NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4160 8.3044 118.1949 54.5441 32.7951 175.0131 2 K 3.9324 8.3492 122.2550 56.2937 32.6614 170.5600 3 V 3.9666 8.5329 116.1705 57.8932 33.4252 172.4181 4 R 3.7075 8.2519 123.3177 55.6820 30.8558 177.5998 5 A 3.9582 8.7651 124.7839 54.2252 18.6245 177.0730 6 S 4.5873 7.3297 112.0890 56.7546 63.0007 173.9472 7 V 3.7045 7.7025 126.9535 58.4647 32.0161 176.8981 8 K 3.7388 7.8915 126.3070 53.9551 32.8972 175.3968 9 K 4.3883 8.1356 120.2145 56.8783 33.5811 176.2624 10 L 4.7179 8.0672 113.7398 55.3005 46.9259 176.1974 11 C 4.3122 7.5686 116.1770 58.0583 32.2321 175.0972 12 R 4.5099 8.7314 113.5094 55.8912 30.2546 176.3803 13 N 4.5722 7.9865 114.7674 54.1091 39.5969 173.9247 14 C 4.1491 8.1475 115.1082 59.9452 28.0141 173.6689 15 K 3.9496 9.3064 127.4121 59.6732 32.1317 176.0084 16 I 3.2097 7.6709 118.1737 62.5247 32.5018 172.9349 17 V 4.1396 7.3450 122.4243 61.6684 33.2627 174.6727 18 K 4.9178 8.0715 124.3397 54.5080 31.7528 175.0749 19 R 4.2963 7.8488 121.0893 55.8103 32.0050 176.6829 20 D 4.5174 8.8806 119.6593 54.9386 40.3355 174.3817 21 G 3.9923 8.3419 111.1072 46.1484 0.0000 172.8399 22 V 3.6540 7.3938 112.4062 61.5968 31.2436 177.3619 23 I 4.0893 7.9590 130.1303 60.7703 34.9810 175.4365 24 R 4.3450 7.7785 121.8047 56.2017 32.1602 176.8813 25 V 4.7000 8.2753 118.3189 62.0837 35.2127 173.8090 26 I 4.7019 8.5906 127.5421 59.5311 41.2520 173.7705 27 C 5.0829 8.4949 126.0342 57.4558 33.5744 174.5599 28 S 4.2954 9.0485 120.8765 59.9613 62.4744 174.7464 29 A 4.2342 6.9841 123.2909 52.7081 19.4669 176.4244 30 E 4.6426 7.3934 111.2286 53.3669 32.3668 175.8448 31 P 4.2840 0.0000 0.0000 65.4741 31.7458 178.6808 32 K 4.1035 8.1183 116.4509 59.8180 32.0880 177.8905 33 H 4.2493 7.9269 114.8193 58.2730 28.7304 175.2667 34 K 4.2735 8.2945 121.2588 57.0416 32.2835 176.1712 35 Q 4.8535 8.6786 125.0357 54.3378 33.7035 173.9358 36 R 4.8341 8.1882 119.7976 55.3835 33.9567 171.5680 37 Q 3.2328 9.0416 123.2755 56.1875 28.6024 173.6124 38 G 3.7360 8.3897 112.3149 45.9133 0.0000 171.5369 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 M 8.30 4.42 0.00 2.14 2.32 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 2 K 8.35 3.93 0.00 1.94 1.72 0.00 1.59 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.58 7.81 3 V 8.53 3.97 2.23 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 0.79 0.00 0.00 0.93 0.00 0.00 4 R 8.25 3.71 0.00 2.08 1.97 0.00 3.13 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 5 A 8.77 3.96 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 6 S 7.33 4.59 0.00 3.83 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.70 3.70 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 0.75 0.00 0.00 1.00 0.00 0.00 8 K 7.89 3.74 0.00 1.89 1.81 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.40 7.81 9 K 8.14 4.39 0.00 1.87 1.84 0.00 1.49 0.00 0.00 1.68 0.00 0.00 3.15 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.51 7.81 10 L 8.07 4.72 0.00 1.27 1.34 0.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 11 C 7.57 4.31 0.00 3.07 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.73 4.51 0.00 1.91 2.06 0.00 3.02 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 13 N 7.99 4.57 0.00 2.73 2.91 0.00 0.00 6.97 7.66 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 14 C 8.15 4.15 0.00 2.96 2.95 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 0.00 0.00 0.00 15 K 9.31 3.95 0.00 1.65 1.93 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.46 7.81 16 I 7.67 3.21 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 1.35 0.95 0.00 0.00 17 V 7.35 4.14 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 0.97 0.00 0.00 0.93 0.00 0.00 18 K 8.07 4.92 0.00 1.70 1.65 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.41 7.81 19 R 7.85 4.30 0.00 1.91 1.82 0.00 3.33 0.00 0.00 3.34 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 20 D 8.88 4.52 0.00 2.79 2.53 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 0.00 21 G 8.34 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 22 V 7.39 3.65 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 0.70 0.00 0.00 0.99 0.00 0.00 23 I 7.96 4.09 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 1.41 0.61 0.91 0.00 0.00 24 R 7.78 4.35 0.00 1.80 2.08 0.00 3.11 0.00 0.00 3.09 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 25 V 8.28 4.70 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 0.93 0.00 0.00 0.93 0.00 0.00 26 I 8.59 4.70 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.17 0.91 0.00 0.00 27 C 8.49 5.08 0.00 3.03 2.93 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 28 S 9.05 4.30 0.00 4.01 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 29 A 6.98 4.23 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 30 E 7.39 4.64 0.00 1.52 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.13 0.00 31 P 0.00 4.28 0.00 2.16 2.09 0.00 3.58 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 32 K 8.12 4.10 0.00 1.77 1.92 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.64 7.81 33 H 7.93 4.25 0.00 3.28 3.35 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 34 K 8.29 4.27 0.00 1.73 2.00 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.44 7.81 35 Q 8.68 4.85 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.29 0.00 0.00 0.00 0.00 0.00 2.26 2.44 0.00 36 R 8.19 4.83 0.00 1.77 1.78 0.00 3.41 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 37 Q 9.04 3.23 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.61 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 38 G 8.39 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00