NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5573 8.2076 120.4818 54.5054 43.3611 177.5284 2 Y 3.9730 7.2155 117.9621 59.6317 38.0005 176.5796 3 L 4.0358 7.6521 121.1421 56.7610 42.0204 180.4826 4 R 4.0317 7.5201 117.8863 58.5755 30.5159 177.9343 5 E 3.9396 8.4515 119.4900 59.2397 29.5684 178.7447 6 L 4.0017 8.1657 119.0704 57.9807 41.5704 179.1473 7 L 3.9779 7.7298 118.5704 58.1672 42.2273 178.7474 8 K 4.1049 8.3440 119.8080 59.5917 32.2210 178.9536 9 L 4.0694 8.1417 119.3047 57.6980 41.5353 179.2019 10 E 4.1266 8.2815 118.3174 58.9377 29.3011 179.2372 11 L 4.1309 7.6844 118.9879 57.5410 41.7773 179.1741 12 Q 4.0738 8.0293 117.3987 58.6149 28.6063 178.3997 13 A 3.8374 7.9534 121.8124 55.1881 18.4478 179.4550 14 I 3.7790 7.7588 118.1820 64.5853 37.0383 178.2883 15 K 3.8482 8.2575 119.0232 59.7788 32.1625 178.2010 16 Q 4.0931 8.2733 118.2658 59.4268 28.6997 178.6247 17 Y 4.1470 8.0621 117.5204 61.3096 37.6967 178.9859 18 R 4.0285 8.6547 118.3230 59.4332 30.4424 178.7527 19 E 4.0887 8.9746 118.6698 59.2731 29.5053 178.8861 20 A 4.0425 8.1052 120.1749 55.5083 17.9680 179.1721 21 L 3.9299 8.4107 118.8223 58.2890 41.9497 178.5353 22 E 4.2007 8.0433 117.0442 57.7049 29.7043 176.2964 23 Y 4.1948 7.9680 118.6759 58.7434 39.8258 175.7911 24 V 4.2067 7.5947 121.6228 60.7060 31.6182 176.5338 25 K 4.5096 8.0669 132.0678 55.1586 30.7032 178.7945 26 L 4.1310 7.8068 121.8537 54.4691 41.5257 174.9659 27 P 4.1209 0.0000 0.0000 65.8634 31.3306 178.3716 28 V 4.1583 7.9449 117.1945 65.3235 30.6830 178.1341 29 L 3.9019 7.6297 117.7597 57.5986 41.2706 178.9238 30 A 4.1467 9.3671 120.4344 54.1106 18.5218 179.5328 31 K 3.7996 7.8233 118.1496 59.8415 32.6527 178.7566 32 I 3.6754 7.5301 120.0632 64.3081 36.9110 178.0484 33 L 3.8039 7.1021 120.1503 57.5656 41.8566 178.4859 34 E 3.8163 8.3507 119.8620 59.3405 29.6189 178.4496 35 D 4.1942 7.9117 118.3921 57.2897 40.8523 178.3657 36 E 3.9196 7.4762 117.5065 58.7377 29.4849 178.7338 37 E 3.9866 7.8773 117.7282 59.4529 29.6644 178.5349 38 K 3.7366 8.3704 119.7223 58.2098 31.1889 179.5780 39 H 4.1184 8.5992 115.7016 58.7915 28.8424 177.1168 40 I 4.2973 8.0939 121.7253 64.6623 37.0051 178.0902 41 E 3.8849 8.4258 120.1379 59.0931 29.1919 178.8071 42 W 4.5512 7.8695 118.3648 59.9586 29.0026 178.2106 43 L 4.1174 9.2836 117.5086 58.0217 41.4474 179.0957 44 E 4.1489 8.3208 118.5329 59.8246 29.3993 179.7002 45 T 3.9445 8.0696 115.6790 66.7132 68.3458 176.6859 46 I 3.7204 7.2692 120.2808 64.2066 37.2377 177.4639 47 L 4.5789 7.5793 116.6282 55.1442 42.1294 176.9011 48 G 3.7380 7.7182 112.4875 45.8897 0.0000 172.6695 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 D 8.21 4.56 0.00 2.75 2.77 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 2 Y 7.22 3.97 0.00 3.36 3.27 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.65 4.04 0.00 1.54 1.71 0.71 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 4 R 7.52 4.03 0.00 1.95 1.93 0.00 3.08 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 5 E 8.45 3.94 0.00 2.08 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 2.34 2.43 0.00 6 L 8.17 4.00 0.00 1.90 1.78 1.03 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 7 L 7.73 3.98 0.00 1.64 1.85 0.94 0.57 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 8 K 8.34 4.10 0.00 1.84 1.92 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.48 7.81 9 L 8.14 4.07 0.00 1.76 1.72 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.28 4.13 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 11 L 7.68 4.13 0.00 1.87 1.71 0.93 1.10 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 12 Q 8.03 4.07 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 13 A 7.95 3.84 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 14 I 7.76 3.78 2.12 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 1.49 1.32 0.94 0.00 0.00 15 K 8.26 3.85 0.00 1.69 1.99 0.00 1.81 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.50 7.81 16 Q 8.27 4.09 0.00 2.12 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.56 0.00 0.00 0.00 0.00 0.00 2.49 2.44 0.00 17 Y 8.06 4.15 0.00 3.28 2.91 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.65 4.03 0.00 2.08 2.04 0.00 3.18 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 19 E 8.97 4.09 0.00 2.07 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 2.34 2.43 0.00 20 A 8.11 4.04 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 21 L 8.41 3.93 0.00 1.88 1.87 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.04 4.20 0.00 2.17 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 0.00 2.35 2.33 0.00 23 Y 7.97 4.19 0.00 2.99 3.08 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 0.00 0.00 0.00 24 V 7.59 4.21 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 0.96 0.00 0.00 1.23 0.00 0.00 25 K 8.07 4.51 0.00 1.75 1.79 0.00 1.66 0.00 0.00 2.23 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.44 7.81 26 L 7.81 4.13 0.00 1.95 1.60 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.12 0.00 2.19 2.07 0.00 3.69 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 28 V 7.94 4.16 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 0.86 0.00 0.00 0.93 0.00 0.00 29 L 7.63 3.90 0.00 1.97 1.82 1.06 0.99 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 30 A 9.37 4.15 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.82 3.80 0.00 1.83 1.74 0.00 1.59 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.53 7.81 32 I 7.53 3.68 1.30 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 1.33 0.68 0.24 0.00 0.00 33 L 7.10 3.80 0.00 1.72 1.75 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.35 3.82 0.00 1.94 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 2.20 2.25 0.00 35 D 7.91 4.19 0.00 2.78 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 7.48 3.92 0.00 2.12 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 2.47 2.55 0.00 37 E 7.88 3.99 0.00 1.96 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 2.30 2.41 0.00 38 K 8.37 3.74 0.00 1.54 0.74 0.00 1.32 0.00 0.00 0.81 0.00 0.00 2.85 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.05 1.17 7.81 39 H 8.60 4.12 0.00 3.16 3.38 0.00 5.66 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 I 8.09 4.30 2.04 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 1.43 0.63 0.90 0.00 0.00 41 E 8.43 3.88 0.00 1.97 1.85 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 2.31 2.35 0.00 42 W 7.87 4.55 0.00 3.67 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 43 L 9.28 4.12 0.00 1.70 1.80 1.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.32 4.15 0.00 2.25 2.03 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 2.35 2.54 0.00 45 T 8.07 3.94 4.45 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 1.25 0.00 0.00 46 I 7.27 3.72 2.07 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 1.53 0.48 0.91 0.00 0.00 47 L 7.58 4.58 0.00 1.93 1.70 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 48 G 7.72 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00