NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9539 8.3549 109.7365 45.7055 0.0000 173.0935 2 S 4.4396 8.1706 114.9122 57.8252 66.4349 173.9426 3 S 4.6446 8.2630 117.5050 58.0672 67.9633 174.4437 4 G 4.1770 7.9667 105.4766 45.2592 0.0000 172.6343 5 S 4.6171 7.8907 113.6306 56.6312 64.4795 172.9492 6 S 4.6214 8.5522 122.5349 57.0570 64.6714 171.6573 7 G 3.7200 9.0723 119.6033 45.9881 0.0000 175.9107 8 E 3.8977 9.2629 115.2793 56.5276 30.6351 177.3025 9 S 4.7292 8.5576 115.6123 57.0573 65.1512 172.9216 10 L 5.1733 8.3242 124.3123 52.3198 44.9883 176.2745 11 C 4.0439 8.3829 123.1347 59.5940 32.0817 172.9033 12 P 4.5812 0.0000 0.0000 64.3402 31.4389 176.5349 13 Q 4.3510 7.9054 116.5894 57.4653 29.7859 176.1670 14 H 4.4030 8.0540 113.5952 55.9141 29.5513 175.4342 15 H 4.2045 8.3135 114.8745 56.7651 26.6963 174.1122 16 E 4.6377 7.3483 115.0640 53.7786 31.8445 175.4874 17 A 3.7987 8.6261 124.1219 52.6669 18.4617 177.3445 18 L 4.2487 8.2807 123.7911 54.7283 41.3503 176.7807 19 S 4.7512 8.5221 119.0459 57.3684 63.0029 172.7247 20 L 4.9559 7.4694 116.7973 53.3031 47.1098 174.7128 21 F 4.8841 8.7198 121.7834 57.2345 43.2393 172.4491 22 C 4.4525 8.2136 127.6790 58.6853 31.9921 173.2929 23 Y 4.0963 8.9003 125.7727 61.0064 37.9193 177.5523 24 E 4.0114 8.1219 118.9127 60.0669 29.8499 179.0246 25 D 4.3069 7.7724 117.1214 55.3889 41.1336 176.5688 26 Q 3.6435 7.9177 118.8568 56.8234 27.8832 172.3040 27 E 4.9445 7.0745 111.5134 53.7380 33.6077 173.9429 28 A 4.8998 8.6130 122.5432 51.6317 19.6725 177.1114 29 V 4.5735 8.2434 114.7213 59.4959 35.2115 175.5118 30 C 4.4909 8.1728 116.7992 56.9850 31.7000 174.0121 31 L 3.7704 8.3499 120.1786 58.5722 41.7774 178.8193 32 I 3.6636 7.9530 118.8986 65.0324 37.5248 177.7599 33 C 4.0109 7.6391 115.6361 63.3382 27.9197 176.1519 34 A 3.8538 7.7150 121.7262 55.7534 17.7662 179.5919 35 I 3.5422 7.0836 115.2912 64.7796 37.5370 177.9751 36 S 4.2659 8.2137 115.5540 62.6412 62.7712 176.1262 37 H 3.9656 8.5226 118.0938 59.1623 28.2404 177.4075 38 T 3.9284 8.6461 113.1888 65.5212 68.1518 175.1239 39 H 4.3970 8.1482 120.6253 58.5673 29.7098 176.3239 40 R 4.3131 8.3079 117.6007 55.3575 30.2948 175.9627 41 A 3.6722 7.5967 119.1487 53.8423 16.2338 178.0422 42 H 4.9982 8.0637 116.6596 55.1471 31.1966 175.2713 43 T 4.2244 8.4086 121.0723 63.6588 69.4834 173.6131 44 V 5.0154 8.4216 125.6174 61.3785 34.7529 174.6870 45 V 4.8024 8.5478 119.8848 58.5753 35.9990 173.2204 46 P 4.8381 0.0000 0.0000 62.6981 31.5941 176.2877 47 L 4.0896 8.8689 124.3087 57.5560 42.1375 179.2521 48 S 4.0013 8.0093 113.0826 60.1982 63.0127 173.0029 49 G 3.8301 7.4008 104.9505 43.1885 0.0000 171.3762 50 P 4.4566 0.0000 0.0000 63.0226 31.9871 175.4651 51 S 4.7122 8.1159 115.2487 56.8088 67.2000 174.4918 52 S 4.1036 9.0293 116.4173 61.5544 62.7065 174.7643 53 G 4.3551 8.1062 113.6036 45.2365 0.0000 172.6000 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 3.95 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 0.00 0.00 0.00 2 S 8.17 4.44 0.00 3.89 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 3 S 8.26 4.64 0.00 3.80 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 7.97 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 4.62 0.00 3.83 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 6 S 8.55 4.62 0.00 3.87 3.75 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 7 G 9.07 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 0.00 0.00 0.00 8 E 9.26 3.90 0.00 2.08 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 2.33 0.00 9 S 8.56 4.73 0.00 3.77 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 10 L 8.32 5.17 0.00 1.51 1.63 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 11 C 8.38 4.04 0.00 2.97 3.01 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 0.00 0.00 0.00 12 P 0.00 4.58 0.00 2.22 2.16 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 13 Q 7.91 4.35 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 7.01 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 14 H 8.05 4.40 0.00 3.20 3.33 0.00 5.97 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 15 H 8.31 4.20 0.00 3.24 3.39 0.00 5.80 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.35 4.64 0.00 1.94 1.82 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 2.47 2.38 0.00 17 A 8.63 3.80 1.26 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 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.28 4.25 0.00 1.69 1.66 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.52 4.75 0.00 3.81 3.75 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 20 L 7.47 4.96 0.00 1.84 1.47 0.90 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 21 F 8.72 4.88 0.00 3.05 2.67 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 0.00 0.00 0.00 0.00 22 C 8.21 4.45 0.00 2.78 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.90 4.10 0.00 3.07 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 24 E 8.12 4.01 0.00 1.74 1.84 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 2.30 2.23 0.00 25 D 7.77 4.31 0.00 2.53 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 7.92 3.64 0.00 2.26 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.98 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 27 E 7.07 4.94 0.00 1.99 1.93 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 2.06 2.18 0.00 28 A 8.61 4.90 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.24 4.57 1.95 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 0.68 0.00 0.00 0.74 0.00 0.00 30 C 8.17 4.49 0.00 3.05 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.35 3.77 0.00 1.68 1.67 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 32 I 7.95 3.66 1.68 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 0.85 0.97 0.00 0.00 33 C 7.64 4.01 0.00 3.01 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 34 A 7.72 3.85 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 35 I 7.08 3.54 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 1.53 0.68 0.93 0.00 0.00 36 S 8.21 4.27 0.00 4.03 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 37 H 8.52 3.97 0.00 3.32 3.36 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.65 3.93 4.26 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 0.00 0.00 0.00 1.25 0.00 0.00 39 H 8.15 4.40 0.00 3.52 3.48 0.00 5.77 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 8.31 4.31 0.00 1.66 1.77 0.00 3.43 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 41 A 7.60 3.67 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 42 H 8.06 5.00 0.00 3.19 3.26 0.00 5.72 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.41 4.22 4.40 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 1.37 0.00 0.00 44 V 8.42 5.02 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 0.78 0.00 0.00 1.00 0.00 0.00 45 V 8.55 4.80 2.19 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 1.11 0.00 0.00 1.03 0.00 0.00 46 P 0.00 4.84 0.00 2.24 2.07 0.00 3.42 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.86 0.00 47 L 8.87 4.09 0.00 1.77 1.69 1.05 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.01 4.00 0.00 3.96 4.04 0.00 0.00 0.00 0.00 0.00 0.00 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 7.40 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.46 0.00 2.20 2.07 0.00 3.74 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 51 S 8.12 4.71 0.00 3.82 3.75 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 52 S 9.03 4.10 0.00 3.97 4.01 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 0.00 0.00 0.00 53 G 8.11 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00