NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4472 8.2893 118.1939 55.0782 32.3908 175.0532 2 S 4.3732 8.2968 115.3406 56.5768 65.7178 170.1714 3 V 3.5956 8.2944 120.7201 65.6143 31.5957 178.8141 4 K 4.0137 7.9855 119.0720 59.7548 32.1553 178.4233 5 E 3.9705 8.0276 118.2715 59.4852 29.4132 179.4489 6 L 4.0731 7.7187 118.7045 57.6185 41.7857 179.2955 7 E 4.0678 8.3834 118.8729 59.1930 29.3811 178.9967 8 D 4.3771 8.2072 119.3679 57.1076 40.8441 178.6444 9 K 3.9955 8.0731 120.2502 59.1638 32.1359 179.2217 10 V 3.5420 7.6555 118.2614 66.0948 31.5017 177.9700 11 E 3.9741 8.0621 118.0375 59.1877 29.2572 179.0451 12 E 3.9191 8.2202 119.5184 59.3353 29.7312 178.9404 13 L 4.0058 8.0727 119.1148 57.5250 41.5687 179.2629 14 L 3.6980 7.8625 120.5801 57.9333 42.0705 178.9825 15 S 4.1343 7.8553 112.7986 61.3370 62.3617 176.3252 16 K 4.0750 8.0228 121.1900 59.4186 31.7671 179.1795 17 N 4.3431 8.1951 116.9321 56.5672 38.4557 177.0799 18 Y 4.5448 8.0387 118.2543 61.4464 37.9187 178.2172 19 H 4.3062 8.3719 119.0497 59.2766 29.9922 177.4079 20 L 3.9784 8.0181 120.8191 57.6162 41.4527 179.2748 21 E 4.0864 8.3138 118.7638 59.2234 29.3991 178.9778 22 N 4.4130 8.1363 116.8107 56.1571 38.4619 177.3727 23 E 3.9404 8.1055 120.2273 59.3257 29.6683 179.4273 24 V 3.5482 7.8017 118.1195 65.9884 31.0335 177.9890 25 A 4.0386 7.9978 120.4354 54.9451 17.6875 179.6431 26 R 3.9039 7.9355 117.4520 59.5067 30.0559 178.6781 27 L 4.1305 8.3057 118.9795 57.3046 41.4300 179.4703 28 K 4.0312 7.8251 117.7569 59.1164 31.9413 179.2011 29 K 4.1525 7.7674 118.0722 59.3484 31.8330 179.4088 30 L 4.0702 7.6201 118.5520 57.5452 41.2865 179.5187 31 V 3.7837 7.5619 117.9407 64.8383 31.3757 176.5349 32 G 4.1878 7.2589 106.4369 44.8020 0.0000 172.6213 33 E 4.0748 7.7797 119.9472 56.2341 30.0005 177.4331 34 R 4.1392 8.2881 122.2083 56.8391 30.0693 174.3194 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 8.29 4.45 0.00 2.14 2.36 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 2 S 8.30 4.37 0.00 4.06 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 3 V 8.29 3.60 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 1.10 0.00 0.00 0.93 0.00 0.00 4 K 7.99 4.01 0.00 1.86 1.79 0.00 1.78 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.54 7.81 5 E 8.03 3.97 0.00 2.09 1.98 0.00 0.00 0.00 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 2.35 0.00 6 L 7.72 4.07 0.00 1.82 1.70 0.96 0.81 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 7 E 8.38 4.07 0.00 2.16 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 2.32 2.46 0.00 8 D 8.21 4.38 0.00 2.87 2.71 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 0.00 0.00 0.00 9 K 8.07 4.00 0.00 1.89 1.94 0.00 1.51 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.47 7.81 10 V 7.66 3.54 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 0.95 0.00 0.00 0.98 0.00 0.00 11 E 8.06 3.97 0.00 2.21 1.98 0.00 0.00 0.00 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 2.39 0.00 12 E 8.22 3.92 0.00 2.12 2.12 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 2.29 2.34 0.00 13 L 8.07 4.01 0.00 1.79 1.65 0.90 0.34 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 14 L 7.86 3.70 0.00 1.72 1.67 0.55 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 15 S 7.86 4.13 0.00 3.95 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 16 K 8.02 4.07 0.00 2.02 1.85 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.48 7.81 17 N 8.20 4.34 0.00 2.83 2.76 0.00 0.00 7.00 6.99 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 18 Y 8.04 4.54 0.00 3.13 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 19 H 8.37 4.31 0.00 3.29 3.51 0.00 5.60 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.02 3.98 0.00 1.93 1.69 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.31 4.09 0.00 2.27 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 2.43 2.67 0.00 22 N 8.14 4.41 0.00 2.99 2.88 0.00 0.00 6.94 7.76 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 23 E 8.11 3.94 0.00 2.11 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 2.27 2.30 0.00 24 V 7.80 3.55 2.24 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 1.01 0.00 0.00 1.01 0.00 0.00 25 A 8.00 4.04 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 26 R 7.94 3.90 0.00 1.92 2.17 0.00 3.10 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 27 L 8.31 4.13 0.00 1.77 1.69 0.91 0.99 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 K 7.83 4.03 0.00 1.97 1.87 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.64 7.81 29 K 7.77 4.15 0.00 2.00 1.85 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.68 7.81 30 L 7.62 4.07 0.00 1.87 1.71 0.92 0.81 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 31 V 7.56 3.78 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 0.81 0.00 0.00 0.99 0.00 0.00 32 G 7.26 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 E 7.78 4.07 0.00 1.93 1.91 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 2.52 2.30 0.00 34 R 8.29 4.14 0.00 1.71 1.72 0.00 3.27 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00