NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0035 8.3549 109.7383 45.0984 0.0000 176.3426 2 S 4.5772 9.0902 112.1951 56.2549 67.2674 171.4864 3 S 4.7859 8.7084 118.1815 57.3746 67.4442 173.0168 4 G 3.8206 8.1388 106.7396 44.4008 0.0000 172.8913 5 S 4.7922 8.4065 114.6688 56.7991 65.4916 173.6028 6 S 4.4792 8.1656 118.5089 57.6094 67.3034 174.0909 7 G 3.9618 8.4238 107.5820 47.0516 0.0000 173.6905 8 L 4.0987 7.8319 119.7811 56.9243 42.7227 177.7184 9 D 4.7467 7.9000 117.9780 51.9929 40.2340 175.6606 10 S 4.6644 8.7197 117.9291 57.8054 62.5881 173.5217 11 E 4.5963 8.1302 113.9824 55.5565 29.6603 175.2048 12 L 4.7219 7.4108 118.1256 53.0307 44.4261 175.9402 13 E 4.2033 8.3178 120.6312 55.8605 30.4169 176.3924 14 L 4.1959 7.7927 119.8198 52.9716 43.1045 175.7148 15 P 4.4788 0.0000 0.0000 61.8960 32.5574 175.3625 16 A 4.2257 8.2746 120.8713 53.7764 19.1657 176.2209 17 G 4.3795 9.0951 111.2350 45.3559 0.0000 174.1100 18 W 4.5517 7.4932 117.8643 56.5502 30.0140 176.3224 19 E 4.5938 8.8440 124.5781 54.8625 32.3015 174.3864 20 K 4.7270 8.5876 127.1562 57.0045 34.0026 176.3929 21 I 4.3763 8.1158 122.6428 59.4746 40.7399 174.0425 22 E 4.9596 8.7607 126.2116 54.8348 30.9954 174.9205 23 D 5.0464 9.1179 124.4832 51.7651 44.7321 174.4311 24 P 4.5326 0.0000 0.0000 64.3100 31.8399 176.8098 25 V 4.2444 8.4800 118.3047 64.0344 33.2184 175.7578 26 Y 4.3064 8.7928 115.4107 57.5808 39.7813 176.9427 27 G 4.0323 9.0211 107.7393 45.3250 0.0000 173.4188 28 I 4.8323 8.3581 126.6676 59.9649 38.3481 174.9966 29 Y 3.8189 8.0786 125.4811 55.0008 41.5078 173.9033 30 Y 5.1150 8.0622 120.9339 57.2695 39.8836 174.4625 31 V 4.4989 8.7370 125.2907 61.2065 33.8922 174.0220 32 D 4.5301 8.4202 129.5437 53.0745 41.1236 176.5203 33 H 4.0661 8.5723 123.8185 58.1596 28.7752 177.3964 34 I 3.9539 8.4361 119.8698 63.8899 37.3733 177.0558 35 N 4.4076 8.1281 116.1304 53.7132 39.1233 175.2019 36 R 3.8377 7.8499 116.6130 57.2558 27.9127 175.7533 37 K 4.8307 7.3035 115.1533 55.1397 36.8630 175.7510 38 T 5.7089 8.6701 110.8814 59.0602 70.6597 173.0298 39 Q 4.8423 8.7253 123.3747 55.0050 31.6200 175.5014 40 Y 3.4245 9.1285 119.3852 60.4571 38.3834 176.3123 41 E 4.1010 8.1038 118.0522 56.3197 30.1783 176.0085 42 N 4.8653 8.4524 119.2234 51.2613 39.3087 173.0129 43 P 4.4449 0.0000 0.0000 63.0478 31.5021 176.9873 44 S 3.8778 7.1006 114.5686 59.6900 63.0427 172.9194 45 G 3.8035 8.5360 107.1906 42.9549 0.0000 173.3429 46 P 4.4586 0.0000 0.0000 62.3154 28.8810 174.3897 47 S 4.3436 7.9282 118.7248 57.5534 64.6186 174.6268 48 S 4.6589 8.3334 120.0830 56.5578 64.8726 174.5310 49 G 3.7845 8.2933 108.6825 46.6657 0.0000 173.1480 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 G 8.35 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 0.00 0.00 0.00 0.00 2 S 9.09 4.58 0.00 3.90 3.72 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 3 S 8.71 4.79 0.00 3.81 3.72 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 4 G 8.14 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.41 4.79 0.00 3.79 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 6 S 8.17 4.48 0.00 3.85 3.72 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 7 G 8.42 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 8 L 7.83 4.10 0.00 1.64 1.72 0.91 1.10 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 9 D 7.90 4.75 0.00 2.73 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 10 S 8.72 4.66 0.00 3.84 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.13 4.60 0.00 2.08 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 2.16 2.28 0.00 12 L 7.41 4.72 0.00 1.56 1.54 0.97 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.32 4.20 0.00 1.90 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 0.00 2.25 2.27 0.00 14 L 7.79 4.20 0.00 1.48 1.49 0.05 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.48 0.00 2.27 2.15 0.00 3.18 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 16 A 8.27 4.23 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 17 G 9.10 4.38 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 0.00 0.00 0.00 18 W 7.49 4.55 0.00 3.38 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 19 E 8.84 4.59 0.00 2.07 1.80 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 2.20 2.25 0.00 20 K 8.59 4.73 0.00 1.91 1.46 0.00 1.41 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.45 7.81 21 I 8.12 4.38 0.56 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.71 0.85 0.00 0.00 22 E 8.76 4.96 0.00 1.82 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 2.24 2.27 0.00 23 D 9.12 5.05 0.00 2.89 2.84 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 24 P 0.00 4.53 0.00 2.27 2.21 0.00 3.86 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.00 0.00 25 V 8.48 4.24 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.02 0.00 0.00 26 Y 8.79 4.31 0.00 2.98 2.87 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 G 9.02 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 0.00 0.00 0.00 28 I 8.36 4.83 1.88 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.54 0.87 0.00 0.00 29 Y 8.08 3.82 0.00 2.82 2.54 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 0.00 0.00 0.00 0.00 30 Y 8.06 5.11 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 31 V 8.74 4.50 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.15 0.00 0.00 32 D 8.42 4.53 0.00 1.58 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 0.00 0.00 0.00 33 H 8.57 4.07 0.00 3.04 3.31 0.00 5.70 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.44 3.95 2.01 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 1.32 0.37 0.92 0.00 0.00 35 N 8.13 4.41 0.00 2.72 2.80 0.00 0.00 7.27 7.80 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 36 R 7.85 3.84 0.00 1.88 1.96 0.00 3.14 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 1.52 1.53 0.00 37 K 7.30 4.83 0.00 1.75 1.80 0.00 1.44 0.00 0.00 1.90 0.00 0.00 3.21 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.89 1.00 7.81 38 T 8.67 5.71 4.38 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 1.30 0.00 0.00 39 Q 8.73 4.84 0.00 2.27 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 7.01 0.00 0.00 0.00 0.00 0.00 2.90 2.84 0.00 40 Y 9.13 3.42 0.00 2.79 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 41 E 8.10 4.10 0.00 2.04 1.94 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 2.35 2.34 0.00 42 N 8.45 4.87 0.00 2.91 2.73 0.00 0.00 6.48 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 43 P 0.00 4.44 0.00 1.86 1.89 0.00 3.40 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.44 0.00 44 S 7.10 3.88 0.00 3.94 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 45 G 8.54 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 0.00 0.00 0.00 46 P 0.00 4.46 0.00 2.18 2.10 0.00 3.71 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 47 S 7.93 4.34 0.00 3.92 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 S 8.33 4.66 0.00 4.00 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 49 G 8.29 3.78 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 0.00 0.00 0.00