NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.7966 8.1633 120.6366 55.5829 33.9063 173.8745 2 L 4.8932 8.4033 126.0169 51.4804 46.3000 174.6565 3 Q 4.1003 9.2444 124.6867 56.4506 30.8110 174.8928 4 L 4.2550 8.6758 125.3058 54.0128 45.5915 176.1534 5 N 4.2154 9.1219 119.7952 54.1347 35.9594 173.8120 6 G 4.1228 8.0851 109.5770 44.8357 0.0000 171.5819 7 K 4.5115 7.8601 119.7107 54.7376 34.2557 173.9259 8 D 5.3369 8.3577 121.5638 52.7404 42.8498 176.3575 9 V 4.6442 8.1447 114.1645 59.9359 36.6381 174.3935 10 K 4.7470 8.6380 121.6335 55.3392 33.3444 176.7695 11 W 5.1558 8.4637 131.0948 55.4707 32.3445 174.4277 12 K 3.9904 8.1361 128.4660 57.8842 32.0432 178.1552 13 K 3.7589 8.6717 123.2855 54.6747 28.1916 173.0252 14 D 4.7310 6.8581 118.4655 56.7633 40.3957 173.9054 15 T 3.9720 7.8766 115.0436 62.0106 68.6412 174.2244 16 G 4.1453 7.7693 116.3944 44.8359 0.0000 171.3368 17 T 4.9337 7.7315 110.0131 59.1682 72.8482 175.1241 18 I 3.5768 8.0103 120.7575 64.3654 37.0217 178.1207 19 Q 3.7641 7.4665 120.0601 59.6387 28.8903 178.6412 20 D 4.6131 7.5918 118.2578 57.7229 40.4644 178.9581 21 L 4.1517 8.0750 120.5210 58.1629 41.5346 178.7809 22 L 3.9838 7.7638 116.6792 56.6728 41.4087 179.1110 23 A 4.3624 7.9693 121.3672 54.7066 18.3625 178.8216 24 S 4.3329 7.6848 107.5112 59.8599 63.3247 174.2201 25 Y 4.7556 7.5936 116.3936 57.6145 39.0492 175.7491 26 Q 3.9821 8.8514 117.2165 56.8201 25.3828 173.2337 27 L 4.9541 7.7253 114.8804 54.4582 42.8580 177.9716 28 E 4.2490 8.5948 120.1912 58.7272 29.8688 178.6223 29 N 4.7427 8.1230 116.3365 54.1903 40.5756 177.3383 30 K 4.4082 7.7402 121.1297 54.0873 32.5367 180.2442 31 I 4.6213 8.1982 116.2929 61.1672 40.0322 175.9803 32 V 4.8782 7.9624 118.7013 60.4980 35.8421 173.4174 33 I 4.8267 8.5466 122.8106 59.8417 41.7462 174.9375 34 V 4.9985 8.1574 115.9875 59.6658 36.2990 174.2467 35 E 4.9185 8.8675 122.3835 54.6085 32.1810 174.8305 36 R 4.5542 8.5221 126.6258 54.8082 31.1118 175.9516 37 N 4.1061 8.7779 129.1145 57.0136 35.8387 174.9189 38 K 3.9417 7.7124 110.8370 55.0425 29.9964 175.6550 39 E 4.6845 7.5398 120.4082 54.8777 31.6236 174.9974 40 I 4.1819 8.3380 127.2451 61.3307 36.8155 175.3365 41 I 4.5083 9.1270 127.4642 59.5818 40.0963 175.5074 42 G 4.2005 8.7532 116.2730 44.9528 0.0000 175.2313 43 K 3.1628 8.6181 121.0675 57.2333 31.5606 178.5208 44 E 4.0696 8.0716 115.8126 58.2515 29.8787 177.3334 45 R 4.5985 7.7044 119.6137 56.3523 30.5595 177.5154 46 Y 4.2591 7.9308 115.9866 61.1964 38.0591 178.3626 47 H 4.4300 8.2965 115.3142 58.9405 29.0181 176.7959 48 E 4.0159 8.2514 117.5040 58.4386 29.8399 176.6362 49 V 4.1418 7.7364 119.5152 61.5245 32.4972 174.8793 50 E 4.7678 8.6338 128.2040 55.1336 30.6752 176.4375 51 L 3.7888 8.4120 124.5501 55.3427 42.0532 178.4487 52 C 4.2697 9.1392 125.0828 61.5264 26.1045 175.9663 53 D 3.6819 6.5376 117.6586 53.3562 42.6704 177.1450 54 R 4.6122 7.9044 128.3142 56.5791 30.1310 174.7601 55 D 4.3079 7.9932 122.7768 52.9965 42.8684 174.9221 56 V 4.1795 7.8797 117.7212 61.7910 32.4306 174.3461 57 I 5.3369 7.8478 128.4250 58.8641 39.5791 174.7842 58 E 4.8448 8.6937 126.9259 54.7387 31.4427 174.9688 59 I 4.7469 7.7916 126.3492 60.3510 38.5317 176.0568 60 V 4.5087 8.9564 125.2628 60.2685 35.1748 173.6363 61 H 5.1963 8.4600 115.8668 53.8700 31.9429 173.7324 62 F 4.4802 8.9758 118.7547 56.8191 37.7255 175.6520 63 V 4.2336 7.7865 119.2429 59.5114 31.8667 176.5206 64 G 4.2972 8.4375 111.5732 45.8409 0.0000 171.1451 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 M 8.16 4.80 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.61 0.00 2 L 8.40 4.89 0.00 1.49 1.54 0.37 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 3 Q 9.24 4.10 0.00 2.18 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 4 L 8.68 4.26 0.00 1.62 1.49 1.01 0.37 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 5 N 9.12 4.22 0.00 2.82 2.85 0.00 0.00 7.15 7.53 0.00 0.00 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 G 8.09 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 7.86 4.51 0.00 1.79 1.68 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.40 7.81 8 D 8.36 5.34 0.00 2.59 2.57 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 9 V 8.14 4.64 2.17 0.00 0.00 0.00 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 1.03 0.00 0.00 10 K 8.64 4.75 0.00 1.69 1.78 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.68 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.46 7.81 11 W 8.46 5.16 0.00 3.23 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 12 K 8.14 3.99 0.00 1.49 1.46 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.37 7.81 13 K 8.67 3.76 0.00 1.96 1.84 0.00 1.96 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.23 1.01 7.81 14 D 6.86 4.73 0.00 2.99 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.88 3.97 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 1.20 0.00 0.00 16 G 7.77 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 0.00 0.00 0.00 17 T 7.73 4.93 4.32 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 18 I 8.01 3.58 1.42 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.68 0.36 0.00 0.00 19 Q 7.47 3.76 0.00 2.24 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.72 0.00 0.00 0.00 0.00 0.00 2.57 2.59 0.00 20 D 7.59 4.61 0.00 3.22 2.99 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 21 L 8.07 4.15 0.00 1.11 1.55 0.75 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.76 3.98 0.00 1.87 1.82 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.97 4.36 1.39 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 0.00 0.00 0.00 24 S 7.68 4.33 0.00 3.74 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 25 Y 7.59 4.76 0.00 3.08 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 26 Q 8.85 3.98 0.00 2.30 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.54 0.00 0.00 0.00 0.00 0.00 2.27 2.47 0.00 27 L 7.73 4.95 0.00 1.64 1.65 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.59 4.25 0.00 2.10 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 0.00 2.68 2.40 0.00 29 N 8.12 4.74 0.00 2.73 2.88 0.00 0.00 6.80 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 7.74 4.41 0.00 1.77 1.58 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.36 0.99 7.81 31 I 8.20 4.62 1.92 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 1.59 1.35 1.04 0.00 0.00 32 V 7.96 4.88 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 1.02 0.00 0.00 33 I 8.55 4.83 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.57 0.91 0.00 0.00 34 V 8.16 5.00 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 0.74 0.00 0.00 1.12 0.00 0.00 35 E 8.87 4.92 0.00 1.93 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 2.29 2.25 0.00 36 R 8.52 4.55 0.00 1.83 1.82 0.00 3.20 0.00 0.00 3.14 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 37 N 8.78 4.11 0.00 2.86 2.85 0.00 0.00 7.19 7.30 0.00 0.00 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 K 7.71 3.94 0.00 1.84 1.68 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.28 0.97 7.81 39 E 7.54 4.68 0.00 1.89 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 2.18 2.23 0.00 40 I 8.34 4.18 1.87 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 1.33 0.64 0.91 0.00 0.00 41 I 9.13 4.51 1.92 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 1.29 1.28 0.96 0.00 0.00 42 G 8.75 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.62 3.16 0.00 1.69 1.84 0.00 1.80 0.00 0.00 1.87 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.01 7.81 44 E 8.07 4.07 0.00 2.05 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 0.00 2.29 2.25 0.00 45 R 7.70 4.60 0.00 1.88 1.98 0.00 3.12 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 46 Y 7.93 4.26 0.00 3.15 3.12 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 0.00 0.00 0.00 0.00 47 H 8.30 4.43 0.00 3.19 3.38 0.00 5.70 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.25 4.02 0.00 2.00 2.04 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 2.38 2.28 0.00 49 V 7.74 4.14 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 0.94 0.00 0.00 1.01 0.00 0.00 50 E 8.63 4.77 0.00 1.89 2.04 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 2.30 2.41 0.00 51 L 8.41 3.79 0.00 1.69 1.60 0.78 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 52 C 9.14 4.27 0.00 2.95 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 53 D 6.54 3.68 0.00 2.75 2.83 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 54 R 7.90 4.61 0.00 1.69 1.93 0.00 3.47 0.00 0.00 4.01 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.43 0.00 55 D 7.99 4.31 0.00 3.04 2.71 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 56 V 7.88 4.18 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 1.00 0.00 0.00 0.97 0.00 0.00 57 I 7.85 5.34 1.77 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.11 0.82 0.00 0.00 58 E 8.69 4.84 0.00 1.95 1.81 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 2.24 2.30 0.00 59 I 7.79 4.75 1.72 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.31 0.79 0.00 0.00 60 V 8.96 4.51 1.97 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 0.60 0.00 0.00 0.83 0.00 0.00 61 H 8.46 5.20 0.00 3.11 3.30 0.00 5.54 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 62 F 8.98 4.48 0.00 3.03 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.79 4.23 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 0.72 0.00 0.00 0.94 0.00 0.00 64 G 8.44 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00