NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.3077 8.3149 120.1340 56.1574 32.7260 174.7446 3 K 3.9945 7.9554 120.4981 55.7350 33.1198 175.3566 4 R 4.7191 7.7923 121.1921 54.6811 33.5543 175.1020 5 L 4.4120 7.7171 117.1673 55.5134 42.5239 173.9306 6 T 4.5713 8.4830 117.0169 61.7212 70.7811 173.5547 7 I 4.6586 8.1004 118.0467 59.1229 40.6946 174.3667 8 T 4.6436 8.1945 115.4990 61.8582 71.5114 173.6955 9 L 4.8733 8.2305 125.0282 51.7843 45.7653 177.0007 10 S 4.2370 8.4831 116.8984 58.1281 64.6552 174.6564 11 E 3.8370 8.8960 126.2718 59.7086 29.2567 178.9081 12 S 4.8317 8.0896 113.5849 60.9054 62.3735 176.1158 13 V 3.5407 7.6066 120.1046 65.9562 31.2053 177.3369 14 L 3.8904 8.2100 120.5463 58.2223 41.8990 178.5029 15 E 4.5624 8.6030 118.8654 59.0244 29.3423 178.3139 16 N 4.2134 8.2287 118.5522 56.7377 38.9217 175.6595 17 L 3.8823 8.4371 121.4635 58.0151 42.1129 178.4338 18 E 3.9156 8.7806 118.1044 60.2779 29.6262 178.9518 19 K 3.7773 8.6473 119.1128 59.5767 31.9238 178.1147 20 M 3.9174 8.8771 118.2539 58.6953 32.2568 178.5893 21 A 3.9626 8.4153 120.6519 55.3893 18.6505 179.2538 22 R 3.8122 8.5066 117.0767 59.7575 29.8428 178.1267 23 E 3.9480 8.1445 117.3641 59.5724 29.7756 177.9313 24 M 4.4302 8.1383 115.4589 54.1858 32.6333 176.3553 25 G 4.0400 7.8111 106.8387 46.9619 0.0000 173.6246 26 L 4.8426 7.8784 116.3209 51.7512 45.6726 177.9287 27 S 4.4269 8.2684 116.0484 57.9309 65.1326 175.6552 28 K 3.9730 8.4271 121.4484 59.6920 31.7446 179.6784 29 S 4.1017 8.1072 114.6996 61.5275 62.7906 176.4621 30 A 3.9347 7.9307 123.1318 55.3946 18.1285 178.9297 31 M 3.8584 8.3679 117.1013 59.1283 32.1686 178.3949 32 I 3.6592 8.0933 119.7411 64.6207 37.2596 178.2346 33 S 4.1089 8.2079 116.0539 62.3237 62.6428 176.6817 34 V 3.5630 8.3996 120.5967 65.5854 31.0779 177.4242 35 A 4.0602 8.4611 120.1377 55.5591 18.3692 179.3308 36 L 4.1227 8.5140 117.2257 58.2108 41.5365 179.5199 37 E 3.9887 8.2897 117.4759 59.5428 29.6979 178.7504 38 N 4.4161 8.9154 117.3713 57.0857 39.0717 175.8809 39 Y 3.8462 8.7934 121.7343 60.8992 38.5259 177.9797 40 K 4.0956 8.1054 119.6074 59.0940 32.1870 177.5077 41 K 4.4559 8.7227 117.5015 55.8798 33.1509 176.6751 42 G 3.4960 8.5900 108.8427 45.4866 0.0000 173.9205 43 Q 4.0364 7.9828 121.3303 55.6663 29.5179 175.4226 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 2 K 8.31 4.31 0.00 1.76 1.85 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.42 7.81 3 K 7.96 3.99 0.00 1.82 1.74 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.47 7.81 4 R 7.79 4.72 0.00 1.77 1.82 0.00 3.24 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 5 L 7.72 4.41 0.00 1.68 1.57 0.91 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 6 T 8.48 4.57 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 7 I 8.10 4.66 1.86 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 1.40 0.66 0.90 0.00 0.00 8 T 8.19 4.64 4.23 0.00 0.00 0.00 0.00 0.00 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 9 L 8.23 4.87 0.00 1.56 1.50 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.48 4.24 0.00 4.04 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 0.00 11 E 8.90 3.84 0.00 2.04 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 2.60 2.41 0.00 12 S 8.09 4.83 0.00 3.92 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 13 V 7.61 3.54 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.92 0.00 0.00 14 L 8.21 3.89 0.00 1.76 1.76 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.60 4.56 0.00 2.17 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 0.00 2.52 2.22 0.00 16 N 8.23 4.21 0.00 2.77 3.17 0.00 0.00 6.91 6.19 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 17 L 8.44 3.88 0.00 1.74 1.77 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.78 3.92 0.00 2.14 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 2.34 2.47 0.00 19 K 8.65 3.78 0.00 1.89 1.95 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.50 7.81 20 M 8.88 3.92 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.60 0.00 21 A 8.42 3.96 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 22 R 8.51 3.81 0.00 1.91 2.18 0.00 3.10 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 23 E 8.14 3.95 0.00 1.97 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 2.33 2.40 0.00 24 M 8.14 4.43 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.55 0.00 25 G 7.81 4.04 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 0.00 0.00 0.00 26 L 7.88 4.84 0.00 1.59 1.54 0.92 0.72 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 27 S 8.27 4.43 0.00 4.04 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 28 K 8.43 3.97 0.00 1.82 1.89 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.53 7.81 29 S 8.11 4.10 0.00 3.86 3.92 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 0.00 0.00 0.00 30 A 7.93 3.93 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 31 M 8.37 3.86 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.66 0.00 32 I 8.09 3.66 2.14 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 1.51 0.71 0.90 0.00 0.00 33 S 8.21 4.11 0.00 4.04 3.94 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 34 V 8.40 3.56 2.31 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 1.02 0.00 0.00 0.98 0.00 0.00 35 A 8.46 4.06 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 36 L 8.51 4.12 0.00 1.86 1.75 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 37 E 8.29 3.99 0.00 2.07 2.05 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 2.53 2.49 0.00 38 N 8.92 4.42 0.00 2.74 3.09 0.00 0.00 6.88 7.33 0.00 0.00 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 Y 8.79 3.85 0.00 3.16 3.11 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 40 K 8.11 4.10 0.00 1.86 2.23 0.00 1.95 0.00 0.00 1.76 0.00 0.00 3.13 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.51 7.81 41 K 8.72 4.46 0.00 1.82 1.88 0.00 1.61 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.62 1.39 7.81 42 G 8.59 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 7.98 4.04 0.00 1.82 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.60 0.00 0.00 0.00 0.00 0.00 2.16 2.19 0.00