NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9937 8.3549 109.7386 45.6923 0.0000 172.5619 3 T 4.5752 8.1431 114.5245 59.9569 71.8245 172.3020 4 T 4.6066 8.9864 115.2513 60.0741 72.6786 173.2657 5 T 4.2745 8.4189 120.9116 62.8026 68.7967 174.2419 6 M 4.3089 8.5084 127.1773 54.0915 33.0433 176.2066 7 G 3.8281 8.6119 113.4281 44.5368 0.0000 173.0582 8 V 4.1948 8.3864 127.1120 60.1707 33.0626 175.8642 9 K 4.3603 8.5784 126.9544 53.2918 32.1962 172.4738 10 L 4.9058 8.1294 123.9154 51.0504 45.4152 176.9566 11 D 4.5926 8.3590 121.7956 53.2795 41.5576 177.2877 12 D 4.3599 8.6594 120.3717 57.3271 40.7914 178.8529 13 A 3.9789 8.0017 120.9253 55.5936 18.3194 179.6059 14 T 3.7682 8.2717 114.0612 66.8214 68.4566 176.7173 15 R 3.8543 7.9029 120.5018 59.5375 29.9252 178.1458 16 E 3.9213 8.4529 119.1344 59.2407 29.5593 179.0048 17 R 3.9120 8.0034 118.1750 59.2194 30.0802 179.0438 18 I 3.7009 7.9811 119.7118 64.3966 37.1333 178.5942 19 K 3.9823 8.2692 119.4069 59.6629 32.0165 179.6587 20 S 4.1105 8.3951 115.3539 61.5295 62.6255 176.6732 21 A 4.0146 8.3188 123.4633 55.0055 18.1201 179.5607 22 A 3.9995 8.4551 119.7643 55.6978 18.5908 179.9641 23 T 3.8224 8.1024 114.2900 66.9207 68.2715 177.0864 24 R 4.0226 7.8329 118.8669 58.2579 30.1141 178.0707 25 I 4.1702 7.2659 110.0929 59.3285 38.8313 174.8296 26 D 4.2832 7.7480 118.0342 55.9767 39.7474 172.5690 27 R 4.5325 7.8717 115.7547 53.6602 34.6158 176.5542 28 T 4.3009 8.1371 109.8047 60.8719 71.2045 173.7449 29 P 4.3111 0.0000 0.0000 66.2524 31.3631 178.3886 30 H 4.1014 8.2913 116.3399 59.0102 29.8201 176.7734 31 W 4.0781 8.4988 130.2098 60.4436 30.4255 177.5746 32 L 4.1250 8.3604 120.1141 58.3505 41.5515 178.9637 33 I 3.5811 7.8124 119.6445 64.2864 36.9709 178.5693 34 K 3.4536 7.7837 119.2075 59.2794 31.7601 179.1865 35 Q 3.6924 7.7754 119.9137 58.8296 28.8167 177.9724 36 A 3.9390 7.9644 122.0050 55.2725 18.3360 179.6225 37 I 3.5818 7.5658 118.0945 64.5812 37.1323 178.6884 38 F 4.4447 7.7680 118.5690 60.6208 38.7211 177.6816 39 S 4.1206 8.5296 113.1317 61.6252 62.2258 175.6183 40 Y 4.1744 8.2068 122.1942 60.7519 38.5235 177.8479 41 L 3.8987 8.2757 120.1285 57.7294 41.7305 179.0487 42 E 3.9110 8.4267 119.3207 59.3539 29.3044 178.9811 43 Q 3.9450 7.7132 117.0880 59.0052 28.8717 178.4682 44 L 3.9535 7.5055 118.7630 57.6140 41.6995 178.9653 45 E 4.4249 8.2682 119.6946 57.7198 29.6527 177.1112 46 N 4.5708 7.9902 118.7816 52.3344 37.1382 179.9359 47 S 4.8007 8.3811 119.8381 56.9808 62.7938 172.7666 48 D 4.4207 7.9741 122.2869 58.1187 40.8649 176.3813 49 T 4.0889 7.2204 117.9239 62.1516 67.2674 173.9177 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 2 G 8.35 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.14 4.58 4.25 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 0.00 0.00 0.00 1.23 0.00 0.00 4 T 8.99 4.61 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 5 T 8.42 4.27 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 1.22 0.00 0.00 6 M 8.51 4.31 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 7 G 8.61 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 8 V 8.39 4.19 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.89 0.00 0.00 9 K 8.58 4.36 0.00 1.80 1.65 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.32 1.02 7.81 10 L 8.13 4.91 0.00 1.56 1.53 0.90 1.09 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 11 D 8.36 4.59 0.00 2.94 2.78 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 12 D 8.66 4.36 0.00 2.70 2.76 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 0.00 0.00 0.00 0.00 13 A 8.00 3.98 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.27 3.77 4.36 0.00 0.00 0.00 0.00 0.00 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 15 R 7.90 3.85 0.00 1.90 2.11 0.00 3.10 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 16 E 8.45 3.92 0.00 2.13 2.10 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 2.31 2.49 0.00 17 R 8.00 3.91 0.00 2.10 1.96 0.00 3.18 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 18 I 7.98 3.70 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 1.52 0.74 0.94 0.00 0.00 19 K 8.27 3.98 0.00 1.99 1.87 0.00 1.67 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 1.58 7.81 20 S 8.40 4.11 0.00 3.86 3.91 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 0.00 0.00 0.00 21 A 8.32 4.01 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.46 4.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.10 3.82 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 24 R 7.83 4.02 0.00 2.00 2.00 0.00 3.14 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 25 I 7.27 4.17 1.82 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.66 0.93 0.00 0.00 26 D 7.75 4.28 0.00 2.75 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 27 R 7.87 4.53 0.00 1.73 1.63 0.00 2.21 0.00 0.00 2.60 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.56 0.00 28 T 8.14 4.30 4.33 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 1.25 0.00 0.00 29 P 0.00 4.31 0.00 2.22 2.19 0.00 3.65 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 30 H 8.29 4.10 0.00 3.22 3.38 0.00 5.68 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 W 8.50 4.08 0.00 3.51 3.37 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.36 4.13 0.00 2.02 2.09 0.94 0.91 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 33 I 7.81 3.58 1.87 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.52 0.78 0.00 0.00 34 K 7.78 3.45 0.00 1.66 1.45 0.00 1.64 0.00 0.00 1.51 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.09 1.09 7.81 35 Q 7.78 3.69 0.00 0.93 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.15 2.30 0.00 36 A 7.96 3.94 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 37 I 7.57 3.58 1.54 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.49 0.69 0.00 0.00 38 F 7.77 4.44 0.00 3.12 2.91 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 0.00 0.00 0.00 39 S 8.53 4.12 0.00 3.95 4.05 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 0.00 0.00 0.00 40 Y 8.21 4.17 0.00 3.14 2.96 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 41 L 8.28 3.90 0.00 1.95 1.73 0.99 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.43 3.91 0.00 2.16 2.12 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 2.30 2.35 0.00 43 Q 7.71 3.94 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 44 L 7.51 3.95 0.00 1.55 1.56 0.68 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.27 4.42 0.00 1.96 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 2.30 2.38 0.00 46 N 7.99 4.57 0.00 2.76 2.64 0.00 0.00 6.80 6.93 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 47 S 8.38 4.80 0.00 3.63 3.84 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 48 D 7.97 4.42 0.00 2.65 2.76 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 0.00 0.00 0.00 0.00 49 T 7.22 4.09 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 1.20 0.00 0.00