NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 V 3.4972 7.9133 120.3542 62.6145 33.6175 176.0666 13 E 4.4781 7.8428 118.2359 56.1914 29.3760 175.9248 14 Q 4.4506 8.5619 119.8791 58.1270 30.5628 177.3657 15 Q 4.3050 8.0360 118.2609 59.2068 28.4399 179.1402 16 F 4.6542 8.7942 118.9771 60.1904 38.9994 177.1385 17 D 4.7258 9.4993 119.4929 57.0492 40.9181 178.2533 18 L 3.7277 7.9560 118.9041 58.2179 41.4287 179.2252 19 Q 4.0679 7.6793 116.5832 59.7364 29.1407 178.9851 20 K 3.8816 8.0059 118.3458 60.7971 32.0827 178.5476 21 Y 4.3553 8.5797 115.8948 61.3136 37.8560 178.5355 22 R 4.2305 8.0799 117.0858 57.7344 29.8390 178.8737 23 Q 3.8919 7.8478 118.0887 59.7289 29.1485 177.5025 24 Q 3.9145 8.2577 118.0746 59.0511 28.5434 178.9335 25 V 3.5541 8.4488 118.5989 66.7645 31.6007 178.4298 26 R 3.8381 7.2060 117.0072 59.3501 29.8706 177.0378 27 D 4.7679 8.1135 116.4115 53.7358 42.0779 176.4723 28 I 3.9610 7.2682 119.7713 60.2143 39.0889 175.4079 29 S 4.5768 8.0679 118.2779 57.3917 65.8083 174.8068 30 R 3.9698 8.4245 119.6075 58.7045 30.1184 177.9508 31 E 4.3989 7.9445 117.1603 57.7001 30.5139 177.7544 32 D 4.4158 9.2640 118.4938 56.5496 40.8624 177.4993 33 L 4.0851 7.6699 117.9101 56.3629 42.0559 179.0794 34 E 3.7523 7.8480 118.6428 59.3622 29.2259 177.9196 35 D 4.7636 7.7148 116.6592 54.7174 40.7990 178.0476 36 L 4.2646 7.3640 122.1212 56.9654 42.1843 178.8411 37 F 4.6384 7.4994 117.0800 60.8230 38.6838 177.4688 38 I 3.6558 8.0577 110.7970 65.0122 37.2322 176.7465 39 E 4.0207 8.0488 120.4281 58.4021 29.0212 178.4390 40 V 3.8121 7.8918 122.8661 65.5672 32.1939 178.4519 41 V 3.6588 8.5880 119.2425 66.1913 30.2835 178.0833 42 R 4.0042 8.1650 118.9298 58.9904 29.9937 177.2841 43 Q 4.6684 7.7821 115.8523 56.2014 29.2204 176.7935 44 K 4.4653 8.2245 119.3014 57.8880 34.2694 176.4763 45 M 4.5871 8.1092 117.6265 55.1513 32.5839 178.1492 46 A 3.9575 7.3655 120.3598 55.6439 18.5740 179.2811 47 H 4.2341 8.2752 114.1007 59.1250 28.8499 177.4079 48 E 4.1149 8.2186 119.4258 58.0806 28.9185 177.7139 49 N 5.0076 8.0032 116.0686 53.2178 39.4445 176.1769 50 I 4.1555 8.6337 121.5751 63.4083 37.5593 177.8780 51 F 4.0919 8.1874 117.9910 61.0065 38.9676 176.7448 52 K 3.9145 8.6079 118.3172 60.1407 31.5004 178.2712 53 G 3.8518 8.0142 107.2891 48.6925 0.0000 173.8516 54 M 3.9425 7.8861 120.0339 58.6169 31.9689 177.8846 55 I 3.7607 9.4694 113.0509 64.4026 37.6516 178.1027 56 R 3.9465 8.5115 119.8287 59.3681 29.8301 178.3217 57 Q 4.4212 8.3540 113.9629 56.4575 28.7922 176.7159 58 G 4.0858 7.9983 108.7299 44.9655 0.0000 174.0423 59 S 4.2872 7.9821 120.2450 58.2148 63.0583 173.8097 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 12 V 7.91 3.50 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 0.39 0.00 0.00 0.83 0.00 0.00 13 E 7.84 4.48 0.00 2.08 1.99 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 2.44 2.62 0.00 14 Q 8.56 4.45 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.22 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 15 Q 8.04 4.30 0.00 1.95 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 16 F 8.79 4.65 0.00 2.95 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 D 9.50 4.73 0.00 2.96 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 L 7.96 3.73 0.00 1.81 1.70 0.86 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 19 Q 7.68 4.07 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.87 0.00 0.00 0.00 0.00 0.00 2.46 2.58 0.00 20 K 8.01 3.88 0.00 2.36 1.93 0.00 1.96 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.95 7.81 21 Y 8.58 4.36 0.00 2.97 3.02 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 0.00 0.00 0.00 22 R 8.08 4.23 0.00 2.02 2.01 0.00 3.24 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.95 0.00 23 Q 7.85 3.89 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.75 0.00 24 Q 8.26 3.91 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 25 V 8.45 3.55 2.15 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 1.16 0.00 0.00 1.09 0.00 0.00 26 R 7.21 3.84 0.00 2.11 2.10 0.00 3.61 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 27 D 8.11 4.77 0.00 2.87 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 28 I 7.27 3.96 1.93 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.72 1.01 0.00 0.00 29 S 8.07 4.58 0.00 4.06 4.11 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 30 R 8.42 3.97 0.00 1.78 2.01 0.00 3.17 0.00 0.00 3.21 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 31 E 7.94 4.40 0.00 1.97 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 2.29 2.35 0.00 32 D 9.26 4.42 0.00 2.70 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.67 4.09 0.00 1.72 1.32 0.95 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 34 E 7.85 3.75 0.00 2.19 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 2.28 2.44 0.00 35 D 7.71 4.76 0.00 2.78 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.36 4.26 0.00 1.65 1.73 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 37 F 7.50 4.64 0.00 3.05 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 38 I 8.06 3.66 1.91 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 1.69 0.56 1.05 0.00 0.00 39 E 8.05 4.02 0.00 2.22 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 2.51 2.51 0.00 40 V 7.89 3.81 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.05 0.00 0.00 41 V 8.59 3.66 2.14 0.00 0.00 0.00 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 0.99 0.00 0.00 42 R 8.17 4.00 0.00 2.13 2.00 0.00 3.18 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 43 Q 7.78 4.67 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.71 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 44 K 8.22 4.47 0.00 1.92 1.99 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.43 7.81 45 M 8.11 4.59 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.40 0.00 46 A 7.37 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.28 4.23 0.00 3.41 3.73 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.22 4.11 0.00 2.18 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 2.37 0.00 49 N 8.00 5.01 0.00 2.72 2.82 0.00 0.00 6.90 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 50 I 8.63 4.16 2.03 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 1.52 0.95 0.42 0.00 0.00 51 F 8.19 4.09 0.00 3.03 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 52 K 8.61 3.91 0.00 2.13 1.78 0.00 1.76 0.00 0.00 1.84 0.00 0.00 3.16 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.57 7.81 53 G 8.01 3.85 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 0.00 0.00 0.00 54 M 7.89 3.94 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.53 0.00 55 I 9.47 3.76 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.67 0.97 0.00 0.00 56 R 8.51 3.95 0.00 1.98 2.05 0.00 3.13 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.02 0.00 57 Q 8.35 4.42 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 58 G 8.00 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 59 S 7.98 4.29 0.00 3.96 3.89 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