NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.2810 8.1127 119.7053 55.9783 31.5836 173.6830 5 E 4.7155 8.2775 120.5861 53.1061 32.3235 173.7975 6 C 4.3046 9.5315 127.8737 59.6321 32.6077 173.4881 7 D 4.4846 8.5867 127.2725 56.0991 39.8210 175.9940 8 Y 4.3555 7.0024 118.7307 58.8020 40.7867 176.1417 9 C 3.9696 8.0350 114.9032 59.1891 30.8416 175.3421 10 G 4.2042 8.3756 107.8198 45.2807 0.0000 173.5936 11 T 4.3043 7.7003 109.3281 61.4814 70.3677 173.3022 12 D 5.0066 8.5007 122.1400 54.3282 41.7544 176.3078 13 I 4.1535 8.4308 124.8441 60.0089 37.8375 175.6629 14 E 3.8979 8.9972 128.8521 55.5719 29.7847 174.8291 15 P 4.2929 0.0000 0.0000 64.2487 31.6666 175.5831 16 G 3.9017 9.2110 106.0407 46.5242 0.0000 173.4377 17 T 4.4476 7.9249 112.9512 62.9906 72.5048 174.5096 18 G 4.1318 9.0653 108.8628 45.7028 0.0000 172.5843 19 T 4.8156 8.4600 113.9191 61.7350 72.7240 173.0882 20 M 4.9847 8.7472 124.1006 53.8759 34.4299 174.3773 21 F 4.8305 9.4706 129.7359 56.9126 41.4326 174.3846 22 V 4.3641 7.5679 126.3485 61.5258 32.3158 175.4240 23 H 4.2155 8.8332 125.8008 54.9016 29.5496 176.5240 24 K 3.8439 8.7749 122.4121 59.8027 31.8746 177.7608 25 D 4.4344 7.9754 115.4176 54.1111 39.6260 176.6458 26 G 3.9631 7.9452 107.5669 45.1761 0.0000 174.0747 27 A 4.2635 9.3757 122.9455 52.5938 19.6994 176.5523 28 T 5.0574 8.3424 114.7994 62.1016 72.3702 174.0463 29 T 4.6390 8.7852 121.1097 62.2077 72.4286 172.6537 30 H 5.0493 9.6391 125.4321 54.9644 30.3638 174.5682 31 F 5.3594 9.6219 122.8710 55.9135 41.1433 176.6149 32 C 4.4171 9.1155 116.8989 59.8821 30.5769 173.4763 33 S 4.5909 7.5345 114.5086 56.5557 66.2491 175.7946 34 S 4.6888 8.3113 118.0804 60.7420 62.8012 175.9736 35 K 3.7320 8.0688 122.8345 59.6976 31.7629 178.3355 36 C 4.2527 7.7784 115.3092 62.7854 28.2015 175.6549 37 E 2.5969 7.5224 119.6051 59.2765 28.7907 179.3137 38 N 4.1725 8.3366 116.3997 56.4369 38.2130 177.3128 39 N 4.3819 8.1927 117.5707 55.9680 38.4858 177.4895 40 A 4.0329 7.6496 122.4146 55.3007 18.3502 179.4094 41 D 3.8194 7.9678 116.0988 56.9724 40.8988 178.2630 42 L 4.3049 7.3316 117.6267 54.8969 41.8602 177.7310 43 G 3.9572 8.6660 108.2407 45.5671 0.0000 173.9809 44 R 4.3276 7.4897 117.6664 55.4261 31.1080 175.6763 45 E 4.5961 8.4770 119.9238 54.3253 31.5172 176.9183 46 A 3.4159 8.1855 126.5038 55.2766 18.3512 179.7859 47 R 3.8078 7.6993 113.3194 58.9362 30.1854 177.1280 48 N 4.5404 8.2041 113.3391 52.9735 38.9448 174.8051 49 L 4.4468 7.2709 120.2815 52.6832 41.8737 176.8247 50 E 3.8546 8.8600 124.9662 58.8845 29.5101 178.8596 51 W 4.5062 7.7120 113.6303 57.9361 29.1068 176.7554 52 T 3.7671 7.2262 118.1222 63.0383 68.3521 175.1729 53 D 4.2775 8.7460 125.9994 57.7966 40.5731 177.5840 54 T 3.6363 7.6259 114.4140 66.6296 68.9618 174.7626 55 A 3.9854 7.8028 125.2541 55.5483 18.7375 177.7005 56 R 4.0871 7.9374 118.2193 56.5749 30.0576 176.4248 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 4 R 8.11 4.28 0.00 1.88 1.89 0.00 3.01 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 5 E 8.28 4.72 0.00 1.95 1.77 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 2.19 2.40 0.00 6 C 9.53 4.30 0.00 3.10 2.89 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 7 D 8.59 4.48 0.00 2.56 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.00 4.36 0.00 2.95 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 9 C 8.04 3.97 0.00 3.12 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.38 4.20 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 0.00 0.00 0.00 11 T 7.70 4.30 4.30 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 1.33 0.00 0.00 12 D 8.50 5.01 0.00 2.61 2.66 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 13 I 8.43 4.15 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.60 0.96 0.00 0.00 14 E 9.00 3.90 0.00 1.93 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 15 P 0.00 4.29 0.00 2.23 2.07 0.00 3.94 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 2.00 1.99 0.00 16 G 9.21 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 17 T 7.92 4.45 4.53 0.00 0.00 0.00 0.00 0.00 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 18 G 9.07 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.46 4.82 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 20 M 8.75 4.98 0.00 1.97 1.85 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.37 0.00 21 F 9.47 4.83 0.00 3.32 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.57 4.36 1.83 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 0.73 0.00 0.00 0.83 0.00 0.00 23 H 8.83 4.22 0.00 3.39 3.25 0.00 5.69 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.77 3.84 0.00 1.75 1.89 0.00 1.80 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.45 7.81 25 D 7.98 4.43 0.00 2.83 2.79 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 26 G 7.95 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 27 A 9.38 4.26 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.34 5.06 4.26 0.00 0.00 0.00 0.00 0.00 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 29 T 8.79 4.64 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 0.59 0.00 0.00 30 H 9.64 5.05 0.00 3.07 3.25 0.00 5.77 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.62 5.36 0.00 3.02 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.12 4.42 0.00 3.17 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.53 4.59 0.00 4.03 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 34 S 8.31 4.69 0.00 3.98 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 35 K 8.07 3.73 0.00 1.74 1.84 0.00 1.37 0.00 0.00 1.38 0.00 0.00 2.13 0.00 0.00 2.30 0.00 0.00 0.00 0.00 1.41 1.36 7.81 36 C 7.78 4.25 0.00 3.31 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.52 2.60 0.00 1.67 1.19 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 1.47 2.18 0.00 38 N 8.34 4.17 0.00 2.63 2.78 0.00 0.00 7.12 6.80 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 39 N 8.19 4.38 0.00 3.14 3.12 0.00 0.00 6.92 7.15 0.00 0.00 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 A 7.65 4.03 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.97 3.82 0.00 2.63 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 7.33 4.30 0.00 1.84 1.73 0.94 0.89 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 43 G 8.67 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 44 R 7.49 4.33 0.00 2.15 1.98 0.00 3.26 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.66 0.00 45 E 8.48 4.60 0.00 1.97 1.79 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 2.34 2.29 0.00 46 A 8.19 3.42 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.70 3.81 0.00 1.72 1.92 0.00 3.13 0.00 0.00 3.16 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 48 N 8.20 4.54 0.00 2.74 2.82 0.00 0.00 6.89 7.54 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 49 L 7.27 4.45 0.00 1.16 0.88 1.10 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.86 3.85 0.00 2.02 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 2.32 2.34 0.00 51 W 7.71 4.51 0.00 3.56 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.23 3.77 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 0.98 0.00 0.00 53 D 8.75 4.28 0.00 2.81 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 54 T 7.63 3.64 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 55 A 7.80 3.99 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 56 R 7.94 4.09 0.00 1.93 1.84 0.00 3.22 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00