NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.4074 8.2544 121.1250 56.2911 31.6596 174.4216 2 V 4.0172 9.2033 126.9206 60.6716 32.8483 172.5790 3 C 5.1737 8.4280 128.7287 53.7364 46.1206 171.3915 4 P 4.4979 0.0000 0.0000 63.1821 31.6609 177.3795 5 R 4.3451 8.1790 120.3040 54.9850 28.5523 175.2810 6 I 4.5090 7.2509 118.3698 58.8887 40.8526 175.2866 7 L 4.3116 8.5908 127.3093 54.7671 42.2549 175.8309 8 L 4.8219 8.3541 125.3630 53.2294 45.9683 176.0949 9 E 4.3005 8.6555 123.0046 56.2853 30.7283 174.5591 10 C 4.8904 8.1133 113.2206 55.1124 44.1107 173.9508 11 K 4.2073 9.6171 119.8809 56.8894 33.8207 176.6324 12 K 4.7481 7.6737 115.9678 54.2192 36.3535 176.7200 13 D 4.4138 8.6988 120.1557 57.5048 40.8647 179.3271 14 S 4.1288 8.0147 112.4412 60.9507 62.9579 174.9638 15 D 4.4531 8.0986 119.7772 55.9168 40.7701 175.5270 16 C 4.8122 7.8864 116.7231 55.2513 43.5931 173.0184 17 L 4.5764 8.1595 120.3492 54.6080 43.6617 178.1298 18 A 3.4401 7.9854 124.0480 54.1659 17.3064 177.9423 19 E 4.6195 9.2174 117.4121 58.6460 29.5023 175.3929 20 C 4.6420 8.1142 116.5882 57.2797 41.3817 173.4474 21 V 4.6165 8.1938 113.4321 59.5315 35.7866 175.2198 22 C 4.7714 9.4346 123.7488 55.9355 44.4095 173.3947 23 L 4.6182 8.7245 126.9510 53.7310 42.4610 178.1480 24 E 3.9815 8.6522 120.5217 59.5167 29.6002 178.1381 25 H 4.1775 8.2006 117.3341 57.4492 30.3728 175.6068 26 G 4.2086 8.7736 108.4912 45.4802 0.0000 172.3167 27 Y 5.0922 7.8566 115.7956 55.7161 42.2475 175.6751 28 C 4.9663 9.2965 120.1034 57.3623 41.2904 174.2195 29 G 3.8612 8.7703 108.8591 47.1277 0.0000 173.2532 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 R 8.25 4.41 0.00 1.84 1.90 0.00 3.34 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.77 0.00 2 V 9.20 4.02 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 0.92 0.00 0.00 0.93 0.00 0.00 3 C 8.43 5.17 0.00 2.97 2.93 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 4 P 0.00 4.50 0.00 2.22 2.05 0.00 3.82 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 2.00 2.00 0.00 5 R 8.18 4.35 0.00 1.83 1.94 0.00 3.15 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 6 I 7.25 4.51 1.89 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 1.31 0.62 0.93 0.00 0.00 7 L 8.59 4.31 0.00 1.63 1.66 0.94 1.01 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 8 L 8.35 4.82 0.00 1.60 1.46 0.93 0.96 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 9 E 8.66 4.30 0.00 1.62 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.76 0.00 10 C 8.11 4.89 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 11 K 9.62 4.21 0.00 1.66 1.85 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.77 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.49 7.81 12 K 7.67 4.75 0.00 1.70 1.62 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.40 1.37 7.81 13 D 8.70 4.41 0.00 2.74 2.72 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 14 S 8.01 4.13 0.00 3.97 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 15 D 8.10 4.45 0.00 2.81 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.89 4.81 0.00 3.08 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 17 L 8.16 4.58 0.00 1.71 1.57 0.93 0.65 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 18 A 7.99 3.44 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 19 E 9.22 4.62 0.00 2.13 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 0.00 2.26 2.25 0.00 20 C 8.11 4.64 0.00 2.95 3.04 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 21 V 8.19 4.62 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 0.94 0.00 0.00 22 C 9.43 4.77 0.00 3.02 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 23 L 8.72 4.62 0.00 1.88 1.60 0.96 0.68 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 24 E 8.65 3.98 0.00 1.98 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 2.33 2.31 0.00 25 H 8.20 4.18 0.00 3.11 3.42 0.00 5.89 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.77 4.21 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 7.86 5.09 0.00 2.84 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 28 C 9.30 4.97 0.00 2.89 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 29 G 8.77 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00