NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.3239 8.3549 107.9912 45.4608 0.0000 173.1296 2 E 4.6775 7.4215 119.8436 54.3166 32.5590 175.1193 3 W 5.1817 8.6679 122.8354 54.8528 32.1848 174.6108 4 E 4.8860 9.5540 121.9405 54.7615 32.8420 174.6983 5 I 4.7424 8.4656 122.4615 61.1684 38.5952 174.8805 6 I 4.8778 8.5034 118.4868 59.0740 40.9223 174.3147 7 D 4.6670 8.8411 121.0984 54.0275 39.6249 175.6203 8 I 4.6058 8.1310 118.6587 61.0483 38.5888 177.3879 9 G 4.1350 8.4652 111.9630 44.3216 0.0000 171.9390 10 P 4.3101 0.0000 0.0000 65.3652 31.5604 177.7738 11 F 4.2523 8.3530 118.7066 62.1819 39.2417 177.4390 12 T 3.7762 8.1898 111.8673 65.1765 67.3845 176.0401 13 Q 4.3505 8.5728 119.9289 58.3142 28.7251 178.2491 14 N 4.2522 8.6154 118.9031 55.7460 38.6650 176.6097 15 L 4.3901 7.8550 119.5219 56.7385 40.8448 179.2620 16 G 3.8022 7.5912 106.5460 47.9591 0.0000 175.4863 17 K 3.4350 7.3815 122.7334 59.0152 32.0122 177.9964 18 F 4.0997 8.7023 120.5921 61.5725 39.3427 176.5384 19 A 3.8616 8.1725 119.9467 55.7743 18.1990 179.9558 20 V 3.6394 8.5998 116.1265 65.8355 31.5688 177.9693 21 D 4.3709 8.1496 119.0852 57.0888 40.7117 178.5142 22 E 3.8304 8.0144 119.2521 59.0447 29.2541 178.9699 23 E 3.7455 7.9798 119.3893 59.2254 29.4656 178.5714 24 N 4.4246 7.8486 115.7824 56.4250 38.6593 176.1285 25 K 4.1224 8.1208 121.9034 57.1610 32.1093 176.4101 26 I 4.2135 8.3009 114.0095 60.5200 38.3525 176.2367 27 G 4.3364 7.6886 110.0557 45.3216 0.0000 174.0381 28 Q 4.3013 8.7126 122.1555 56.5440 29.4131 175.6313 29 Y 4.6849 7.4859 116.9085 56.7572 40.2886 174.8689 30 G 3.7713 8.9127 112.2874 46.6043 0.0000 173.1530 31 R 4.3818 8.4301 122.3934 55.4381 30.9919 176.1829 32 L 4.6501 9.2985 122.6693 53.3185 44.1278 175.9469 33 T 4.5516 8.0074 115.5834 61.4126 70.5728 174.2766 34 F 4.0916 8.9570 129.0717 58.6167 39.9930 172.8224 35 N 4.8615 7.1077 122.1028 53.6904 40.8100 174.4986 36 K 4.6110 6.5446 113.7936 55.5290 35.9686 175.1656 37 V 4.1770 8.5998 121.9158 61.2332 32.3605 175.6502 38 I 4.3560 8.0424 120.9178 59.2760 39.8096 174.7584 39 R 4.5105 8.1886 119.2048 54.6316 31.0423 174.5786 40 P 4.7761 0.0000 0.0000 61.6980 33.2666 174.3161 41 C 4.9652 8.4571 120.0753 58.0211 34.1956 172.3093 42 M 5.3962 8.7512 123.9402 53.4420 35.8974 174.6556 43 K 4.5482 9.3097 122.2485 54.5255 35.5830 174.6135 44 K 4.1719 8.3689 128.2455 54.5548 34.1673 175.1854 45 T 4.1955 8.3321 124.9082 62.8802 69.9108 174.0398 46 I 4.3394 7.6261 124.6849 60.1477 41.3551 174.4691 47 Y 4.7709 7.6347 119.4949 57.9060 41.5477 173.4999 48 E 4.2298 9.1606 119.0857 57.7794 30.9153 176.6269 49 N 4.3309 8.5193 113.1995 56.5331 36.1424 173.8645 50 E 4.7512 8.0815 119.5477 55.9720 29.8014 175.7185 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 G 8.35 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 0.00 0.00 0.00 0.00 2 E 7.42 4.68 0.00 1.90 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 3 W 8.67 5.18 0.00 3.17 3.18 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 0.00 0.00 0.00 0.00 4 E 9.55 4.89 0.00 1.96 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 2.16 2.39 0.00 5 I 8.47 4.74 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.64 0.95 0.00 0.00 6 I 8.50 4.88 1.92 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.07 0.99 0.00 0.00 7 D 8.84 4.67 0.00 2.83 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.13 4.61 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.85 1.00 0.00 0.00 9 G 8.47 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.31 0.00 2.23 2.10 0.00 3.69 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 11 F 8.35 4.25 0.00 3.00 2.97 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 0.00 0.00 0.00 0.00 12 T 8.19 3.78 4.69 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 1.42 0.00 0.00 13 Q 8.57 4.35 0.00 2.27 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.60 0.00 0.00 0.00 0.00 0.00 2.61 2.61 0.00 14 N 8.62 4.25 0.00 2.80 2.73 0.00 0.00 6.59 6.97 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 15 L 7.86 4.39 0.00 1.84 1.67 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.59 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.38 3.44 0.00 1.17 1.83 0.00 1.47 0.00 0.00 1.46 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.13 7.81 18 F 8.70 4.10 0.00 2.97 3.13 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 0.00 0.00 0.00 0.00 19 A 8.17 3.86 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 0.00 0.00 0.00 0.00 0.00 20 V 8.60 3.64 2.27 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 1.08 0.00 0.00 1.04 0.00 0.00 21 D 8.15 4.37 0.00 2.65 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.01 3.83 0.00 1.53 1.71 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 1.89 1.47 0.00 23 E 7.98 3.75 0.00 2.09 2.11 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 2.30 2.40 0.00 24 N 7.85 4.42 0.00 2.96 2.86 0.00 0.00 7.00 7.63 0.00 0.00 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 K 8.12 4.12 0.00 1.93 1.71 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.40 7.81 26 I 8.30 4.21 1.85 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 1.41 0.72 0.88 0.00 0.00 27 G 7.69 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.71 4.30 0.00 1.70 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.65 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 29 Y 7.49 4.68 0.00 2.82 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.91 3.77 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 0.00 0.00 0.00 31 R 8.43 4.38 0.00 1.83 1.96 0.00 3.18 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 32 L 9.30 4.65 0.00 1.56 1.58 0.96 0.70 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 33 T 8.01 4.55 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 1.25 0.00 0.00 34 F 8.96 4.09 0.00 3.04 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 35 N 7.11 4.86 0.00 2.42 2.65 0.00 0.00 6.82 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 36 K 6.54 4.61 0.00 1.58 1.63 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.35 1.35 7.81 37 V 8.60 4.18 2.20 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 0.87 0.00 0.00 1.22 0.00 0.00 38 I 8.04 4.36 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 1.38 0.64 0.89 0.00 0.00 39 R 8.19 4.51 0.00 1.83 1.91 0.00 3.22 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 40 P 0.00 4.78 0.00 2.20 2.05 0.00 3.72 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 41 C 8.46 4.97 0.00 3.19 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 M 8.75 5.40 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 43 K 9.31 4.55 0.00 1.82 1.64 0.00 1.51 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.54 7.81 44 K 8.37 4.17 0.00 0.79 0.89 0.00 0.84 0.00 0.00 0.61 0.00 0.00 2.57 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.44 0.90 7.81 45 T 8.33 4.20 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 1.07 0.00 0.00 46 I 7.63 4.34 1.69 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.28 0.78 0.00 0.00 47 Y 7.63 4.77 0.00 2.93 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 48 E 9.16 4.23 0.00 2.03 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 2.34 2.34 0.00 49 N 8.52 4.33 0.00 2.97 2.90 0.00 0.00 7.16 7.66 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 50 E 8.08 4.75 0.00 2.04 1.89 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 2.25 2.25 0.00