NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3154 8.2531 123.5863 51.9565 20.5867 177.2485 3 G 3.7711 8.0578 103.0687 44.8376 0.0000 172.8929 4 S 4.2137 7.9717 115.0831 57.8473 65.2063 172.5988 5 R 3.9823 8.7249 127.8482 59.7734 29.7342 179.0261 6 V 3.6455 7.8117 117.9820 65.3608 31.2743 178.3295 7 T 3.8753 7.8769 116.4321 65.9251 68.3338 176.1584 8 F 4.0124 8.5393 122.8857 61.5191 39.3344 177.1113 9 E 3.9412 8.6588 118.3226 59.4230 29.2221 179.4543 10 R 4.0464 8.0417 118.1249 59.2752 30.0821 179.3672 11 V 3.5424 8.0551 120.5845 66.5508 31.5609 178.3342 12 E 3.7610 7.8551 118.1957 61.2842 29.3766 181.0491 13 Q 4.1405 7.8698 118.8577 59.1852 28.7417 178.7313 14 M 4.0083 8.3178 120.0644 58.3565 31.9243 178.7149 15 S 4.0127 8.0654 113.2046 61.4838 62.7119 176.0151 16 I 3.6765 7.7373 122.3188 64.8870 36.9550 178.5445 17 Q 4.0642 8.2561 118.3717 58.6392 28.4606 178.9315 18 I 3.7196 8.0456 121.4908 64.2043 37.1293 178.0356 19 K 3.8485 8.1102 120.5076 59.7089 31.7828 178.3355 20 E 3.9186 8.1768 119.3050 59.0468 29.5573 178.7666 21 V 3.6786 7.9578 118.5966 65.8702 31.4402 178.2477 22 G 3.5087 8.2434 105.3440 47.8789 0.0000 175.0352 23 D 4.4600 8.2812 122.6033 57.2853 40.8792 179.6667 24 R 4.0537 8.2647 118.2477 59.4287 30.0577 179.3748 25 V 3.6270 7.9310 118.0244 65.9055 31.5080 177.8325 26 N 4.4141 8.4738 116.5868 56.3353 38.2728 176.7648 27 Y 4.2139 8.1720 120.8812 60.8223 38.8838 177.8159 28 I 3.4291 7.9633 120.9325 64.3443 37.1490 178.2772 29 K 3.8506 8.4952 119.3000 59.6820 31.9715 179.2584 30 R 3.9056 7.8421 117.9735 59.6758 30.0620 179.3492 31 S 4.0224 8.0326 114.7428 61.4906 62.6646 176.7654 32 L 3.9552 8.1642 122.1061 57.7283 41.3820 179.2174 33 Q 3.9420 8.3097 119.7330 59.3395 29.0158 178.6982 34 S 4.1096 8.1408 116.0997 61.4934 62.8957 176.4125 35 L 3.9428 8.0016 123.0296 58.1765 41.8106 178.4908 36 D 4.3385 8.4525 118.3709 57.3887 41.0991 178.4939 37 S 4.1023 8.0425 115.5933 61.6271 62.8496 176.5383 38 Q 4.0663 8.0081 120.5233 59.0755 28.4666 179.0709 39 I 3.7855 7.9428 120.8119 64.2273 37.1467 178.3730 40 G 3.7054 8.1064 106.5382 48.5075 0.0000 175.0736 41 H 4.1378 8.0270 119.1947 58.4200 28.6580 177.7049 42 L 3.9653 7.9395 121.9084 58.2166 41.8935 178.9826 43 Q 3.9837 8.6668 118.3510 59.0481 28.6295 178.4439 44 D 4.3408 8.2167 119.9074 57.4136 40.8335 178.7827 45 L 3.9621 7.9420 120.7579 57.8791 42.1115 178.5439 46 S 4.0514 8.2596 113.1454 61.5882 62.2922 176.0366 47 A 3.9921 8.1755 123.2580 55.2221 18.1678 179.3546 48 L 3.9184 7.9222 118.7121 58.4560 42.0752 179.3472 49 T 3.8197 8.0874 115.7660 66.6275 68.4037 176.8370 50 V 3.5519 7.8082 119.9791 66.0326 31.3576 177.4037 51 D 4.3815 7.8756 117.2768 57.9570 41.0339 178.8545 52 T 4.0074 7.7765 115.5826 66.6714 68.4157 176.4725 53 L 3.9316 8.1170 122.2707 58.0075 41.8876 178.5855 54 K 3.7769 8.2119 119.0444 60.1534 32.0363 178.3521 55 T 4.1198 7.6638 114.6933 65.5576 68.5247 174.6725 56 L 4.2140 7.8858 125.2163 54.8735 41.7730 176.4202 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 2 A 8.25 4.32 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 3 G 8.06 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 4 S 7.97 4.21 0.00 3.91 3.77 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 0.00 0.00 0.00 5 R 8.72 3.98 0.00 1.93 1.96 0.00 3.31 0.00 0.00 3.41 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.11 0.00 6 V 7.81 3.65 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 0.85 0.00 0.00 0.95 0.00 0.00 7 T 7.88 3.88 4.46 0.00 0.00 0.00 0.00 0.00 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 8 F 8.54 4.01 0.00 3.14 3.10 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 9 E 8.66 3.94 0.00 2.30 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 10 R 8.04 4.05 0.00 1.97 1.96 0.00 3.21 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 11 V 8.06 3.54 1.89 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 0.89 0.00 0.00 0.94 0.00 0.00 12 E 7.86 3.76 0.00 2.01 1.96 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 2.25 2.24 0.00 13 Q 7.87 4.14 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 14 M 8.32 4.01 0.00 1.99 2.22 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.53 0.00 15 S 8.07 4.01 0.00 3.94 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 16 I 7.74 3.68 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.95 0.89 0.00 0.00 17 Q 8.26 4.06 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 18 I 8.05 3.72 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.00 0.90 0.00 0.00 19 K 8.11 3.85 0.00 1.82 1.98 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.46 7.81 20 E 8.18 3.92 0.00 2.15 2.02 0.00 0.00 0.00 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 2.35 0.00 21 V 7.96 3.68 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 0.96 0.00 0.00 1.02 0.00 0.00 22 G 8.24 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.28 4.46 0.00 2.82 2.76 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 24 R 8.26 4.05 0.00 2.02 2.05 0.00 3.14 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.83 0.00 25 V 7.93 3.63 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.97 0.00 0.00 26 N 8.47 4.41 0.00 2.99 2.90 0.00 0.00 6.62 7.50 0.00 0.00 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 Y 8.17 4.21 0.00 3.00 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 28 I 7.96 3.43 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.66 0.86 0.00 0.00 29 K 8.50 3.85 0.00 1.94 1.86 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.56 7.81 30 R 7.84 3.91 0.00 2.06 2.01 0.00 3.18 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.92 0.00 31 S 8.03 4.02 0.00 3.73 3.68 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.16 3.96 0.00 1.74 1.68 0.90 0.76 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 33 Q 8.31 3.94 0.00 2.13 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 34 S 8.14 4.11 0.00 4.05 3.89 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 35 L 8.00 3.94 0.00 1.73 1.84 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.45 4.34 0.00 2.88 2.81 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 37 S 8.04 4.10 0.00 4.09 3.92 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 0.00 0.00 0.00 38 Q 8.01 4.07 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 39 I 7.94 3.79 2.03 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 1.45 0.84 0.90 0.00 0.00 40 G 8.11 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 0.00 0.00 0.00 41 H 8.03 4.14 0.00 3.36 3.37 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 7.94 3.97 0.00 1.99 1.83 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 8.67 3.98 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.56 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 44 D 8.22 4.34 0.00 2.91 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 45 L 7.94 3.96 0.00 1.79 1.80 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 46 S 8.26 4.05 0.00 4.07 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 47 A 8.18 3.99 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 48 L 7.92 3.92 0.00 1.92 1.88 0.92 0.89 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 49 T 8.09 3.82 4.37 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 1.21 0.00 0.00 50 V 7.81 3.55 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 1.09 0.00 0.00 0.99 0.00 0.00 51 D 7.88 4.38 0.00 2.80 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 52 T 7.78 4.01 4.37 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 1.21 0.00 0.00 53 L 8.12 3.93 0.00 1.96 1.66 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.21 3.78 0.00 1.99 2.01 0.00 1.85 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.50 7.81 55 T 7.66 4.12 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56 L 7.89 4.21 0.00 1.82 1.57 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00