NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4436 0.0000 0.0000 62.3509 33.6121 175.1251 2 I 4.7397 8.3051 123.4145 59.1905 39.9012 172.9370 3 A 4.5894 9.1130 130.7594 50.3531 21.3324 174.8753 4 Q 4.9146 8.6629 124.1374 54.5203 30.8571 174.5188 5 I 4.4149 8.8384 128.1322 59.9007 39.5729 174.3574 6 H 5.2544 8.7727 125.0829 54.6979 29.7621 174.8071 7 I 4.6397 8.4685 116.3526 58.5926 41.1900 175.1291 8 R 4.5294 8.5209 123.0187 56.2444 30.3619 176.5231 9 E 4.1627 8.9783 121.3861 56.4865 31.1356 175.9166 10 G 3.5832 7.1217 109.9986 45.5991 0.0000 174.0234 11 R 4.7309 7.6529 117.9585 53.0765 33.8569 176.3436 12 S 4.3528 8.2806 114.9337 58.2230 65.2551 175.0334 13 D 4.3224 8.6202 123.3000 57.7204 40.6644 178.6186 14 E 3.9296 8.2828 118.4713 59.9017 29.4871 179.3015 15 Q 3.9743 7.9466 118.5003 59.2318 29.0625 178.4886 16 K 3.9911 8.0532 119.4597 59.3258 32.1101 178.9056 17 E 3.9683 8.0520 119.2825 59.1087 29.5050 179.0262 18 T 3.8736 8.0455 116.1755 66.2660 68.4462 176.1660 19 L 3.8905 7.9486 122.2689 58.3817 42.0556 178.7953 20 I 3.6580 7.8459 119.5752 64.5799 37.1453 178.3096 21 R 3.8568 7.7765 118.4457 59.5027 29.9508 178.2869 22 E 3.9511 8.7000 118.6298 59.4627 29.4133 179.6524 23 V 3.5644 8.0286 118.3448 66.0738 31.5520 178.0505 24 S 4.1069 8.1577 114.9790 61.7761 62.6660 176.4732 25 E 3.8937 8.3166 121.5692 59.1188 29.3656 178.6705 26 A 4.0079 8.1926 120.9458 55.1678 18.3534 179.5611 27 I 3.6121 8.0984 118.6539 64.5255 37.3406 178.3030 28 S 4.0587 8.2439 113.9308 61.6131 62.0473 176.1253 29 R 3.8610 8.3504 121.6671 59.7386 29.6718 178.6785 30 S 4.2182 8.1355 112.5776 60.5218 63.2553 175.2266 31 L 4.3389 8.0297 120.6015 53.4463 42.2228 175.5041 32 D 4.3259 7.7638 117.3268 55.3003 40.1229 172.8094 33 A 4.8074 7.5049 118.4544 49.1214 21.8923 175.7619 34 P 4.3832 0.0000 0.0000 62.2452 32.3287 177.6555 35 L 3.9578 8.7167 124.6419 58.4311 42.1347 179.1553 36 T 3.9271 7.9009 106.8847 63.8046 68.6192 174.6806 37 S 4.3145 7.6599 115.3805 58.9164 63.6996 173.9723 38 V 4.2307 7.6658 122.6519 62.1810 31.8274 175.1703 39 R 4.7429 8.8626 127.4982 54.3051 33.0343 175.2363 40 V 4.8098 8.3694 122.3379 61.1263 34.4901 174.3455 41 I 4.5014 8.9684 128.6849 59.5807 39.7745 174.3779 42 I 4.7803 8.3640 127.6841 59.9263 39.0552 175.0442 43 T 4.5396 8.8509 124.2795 61.7430 70.9717 173.2618 44 E 4.8654 8.8299 126.1353 55.7583 31.3385 175.7588 45 M 4.6619 8.9886 123.2284 53.2490 34.1545 175.9951 46 A 4.6436 8.5272 126.2318 51.2791 19.2207 178.1884 47 K 4.0801 8.7211 118.8291 58.4669 32.2419 178.4648 48 G 4.1558 7.9365 106.3923 45.5330 0.0000 173.0572 49 H 4.9729 8.5682 114.3628 54.9487 29.8087 173.8130 50 F 5.0765 8.1419 122.4145 56.2998 41.8295 173.3968 51 G 4.1919 8.5300 116.2063 43.4557 0.0000 171.9011 52 I 4.0983 8.0224 123.6707 59.9918 39.0472 176.1757 53 G 3.7179 9.4795 114.0394 46.5193 0.0000 174.4634 54 G 3.9309 8.4578 107.8845 44.8426 0.0000 173.9944 55 E 4.6785 7.3415 119.2570 53.9167 32.0041 175.5937 56 L 4.1831 8.1455 121.1524 54.6388 42.7085 178.2994 57 A 3.8272 8.7042 126.2042 55.5106 18.5072 180.0768 58 S 4.1977 8.2088 110.2726 61.7136 62.9928 176.1428 59 K 4.2381 7.7447 118.1067 57.7996 32.1733 177.9644 60 V 4.2156 7.4304 108.8305 59.7332 33.8817 176.8469 61 R 4.2635 9.4312 123.4589 57.2937 30.7595 176.0291 62 G 3.7810 7.6842 109.4514 46.1098 0.0000 172.6896 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 P 0.00 4.44 0.00 2.08 2.03 0.00 3.60 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 2 I 8.31 4.74 1.86 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 1.27 0.72 0.90 0.00 0.00 3 A 9.11 4.59 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 8.66 4.91 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.67 0.00 0.00 0.00 0.00 0.00 2.09 2.27 0.00 5 I 8.84 4.41 1.83 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 1.20 0.50 0.88 0.00 0.00 6 H 8.77 5.25 0.00 2.90 3.06 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.47 4.64 1.83 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 1.18 0.91 0.87 0.00 0.00 8 R 8.52 4.53 0.00 1.73 1.95 0.00 3.34 0.00 0.00 3.64 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 9 E 8.98 4.16 0.00 2.03 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 0.00 2.29 2.27 0.00 10 G 7.12 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.65 4.73 0.00 1.75 1.90 0.00 3.21 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 12 S 8.28 4.35 0.00 4.31 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 13 D 8.62 4.32 0.00 2.74 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 14 E 8.28 3.93 0.00 2.04 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 2.41 2.46 0.00 15 Q 7.95 3.97 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 16 K 8.05 3.99 0.00 1.98 1.83 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.43 7.81 17 E 8.05 3.97 0.00 2.28 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 0.00 2.30 2.34 0.00 18 T 8.05 3.87 4.42 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 1.21 0.00 0.00 19 L 7.95 3.89 0.00 1.75 1.89 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.85 3.66 1.86 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 1.39 0.54 0.90 0.00 0.00 21 R 7.78 3.86 0.00 1.89 2.06 0.00 3.10 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 22 E 8.70 3.95 0.00 1.96 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 2.52 2.46 0.00 23 V 8.03 3.56 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 0.94 0.00 0.00 24 S 8.16 4.11 0.00 4.13 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 25 E 8.32 3.89 0.00 2.24 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 2.30 2.32 0.00 26 A 8.19 4.01 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 27 I 8.10 3.61 2.00 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 1.40 0.73 0.91 0.00 0.00 28 S 8.24 4.06 0.00 3.87 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 29 R 8.35 3.86 0.00 1.95 1.97 0.00 3.14 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 30 S 8.14 4.22 0.00 4.07 3.98 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 0.00 0.00 0.00 31 L 8.03 4.34 0.00 1.62 1.74 0.92 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.76 4.33 0.00 2.71 2.70 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 33 A 7.50 4.81 1.24 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 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.38 0.00 2.19 1.98 0.00 3.61 0.00 0.00 3.69 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 35 L 8.72 3.96 0.00 1.67 1.66 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.90 3.93 4.24 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 0.00 0.00 0.00 1.21 0.00 0.00 37 S 7.66 4.31 0.00 4.03 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 38 V 7.67 4.23 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 0.76 0.00 0.00 0.97 0.00 0.00 39 R 8.86 4.74 0.00 1.77 1.77 0.00 3.11 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 40 V 8.37 4.81 2.07 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 0.80 0.00 0.00 0.92 0.00 0.00 41 I 8.97 4.50 1.83 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 1.21 0.49 0.87 0.00 0.00 42 I 8.36 4.78 1.84 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 1.31 0.53 0.88 0.00 0.00 43 T 8.85 4.54 3.94 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 1.20 0.00 0.00 44 E 8.83 4.87 0.00 1.84 1.86 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 2.25 2.31 0.00 45 M 8.99 4.66 0.00 1.90 1.87 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.42 0.00 46 A 8.53 4.64 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.72 4.08 0.00 1.75 1.90 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.66 7.81 48 G 7.94 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.57 4.97 0.00 3.28 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.14 5.08 0.00 2.94 2.89 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 51 G 8.53 4.19 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 0.00 0.00 0.00 52 I 8.02 4.10 1.67 0.00 0.00 0.74 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 0.04 0.83 0.00 0.00 53 G 9.48 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 54 G 8.46 3.93 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 0.00 0.00 0.00 55 E 7.34 4.68 0.00 1.89 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 2.20 2.36 0.00 56 L 8.15 4.18 0.00 1.68 1.56 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.70 3.83 1.19 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 0.00 0.00 58 S 8.21 4.20 0.00 3.87 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 59 K 7.74 4.24 0.00 1.85 1.84 0.00 1.52 0.00 0.00 1.69 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.44 7.81 60 V 7.43 4.22 2.05 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 0.76 0.00 0.00 0.90 0.00 0.00 61 R 9.43 4.26 0.00 1.88 2.07 0.00 3.37 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 62 G 7.68 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