 32.9097 176.9932 45 R 4.2749 8.2680 121.4752 55.8498 30.7750 176.5740 46 R 3.8478 8.9398 125.2349 57.0231 30.4760 175.2150 47 D 4.4892 7.5579 122.7908 53.8418 44.2279 174.0761 48 Y 4.4318 8.5430 121.3588 56.0341 41.5663 176.4266 49 E 4.0393 8.5791 121.7188 58.5684 29.8621 178.4973 50 W 4.6687 7.6043 113.7878 57.1787 28.5400 176.8942 51 Q 4.3286 7.5489 117.9235 57.4980 28.3350 175.2906 52 S 4.7960 7.4865 110.5585 55.8607 66.6726 173.7062 53 K 4.1408 8.5218 119.3327 56.0803 32.4831 178.1553 54 A 4.0095 8.7654 126.7729 55.2864 18.3684 179.5826 55 G 4.1765 7.7509 102.7348 44.6905 0.0000 173.2204 56 E 4.1951 8.2220 125.8061 56.3117 29.8791 174.1628 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 T 8.16 4.32 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 2 G 8.50 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.11 4.38 1.28 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 0.00 0.00 0.00 0.00 0.00 0.00 4 G 7.47 4.35 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 0.00 5 T 8.75 3.83 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 6 P 0.00 4.44 0.00 2.21 2.33 0.00 3.60 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 2.19 2.01 0.00 7 S 8.22 4.36 0.00 4.22 3.93 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.58 4.25 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.63 2.51 0.00 9 G 7.46 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 K 7.81 4.43 0.00 1.74 1.86 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.52 7.81 11 K 7.49 4.39 0.00 1.78 1.77 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.46 7.81 12 N 8.03 5.07 0.00 2.77 2.82 0.00 0.00 6.27 7.71 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 13 T 7.91 4.46 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 14 T 8.38 4.36 4.23 0.00 0.00 0.00 0.00 0.00 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 15 T 7.64 4.29 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 1.09 0.00 0.00 16 H 8.21 5.01 0.00 3.08 3.47 0.00 5.64 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 9.91 4.81 4.35 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 1.32 0.00 0.00 18 K 8.79 4.19 0.00 1.80 1.82 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.52 7.81 19 C 9.28 4.18 0.00 3.12 2.88 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 20 R 8.38 3.66 0.00 1.45 1.30 0.00 3.10 0.00 0.00 3.08 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.49 0.00 21 R 7.17 3.65 0.00 0.67 1.46 0.00 3.31 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.40 0.00 22 C 7.88 4.39 0.00 3.07 2.98 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 23 G 8.11 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 24 E 7.61 4.34 0.00 1.94 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 2.37 2.26 0.00 25 K 8.20 4.59 0.00 1.80 1.77 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.52 7.81 26 S 7.86 4.76 0.00 3.87 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 9.09 4.46 0.00 3.06 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.89 4.51 0.00 3.22 3.07 0.00 5.85 0.00 0.00 0.00 0.00 6.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.78 3.41 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 30 K 8.10 4.15 0.00 1.89 1.85 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.38 7.81 31 K 8.04 4.07 0.00 1.54 1.72 0.00 1.58 0.00 0.00 1.54 0.00 0.00 2.42 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.22 0.91 7.81 32 K 8.84 3.19 0.00 1.69 1.88 0.00 1.73 0.00 0.00 1.43 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.28 1.48 7.81 33 V 6.80 4.74 2.02 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 0.98 0.00 0.00 0.96 0.00 0.00 34 C 9.53 5.30 0.00 3.40 3.19 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 0.00 0.00 0.00 0.00 35 S 8.93 4.42 0.00 4.05 4.10 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 0.00 0.00 0.00 0.00 36 S 8.39 4.56 0.00 3.91 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 C 8.21 4.41 0.00 3.17 3.19 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 0.00 0.00 0.00 0.00 38 G 8.40 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 0.00 0.00 0.00 39 F 8.17 4.34 0.00 3.08 3.10 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 0.00 0.00 0.00 0.00 40 G 8.70 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.36 4.35 0.00 1.64 1.98 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.34 7.81 42 S 7.77 4.66 0.00 3.83 3.71 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 43 A 8.76 4.17 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 K 7.71 4.25 0.00 1.74 1.72 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.45 7.81 45 R 8.27 4.27 0.00 1.65 1.83 0.00 3.37 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 46 R 8.94 3.85 0.00 1.89 1.98 0.00 3.44 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 47 D 7.56 4.49 0.00 2.49 2.21 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 48 Y 8.54 4.43 0.00 1.43 1.51 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 49 E 8.58 4.04 0.00 2.05 2.02 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 2.36 2.25 0.00 50 W 7.60 4.67 0.00 3.45 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Q 7.55 4.33 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.73 0.00 0.00 0.00 0.00 0.00 1.90 1.64 0.00 52 S 7.49 4.80 0.00 3.96 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 K 8.52 4.14 0.00 1.83 1.79 0.00 1.75 0.00 0.00 1.86 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.40 7.81 54 A 8.77 4.01 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.75 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.22 4.20 0.00 1.92 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 2.23 2.26 0.00