NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.4040 8.0393 120.4346 63.5618 33.1188 175.4256 2 F 4.7707 7.8718 115.5423 53.9515 37.5443 171.1412 3 H 4.3347 8.2542 129.2070 57.7291 34.7015 176.6369 4 A 3.8029 8.3120 120.7639 54.4931 18.3868 176.7741 5 Y 4.2081 7.3897 113.2616 57.8285 38.9887 176.1356 6 S 4.4325 8.3501 115.7637 56.2754 64.7117 174.7408 7 A 4.1788 8.6435 128.4796 55.0987 18.0233 178.9231 8 R 4.1299 8.1440 114.7380 58.1947 29.0005 178.0708 9 G 3.9942 8.3725 105.9928 45.7694 0.0000 176.3312 10 V 3.7531 7.6086 121.1627 64.8294 31.6235 178.6111 11 R 4.2326 8.2587 117.6168 58.9622 29.1586 178.4597 12 N 4.5832 7.6164 115.8178 55.5104 38.2860 176.2484 13 N 4.6617 8.0473 116.8927 54.4957 38.9445 176.8754 14 Y 4.1091 8.3472 120.6591 59.7449 38.4292 177.7898 15 K 2.9836 7.1132 119.9834 58.6902 32.2405 178.9235 16 S 4.0594 7.4030 114.3857 61.3788 62.6259 175.7223 17 A 4.1351 7.8017 122.2425 54.2918 17.8105 179.4595 18 V 3.7712 7.1709 115.2831 65.3416 31.4723 177.8701 19 G 3.8786 8.0833 106.1597 47.5454 0.0000 173.8877 20 P 4.6476 0.0000 0.0000 64.8349 31.6650 177.9138 21 A 3.9651 7.7736 120.3497 55.0581 17.9979 179.0347 22 D 4.3820 7.8478 116.5919 56.7869 41.1850 178.5139 23 W 4.2613 8.6000 118.1238 59.4934 28.3639 178.6448 24 V 2.0000 5.7494 120.1277 63.7080 30.4075 178.0030 25 I 3.5887 7.6423 120.2628 63.2939 37.7175 177.7796 26 S 4.1065 8.2534 114.4132 61.2291 62.1934 176.0025 27 A 4.2664 8.7064 124.0538 54.7933 18.1006 179.9220 28 V 3.6170 7.7654 117.2858 66.3323 31.8733 178.6169 29 R 4.1889 8.4600 116.1404 58.9759 29.1064 178.9370 30 G 3.7827 8.2784 106.6413 47.5687 0.0000 175.2192 31 F 4.3261 8.6074 122.8556 60.4824 39.1534 177.1879 32 I 3.1372 7.5060 118.2261 64.0545 37.8487 176.9959 33 H 4.5272 7.5225 112.9177 56.9857 28.8031 176.0296 34 G 3.8723 7.3951 113.2825 45.2522 0.0000 172.8888 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 V 8.04 4.40 2.47 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 1.18 0.00 0.00 1.07 0.00 0.00 2 F 7.87 4.77 0.00 3.22 2.90 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 3 H 8.25 4.33 0.00 2.81 2.77 0.00 5.87 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 A 8.31 3.80 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.39 4.21 0.00 2.94 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 6 S 8.35 4.43 0.00 3.85 3.76 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 7 A 8.64 4.18 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.14 4.13 0.00 1.79 2.02 0.00 3.24 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 9 G 8.37 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 10 V 7.61 3.75 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.02 0.00 0.00 11 R 8.26 4.23 0.00 2.36 2.35 0.00 2.97 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.77 0.00 12 N 7.62 4.58 0.00 3.07 2.93 0.00 0.00 7.12 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 13 N 8.05 4.66 0.00 3.13 2.90 0.00 0.00 6.70 6.77 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 14 Y 8.35 4.11 0.00 3.12 3.40 0.00 0.00 0.00 0.00 0.00 0.00 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 7.11 2.98 0.00 1.65 1.36 0.00 1.36 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.35 7.81 16 S 7.40 4.06 0.00 3.75 4.07 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 17 A 7.80 4.14 1.38 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 18 V 7.17 3.77 2.06 0.00 0.00 0.00 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 1.15 0.00 0.00 19 G 8.08 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 20 P 0.00 4.65 0.00 2.62 2.62 0.00 3.85 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.14 0.00 21 A 7.77 3.97 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.85 4.38 0.00 2.90 2.73 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 23 W 8.60 4.26 0.00 3.50 3.33 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 0.00 24 V 5.75 2.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 -0.07 0.00 0.00 25 I 7.64 3.59 1.93 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.42 0.93 0.00 0.00 26 S 8.25 4.11 0.00 4.03 4.09 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 0.00 0.00 0.00 0.00 27 A 8.71 4.27 1.65 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 0.00 0.00 28 V 7.77 3.62 2.24 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 1.05 0.00 0.00 0.89 0.00 0.00 29 R 8.46 4.19 0.00 2.11 2.21 0.00 2.92 0.00 0.00 3.20 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.70 0.00 30 G 8.28 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 31 F 8.61 4.33 0.00 3.13 3.27 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.51 3.14 2.07 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.82 0.97 0.00 0.00 33 H 7.52 4.53 0.00 3.41 3.40 0.00 5.83 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 7.40 3.87 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 0.00 0.00 0.00