NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2101 8.1233 123.5519 52.2429 20.9729 179.0465 3 F 4.1466 7.6381 114.3674 59.9482 39.0062 175.8468 4 L 4.1396 8.2767 119.7629 57.9239 42.3025 178.7196 5 G 3.5717 8.0725 105.0114 47.8876 0.0000 175.3071 6 A 4.0283 8.2119 123.8036 54.7060 18.3526 179.5958 7 A 4.0049 8.1602 119.2710 55.3031 18.5400 179.9727 8 I 3.7540 7.7665 117.7411 64.2233 37.2358 178.4662 9 A 3.9931 8.0566 121.5322 55.0640 18.1756 179.6349 10 A 4.0520 8.2071 119.4709 55.2278 18.4591 180.2046 11 G 3.5157 8.2530 104.3296 47.7525 0.0000 175.9595 12 L 3.9726 7.8474 120.9972 57.6609 41.7010 179.5867 13 A 3.9700 8.2082 120.3476 54.9291 18.2202 179.5913 14 A 3.9238 8.2389 119.6182 55.2759 18.6094 180.0441 15 V 3.4993 8.0151 116.6365 65.9592 31.6323 177.9864 16 A 4.0776 8.3112 120.8601 55.1819 18.2758 179.8608 17 G 3.5716 8.4883 105.1468 47.3553 0.0000 175.7281 18 A 4.0022 7.9620 123.7840 54.9351 18.3872 179.8755 19 I 3.6668 7.7258 117.7875 64.2004 37.1109 178.4909 20 A 3.9645 7.9585 121.6860 55.2749 18.2260 179.7880 21 V 3.5255 7.8156 116.4732 66.1063 31.4945 177.9587 22 A 4.0138 8.2003 120.5165 55.2833 18.2154 179.7346 23 I 3.6521 7.9912 118.3285 64.5763 37.2180 178.8047 24 I 3.7132 7.9004 120.7182 64.4072 36.8620 178.7697 25 V 3.5933 8.2267 119.5918 65.6568 31.3235 177.9015 26 K 3.8532 8.3371 119.4698 59.4111 31.9763 178.5415 27 A 3.9739 8.0318 120.9417 55.5883 18.3161 179.7482 28 T 3.7785 7.8874 114.1558 66.8102 68.6050 177.0464 29 I 3.7179 8.0103 121.9436 64.3822 37.0877 178.4141 30 E 4.0912 8.4399 119.7189 59.3238 29.2648 179.6830 31 G 3.6011 8.2962 105.9259 48.0412 0.0000 176.0330 32 T 3.9112 8.1020 118.0635 66.5972 68.1528 177.0321 33 T 3.9036 7.5988 116.8522 66.5777 68.5358 176.6575 34 R 4.2733 7.6832 118.6448 57.7913 31.7262 177.2164 35 Q 4.9989 8.0554 116.4018 52.2199 29.8359 173.4797 36 P 4.4225 0.0000 0.0000 64.6988 32.2970 178.6213 37 E 4.0524 8.2701 116.7597 58.3843 29.6516 177.8363 38 L 4.6384 8.1007 118.7170 54.2051 41.9816 177.7017 39 R 3.9212 7.9564 121.7157 59.8352 29.8692 178.6198 40 G 3.5609 7.9852 104.4654 48.1217 0.0000 175.3656 41 T 3.8736 7.7916 115.3874 64.8094 67.5706 176.1863 42 L 4.0061 8.3719 121.3776 57.5498 41.5831 179.1149 43 Q 3.7354 7.9527 119.6207 58.8829 28.9379 178.1683 44 T 3.9872 7.8433 117.1692 66.3114 68.4767 176.6525 45 L 3.9846 7.7587 120.7292 58.1431 41.6162 179.3338 46 M 4.0738 7.8208 117.7501 58.5749 31.9401 178.0265 47 F 4.7822 7.8522 116.4901 59.6550 38.9103 177.5374 48 I 4.1649 7.9198 120.2229 63.9744 37.1150 178.4155 49 G 3.6173 8.6864 106.9247 47.6198 0.0000 175.8098 50 V 3.6311 8.0516 121.0003 65.4756 31.4551 176.3718 51 P 4.2831 0.0000 0.0000 65.5254 30.9767 178.5590 52 L 3.9964 7.4700 115.6571 57.8353 41.6207 179.1782 53 A 4.1443 8.1561 119.9341 54.9744 18.2487 178.9502 54 E 4.1502 8.2465 115.7735 57.7309 29.7622 178.5801 55 A 4.0306 7.6182 122.0960 55.6060 18.3410 179.8826 56 V 3.5866 7.6835 115.6160 65.4745 31.8000 176.1113 57 P 4.2379 0.0000 0.0000 65.8759 31.1393 178.5749 58 I 3.8083 8.1509 118.7849 64.2547 36.9265 178.5585 59 I 3.7110 7.7820 120.4000 64.3628 36.8863 178.3077 60 A 3.9940 8.3409 121.8481 55.1687 18.2083 179.8426 61 I 3.6736 7.5757 118.0478 64.4392 37.1742 178.6456 62 V 3.6283 7.8379 119.1135 66.0489 31.3079 178.0811 63 I 3.6826 8.0251 119.6206 64.5909 37.0098 178.0066 64 S 4.1390 8.2645 114.0568 61.8610 62.0284 176.4680 65 L 4.2401 7.8678 120.7836 57.6732 41.2377 179.2738 66 L 4.1224 7.9076 118.1741 57.7963 41.6002 179.2921 67 I 3.8320 7.9975 119.2319 64.3212 37.1458 178.1925 68 L 3.8706 7.6135 118.1518 57.4723 41.5819 177.8515 69 F 4.5614 8.5245 120.7539 57.5690 39.2454 175.6702 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 8.12 4.21 0.99 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 3 F 7.64 4.15 0.00 3.17 2.97 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 4 L 8.28 4.14 0.00 1.81 1.70 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.07 3.57 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 6 A 8.21 4.03 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 7 A 8.16 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.77 3.75 2.00 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 1.46 1.33 0.92 0.00 0.00 9 A 8.06 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 10 A 8.21 4.05 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 11 G 8.25 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.85 3.97 0.00 2.10 1.74 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.21 3.97 1.46 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 0.00 0.00 0.00 14 A 8.24 3.92 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.02 3.50 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.01 0.00 0.00 16 A 8.31 4.08 1.37 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 0.00 0.00 17 G 8.49 3.57 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 18 A 7.96 4.00 1.37 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 0.00 0.00 19 I 7.73 3.67 1.93 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 1.69 0.84 0.91 0.00 0.00 20 A 7.96 3.96 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.82 3.53 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 1.08 0.00 0.00 1.03 0.00 0.00 22 A 8.20 4.01 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.99 3.65 2.02 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 1.52 0.89 0.91 0.00 0.00 24 I 7.90 3.71 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 1.41 1.06 0.91 0.00 0.00 25 V 8.23 3.59 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.97 0.00 0.00 26 K 8.34 3.85 0.00 1.95 1.96 0.00 1.69 0.00 0.00 1.65 0.00 0.00 3.28 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.46 7.81 27 A 8.03 3.97 1.40 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 0.00 0.00 28 T 7.89 3.78 4.31 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 1.10 0.00 0.00 29 I 8.01 3.72 1.98 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 1.50 1.15 0.90 0.00 0.00 30 E 8.44 4.09 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 31 G 8.30 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.10 3.91 4.25 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 1.19 0.00 0.00 33 T 7.60 3.90 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 34 R 7.68 4.27 0.00 1.76 1.97 0.00 3.23 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 35 Q 8.06 5.00 0.00 2.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 36 P 0.00 4.42 0.00 2.16 2.10 0.00 3.87 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 37 E 8.27 4.05 0.00 2.06 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 2.39 2.39 0.00 38 L 8.10 4.64 0.00 1.70 1.63 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.96 3.92 0.00 2.04 1.94 0.00 3.08 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 40 G 7.99 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.79 3.87 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 1.23 0.00 0.00 42 L 8.37 4.01 0.00 1.63 1.64 0.90 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 7.95 3.74 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 1.81 1.59 0.00 44 T 7.84 3.99 4.39 0.00 0.00 0.00 0.00 0.00 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 45 L 7.76 3.98 0.00 1.99 1.69 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 46 M 7.82 4.07 0.00 1.94 1.93 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.43 0.00 47 F 7.85 4.78 0.00 3.12 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 48 I 7.92 4.16 2.04 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.34 0.94 0.00 0.00 49 G 8.69 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.05 3.63 2.25 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 1.07 0.00 0.00 1.07 0.00 0.00 51 P 0.00 4.28 0.00 2.21 2.09 0.00 3.83 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.19 0.00 52 L 7.47 4.00 0.00 1.84 1.74 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.16 4.14 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 54 E 8.25 4.15 0.00 2.16 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 0.00 2.52 2.48 0.00 55 A 7.62 4.03 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 56 V 7.68 3.59 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 1.16 0.00 0.00 0.94 0.00 0.00 57 P 0.00 4.24 0.00 2.44 2.29 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.20 0.00 58 I 8.15 3.81 2.07 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 1.53 0.96 0.92 0.00 0.00 59 I 7.78 3.71 2.00 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 1.46 0.75 0.92 0.00 0.00 60 A 8.34 3.99 1.37 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 0.00 0.00 61 I 7.58 3.67 2.07 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 1.63 1.21 0.94 0.00 0.00 62 V 7.84 3.63 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.96 0.00 0.00 63 I 8.03 3.68 2.03 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 1.42 0.42 0.92 0.00 0.00 64 S 8.26 4.14 0.00 3.90 4.15 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 65 L 7.87 4.24 0.00 2.04 1.90 0.97 0.75 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 66 L 7.91 4.12 0.00 1.77 1.77 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 67 I 8.00 3.83 2.06 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 1.51 0.66 0.91 0.00 0.00 68 L 7.61 3.87 0.00 1.60 0.88 0.74 0.87 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 69 F 8.52 4.56 0.00 3.03 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