NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4107 8.1627 120.3489 55.0049 33.5369 175.5488 2 K 3.6894 8.8083 127.6879 58.8553 32.2254 173.4742 3 V 3.5680 7.8692 118.2454 65.8614 31.9310 177.2596 4 K 3.9324 7.9821 118.9332 59.5613 32.1217 178.2272 5 Q 3.9510 8.3464 120.0576 59.3159 28.8615 178.4187 6 L 4.0431 8.0757 119.7301 57.4266 41.6937 179.2049 7 A 3.9988 8.4891 121.2964 55.3323 18.2811 179.4214 8 D 4.3212 8.4395 117.7395 57.2780 40.8076 178.9285 9 K 3.8981 8.1302 120.2134 59.3811 32.1129 178.7843 10 V 3.5751 8.1123 118.9228 66.3235 31.4160 177.8913 11 E 3.9804 8.1544 118.0351 59.2189 29.3908 178.9112 12 E 3.9440 8.3877 119.4637 59.5110 29.6839 179.0438 13 L 4.0698 8.1337 118.9587 57.6314 41.5738 179.4997 14 L 3.8558 8.2936 119.5070 57.5733 41.6121 179.4062 15 S 4.3155 8.2819 113.2717 61.3368 62.2890 176.1765 16 K 4.0065 8.0316 122.0482 59.3717 31.8525 178.0000 17 N 4.1899 8.4012 117.7375 57.2074 38.7821 176.3747 18 Y 4.2067 8.1314 117.9179 61.2633 37.8445 178.0827 19 H 4.2593 8.3113 118.7188 59.3295 29.9673 177.2720 20 L 3.8625 8.3246 120.9609 57.7994 41.4390 179.4368 21 A 3.9806 8.3307 120.9153 55.2661 18.2228 179.4534 22 N 4.3489 8.3750 115.0101 56.4398 38.4904 177.5808 23 E 3.9244 8.3671 120.4258 59.2576 29.5018 179.3533 24 V 3.5536 8.0444 118.3189 65.9055 31.3961 177.9787 25 A 3.9396 7.9587 120.3521 55.1203 17.9987 179.3237 26 R 3.8260 8.1823 117.5503 59.8909 30.0881 178.7172 27 L 4.1847 8.3347 118.6497 57.5151 41.6649 179.0341 28 A 3.9944 8.6973 121.2088 55.3446 18.0564 179.7652 29 K 4.0789 7.7744 115.2987 58.7108 32.1326 178.8638 30 L 4.3379 7.0257 118.8384 57.0850 42.1209 178.9266 31 V 3.8054 7.8918 111.8840 64.0604 31.6415 176.5238 32 G 4.0320 8.0443 111.5341 46.2253 0.0000 172.8257 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 M 8.16 4.41 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.60 0.00 2 K 8.81 3.69 0.00 1.98 1.80 0.00 1.66 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.61 7.81 3 V 7.87 3.57 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 0.95 0.00 0.00 0.93 0.00 0.00 4 K 7.98 3.93 0.00 1.91 1.79 0.00 1.67 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.56 7.81 5 Q 8.35 3.95 0.00 2.20 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 6 L 8.08 4.04 0.00 1.87 1.69 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 7 A 8.49 4.00 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 8 D 8.44 4.32 0.00 2.90 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.13 3.90 0.00 1.97 1.99 0.00 1.54 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.49 7.81 10 V 8.11 3.58 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 1.07 0.00 0.00 0.97 0.00 0.00 11 E 8.15 3.98 0.00 2.23 2.01 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 2.35 2.59 0.00 12 E 8.39 3.94 0.00 2.04 2.13 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 2.32 2.37 0.00 13 L 8.13 4.07 0.00 1.84 1.68 0.91 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.29 3.86 0.00 1.87 1.72 0.94 0.82 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 15 S 8.28 4.32 0.00 3.98 4.07 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.03 4.01 0.00 1.93 1.95 0.00 1.72 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.49 7.81 17 N 8.40 4.19 0.00 2.78 2.66 0.00 0.00 7.24 7.95 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 18 Y 8.13 4.21 0.00 3.26 2.89 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 19 H 8.31 4.26 0.00 3.31 3.52 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.32 3.86 0.00 1.69 1.68 0.92 0.66 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 21 A 8.33 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.37 4.35 0.00 2.99 2.91 0.00 0.00 7.04 7.07 0.00 0.00 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 E 8.37 3.92 0.00 2.05 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 2.22 2.22 0.00 24 V 8.04 3.55 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 1.00 0.00 0.00 0.98 0.00 0.00 25 A 7.96 3.94 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.18 3.83 0.00 1.95 2.10 0.00 3.10 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 1.63 1.69 0.00 27 L 8.33 4.18 0.00 1.76 1.69 0.94 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.70 3.99 1.32 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 29 K 7.77 4.08 0.00 1.83 1.89 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.75 7.81 30 L 7.03 4.34 0.00 1.81 1.71 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 31 V 7.89 3.81 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 0.79 0.00 0.00 1.00 0.00 0.00 32 G 8.04 4.03 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 0.00