NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3941 8.1233 122.4692 51.8190 20.6417 175.7747 2 K 5.1895 8.4368 120.5934 53.1166 36.0727 173.1647 3 W 4.9669 8.6004 120.0816 55.0627 32.9269 174.7159 4 V 4.3023 8.2836 124.6062 60.1444 33.3675 175.1185 5 L 4.0624 8.8176 126.7749 53.1366 41.8757 176.8222 6 K 3.5223 8.7534 126.9675 59.3321 32.4162 178.7193 7 I 3.8627 7.6491 118.7001 64.4523 36.9060 177.3582 8 T 4.4628 7.6961 110.3675 62.2714 68.7088 174.8877 9 G 3.9807 9.1930 108.6418 44.9589 0.0000 173.4698 10 Y 4.2985 7.1972 119.7558 58.2264 39.4970 175.3241 11 I 5.6036 8.0806 126.2032 58.9674 40.4652 174.4529 12 Y 4.6072 8.4981 126.3246 56.0165 40.9773 174.1507 13 D 4.6783 8.3403 128.4709 52.7623 39.9116 175.6792 14 E 3.0928 8.0342 124.5248 58.1929 30.3232 178.0643 15 D 4.3965 8.1336 117.6228 56.0942 41.7811 176.3721 16 A 4.5774 9.1207 120.4529 50.9073 22.3241 177.2449 17 G 4.4456 8.5447 104.4285 43.9569 0.0000 174.6781 18 D 5.5987 8.8933 135.0000 53.6427 43.5342 174.1992 19 P 4.4897 0.0000 0.0000 64.7506 31.8627 177.7603 20 D 4.5367 8.2307 118.6949 56.6745 41.0512 176.6309 21 N 4.7125 8.3338 114.3409 52.5297 39.4072 175.3042 22 G 4.0000 7.9602 104.0095 46.8406 0.0000 172.5616 23 I 4.5666 7.7297 117.4795 59.5189 40.3784 177.7709 24 S 4.5497 8.4203 119.2294 57.5465 64.4383 172.1786 25 P 4.8186 0.0000 0.0000 62.9501 31.2969 175.5862 26 G 3.9961 8.5336 114.6654 45.7701 0.0000 171.9198 27 T 4.4040 7.4545 113.6924 61.3682 70.7179 174.6672 28 K 4.5371 8.6908 125.6203 56.0615 32.1358 177.1581 29 F 2.7976 9.2087 126.8896 60.8392 38.8965 176.8651 30 E 3.8870 7.7962 115.8200 57.8807 29.6829 176.7858 31 E 4.1574 8.6026 120.4250 56.8459 30.5762 175.8162 32 L 3.6244 6.4578 117.4172 53.5280 42.2700 175.0971 33 P 4.5068 0.0000 0.0000 61.9594 32.9810 175.5984 34 D 4.3750 8.4298 116.4278 56.9399 41.2404 177.2372 35 D 4.3933 8.1497 117.0121 55.5531 41.3452 175.5780 36 W 4.1898 7.8219 128.9171 56.2459 31.4827 175.8955 37 V 4.7215 7.8690 122.4741 62.2847 31.7725 170.4903 38 A 3.0490 6.8122 128.0481 47.5677 21.2335 173.9061 39 P 4.5368 0.0000 0.0000 62.5665 31.9449 175.7097 40 I 3.9401 7.7557 117.3271 62.5012 40.9871 175.5654 41 T 3.2213 9.1330 108.6725 62.8027 68.1335 172.4241 42 G 3.7043 7.4739 116.5996 42.1801 0.0000 174.2392 43 A 4.9091 7.9644 120.4121 50.1291 19.2390 174.7813 44 P 4.7049 0.0000 0.0000 62.1938 32.0809 176.0889 45 K 3.6771 8.2149 115.5131 60.3799 32.4919 176.8768 46 S 4.3956 8.0280 119.1679 59.9760 64.1479 175.1219 47 E 4.7535 12.0000 119.2658 55.4010 31.0754 174.6803 48 F 4.8236 8.4656 116.2022 57.2660 42.3918 174.8955 49 E 4.1177 8.9430 119.9269 56.5476 31.7341 174.7091 50 K 4.0189 6.1542 125.6427 54.7889 33.8640 175.2444 51 L 4.3305 8.0352 120.3639 55.1455 43.4364 176.0268 52 E 3.7820 7.5339 115.6373 56.0656 30.2941 176.6085 53 D 4.4480 8.3508 116.9490 54.3251 41.3914 175.5377 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 A 8.12 4.39 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 2 K 8.44 5.19 0.00 1.77 1.73 0.00 1.87 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.37 7.81 3 W 8.60 4.97 0.00 3.24 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 4 V 8.28 4.30 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 0.71 0.00 0.00 0.93 0.00 0.00 5 L 8.82 4.06 0.00 1.74 1.49 0.99 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 6 K 8.75 3.52 0.00 1.74 1.87 0.00 1.79 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.41 7.81 7 I 7.65 3.86 1.83 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 1.29 0.42 0.90 0.00 0.00 8 T 7.70 4.46 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 1.22 0.00 0.00 9 G 9.19 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 0.00 0.00 0.00 10 Y 7.20 4.30 0.00 3.20 2.95 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 11 I 8.08 5.60 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 1.49 1.45 0.99 0.00 0.00 12 Y 8.50 4.61 0.00 3.37 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 13 D 8.34 4.68 0.00 2.76 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 8.03 3.09 0.00 2.25 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 2.34 2.57 0.00 15 D 8.13 4.40 0.00 2.64 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 9.12 4.58 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 17 G 8.54 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 0.00 0.00 0.00 0.00 18 D 8.89 5.60 0.00 3.41 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 19 P 0.00 4.49 0.00 2.26 2.21 0.00 3.91 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 2.05 2.03 0.00 20 D 8.23 4.54 0.00 2.80 2.82 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 21 N 8.33 4.71 0.00 2.99 2.83 0.00 0.00 7.09 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 22 G 7.96 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 0.00 0.00 0.00 23 I 7.73 4.57 2.25 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.44 0.98 0.00 0.00 24 S 8.42 4.55 0.00 3.78 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 25 P 0.00 4.82 0.00 2.08 2.10 0.00 3.44 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.82 0.00 26 G 8.53 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 0.00 0.00 0.00 27 T 7.45 4.40 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 1.05 0.00 0.00 28 K 8.69 4.54 0.00 1.99 1.78 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.92 7.81 29 F 9.21 2.80 0.00 2.14 1.45 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 30 E 7.80 3.89 0.00 2.19 2.32 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 2.40 2.28 0.00 31 E 8.60 4.16 0.00 1.68 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.19 0.00 32 L 6.46 3.62 0.00 0.77 0.80 -1.33 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 33 P 0.00 4.51 0.00 2.14 2.03 0.00 3.58 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.91 0.00 34 D 8.43 4.37 0.00 2.74 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 35 D 8.15 4.39 0.00 2.64 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 36 W 7.82 4.19 0.00 3.07 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 37 V 7.87 4.72 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 0.82 0.00 0.00 1.04 0.00 0.00 38 A 6.81 3.05 1.03 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 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.54 0.00 2.09 2.01 0.00 3.49 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.83 0.00 40 I 7.76 3.94 1.79 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.22 0.88 0.00 0.00 41 T 9.13 3.22 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 1.20 0.00 0.00 42 G 7.47 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 0.00 0.00 0.00 43 A 7.96 4.91 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 44 P 0.00 4.70 0.00 2.29 2.13 0.00 4.05 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 2.29 2.06 0.00 45 K 8.21 3.68 0.00 1.86 1.85 0.00 1.05 0.00 0.00 1.13 0.00 0.00 2.53 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.44 1.31 7.81 46 S 8.03 4.40 0.00 3.96 4.05 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 47 E 12.00 4.75 0.00 2.14 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 48 F 8.47 4.82 0.00 3.21 3.30 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 49 E 8.94 4.12 0.00 1.91 1.67 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 2.06 2.16 0.00 50 K 6.15 4.02 0.00 1.23 1.17 0.00 1.55 0.00 0.00 1.97 0.00 0.00 2.63 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.30 0.48 7.81 51 L 8.04 4.33 0.00 1.48 1.55 0.88 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 52 E 7.53 3.78 0.00 2.03 1.91 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 2.09 2.21 0.00 53 D 8.35 4.45 0.00 2.59 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00