NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 V 4.2155 7.9127 120.6596 62.8543 33.7271 174.6653 14 K 4.1477 8.1322 120.4897 53.5150 32.4804 175.7788 15 C 4.3841 8.3464 122.6938 57.9883 29.1106 171.9613 16 F 4.1276 9.8085 133.5879 58.8752 38.6833 174.3399 17 N 4.9362 7.9220 112.8128 54.6624 45.7800 175.1271 18 C 3.9579 7.8739 117.1439 61.4411 31.5860 173.2417 19 G 3.7290 8.2336 114.4352 45.5865 0.0000 173.1389 20 K 3.9936 7.8824 122.2832 56.8112 32.6682 177.1258 21 E 4.4259 8.2639 123.6291 57.4374 30.1043 177.4042 22 G 4.1653 7.8169 107.5958 46.0156 0.0000 173.0748 23 H 4.7537 8.0284 115.3004 54.9038 30.7903 171.4644 24 T 3.4654 8.1179 108.2170 61.4869 67.3020 172.3246 25 A 4.8135 8.2470 134.1102 51.3656 17.2125 176.1666 26 R 4.8110 7.4904 121.6524 57.0611 37.5790 176.8093 27 N 4.3787 7.4721 109.4557 51.7654 40.8136 173.7724 28 H 4.7271 7.7029 116.2602 55.9473 28.4909 172.8664 29 R 4.1854 7.9314 117.5215 56.5684 34.2475 174.4561 30 A 3.7224 8.5977 116.0181 53.7774 15.7169 176.2043 31 P 4.3105 0.0000 0.0000 65.0717 32.4035 177.9313 32 R 4.2115 7.7736 116.7904 55.6471 32.6034 173.1877 33 K 4.1036 8.7478 128.4587 55.8421 32.7276 174.8284 34 K 4.3599 8.5461 122.4841 57.8208 34.1457 178.1777 35 G 4.5683 7.6881 115.9755 46.1267 0.0000 174.2807 36 C 4.6889 8.7955 122.0741 57.9081 28.2537 173.6332 37 W 3.5762 8.2671 126.6619 57.4841 28.9113 173.1801 38 K 4.1388 7.7530 119.6094 56.9296 36.2390 175.2775 39 C 4.4766 7.9077 117.6278 58.2195 32.2769 173.9466 40 G 3.8414 8.3817 105.9798 45.6520 0.0000 172.5916 41 K 4.5165 7.8337 119.3427 54.5480 34.0685 176.3921 42 E 4.3557 8.4686 121.9564 57.3049 31.0359 177.7133 43 G 3.8788 8.2620 107.3957 48.0399 0.0000 172.2182 44 H 5.0891 7.3862 112.2466 53.5322 32.2445 172.3924 45 Q 5.0861 8.2389 117.6341 54.8819 29.5662 177.1983 46 M 4.8005 8.9485 116.3563 57.7216 31.9834 177.6163 47 K 4.2587 8.0190 116.9015 57.9890 33.4246 176.7372 48 D 4.9989 7.9198 119.4559 53.9450 41.5373 175.3988 49 C 4.7057 7.9502 118.1034 58.1871 34.0917 172.9472 50 T 4.4260 8.4582 123.5977 64.5353 69.2271 174.9316 51 E 3.7867 8.5473 119.3284 58.1202 28.2885 174.6467 52 R 3.8336 7.7359 113.4720 57.3551 28.1623 177.0036 53 Q 4.1778 7.6569 119.9140 56.4581 28.8473 176.2056 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 13 V 7.91 4.22 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 1.02 0.00 0.00 0.95 0.00 0.00 14 K 8.13 4.15 0.00 1.84 1.70 0.00 1.71 0.00 0.00 1.50 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.56 7.81 15 C 8.35 4.38 0.00 3.39 3.25 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 0.00 16 F 9.81 4.13 0.00 3.15 3.28 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 17 N 7.92 4.94 0.00 2.79 2.78 0.00 0.00 6.61 7.47 0.00 0.00 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 C 7.87 3.96 0.00 2.79 2.94 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 0.00 0.00 0.00 0.00 19 G 8.23 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 K 7.88 3.99 0.00 1.81 1.82 0.00 1.01 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.42 7.81 21 E 8.26 4.43 0.00 1.98 1.99 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 2.30 2.43 0.00 22 G 7.82 4.17 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 0.00 0.00 0.00 23 H 8.03 4.75 0.00 3.17 3.30 0.00 5.84 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 T 8.12 3.47 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 1.27 0.00 0.00 25 A 8.25 4.81 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.49 4.81 0.00 1.69 1.83 0.00 3.24 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.80 0.00 27 N 7.47 4.38 0.00 2.50 2.60 0.00 0.00 6.78 8.08 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 28 H 7.70 4.73 0.00 3.06 3.16 0.00 5.57 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.93 4.19 0.00 1.69 1.75 0.00 3.57 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.64 0.00 30 A 8.60 3.72 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 31 P 0.00 4.31 0.00 2.02 2.11 0.00 3.76 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.84 0.00 32 R 7.77 4.21 0.00 1.42 1.56 0.00 3.84 0.00 0.00 3.52 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.48 0.00 33 K 8.75 4.10 0.00 2.26 2.01 0.00 1.97 0.00 0.00 1.68 0.00 0.00 2.74 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.46 7.81 34 K 8.55 4.36 0.00 1.77 1.82 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.37 7.81 35 G 7.69 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.80 4.69 0.00 3.13 3.13 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 37 W 8.27 3.58 0.00 3.35 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 38 K 7.75 4.14 0.00 1.82 1.77 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.24 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.50 7.81 39 C 7.91 4.48 0.00 2.98 3.03 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 40 G 8.38 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 0.00 0.00 0.00 41 K 7.83 4.52 0.00 1.72 1.29 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.42 7.81 42 E 8.47 4.36 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.26 0.00 43 G 8.26 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 44 H 7.39 5.09 0.00 3.38 3.28 0.00 5.50 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.24 5.09 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 46 M 8.95 4.80 0.00 2.25 2.41 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 47 K 8.02 4.26 0.00 1.88 1.95 0.00 1.52 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.46 7.81 48 D 7.92 5.00 0.00 2.79 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 49 C 7.95 4.71 0.00 3.15 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 8.46 4.43 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 1.25 0.00 0.00 51 E 8.55 3.79 0.00 2.15 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 2.29 2.32 0.00 52 R 7.74 3.83 0.00 1.97 1.94 0.00 3.25 0.00 0.00 3.27 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 53 Q 7.66 4.18 0.00 2.11 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.56 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00