NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1225 8.0093 120.7866 61.0332 39.1770 174.5149 2 T 4.4855 8.2565 116.3888 59.4438 71.1293 171.7416 3 A 4.6820 7.8770 124.8927 50.3974 23.2532 177.2999 4 K 4.3327 8.2919 118.9707 55.2683 33.8701 175.2462 5 P 4.3432 0.0000 0.0000 61.9115 31.8437 176.4314 6 A 4.0178 8.4980 122.9331 52.9013 18.5537 178.4190 7 K 4.2058 8.7376 122.7612 58.9665 32.6920 177.7034 8 T 4.5895 7.3131 107.2963 57.9626 68.3272 170.6185 9 P 4.0214 0.0000 0.0000 64.3248 32.1860 176.2464 10 T 4.8134 8.4801 119.0485 61.0320 68.6922 175.2467 11 S 4.3832 8.2349 122.0815 57.2602 65.2811 172.9271 12 P 4.1953 0.0000 0.0000 65.7626 30.9876 178.8507 13 K 3.9203 7.9460 117.6840 59.6197 32.1124 178.5338 14 E 3.9755 7.9851 118.4359 59.6049 29.2643 179.4495 15 Q 3.9934 8.5261 118.2478 58.7688 28.6264 178.6412 16 A 3.9123 8.1205 121.9607 54.9664 18.3287 179.8029 17 I 3.7145 7.8073 118.5031 64.5253 37.1873 178.8768 18 G 3.6364 8.1409 106.5586 47.6229 0.0000 175.4835 19 L 3.8434 8.1411 123.0066 57.9354 42.0740 179.1596 20 S 4.0167 8.1437 115.3551 61.6482 62.7912 176.9144 21 V 3.6272 8.1763 121.2028 66.2346 31.2153 178.1034 22 T 4.0471 8.2150 115.4988 66.9708 68.3659 176.5710 23 F 4.2330 9.0065 120.0187 60.7379 38.8323 177.8467 24 L 4.1483 8.5218 119.0563 57.6786 41.1988 179.6188 25 S 4.1614 8.3446 113.5077 60.9495 62.6547 176.2029 26 F 4.2859 8.0964 120.0684 60.1083 39.0785 178.0291 27 L 4.2165 8.3174 118.7000 57.4547 41.3685 179.5858 28 L 4.0446 8.3394 119.3124 57.3577 41.6690 177.5859 29 P 4.2869 0.0000 0.0000 65.6143 31.2645 178.4877 30 A 4.1998 7.6082 116.3675 55.2300 18.3561 179.7866 31 G 3.7081 8.3869 104.3279 47.6897 0.0000 175.6061 32 W 4.1467 8.7402 131.0742 60.2589 29.2300 178.1394 33 V 3.8270 8.2649 118.1260 66.3436 30.8386 178.0566 34 L 4.3263 8.1749 117.4593 57.6866 41.4333 178.7276 35 Y 4.0895 7.9157 119.0396 60.7437 38.8348 176.6654 36 H 4.2103 7.5884 115.5563 55.6803 28.9324 177.0458 37 L 3.7992 6.8802 125.3004 58.3691 41.6937 178.5611 38 D 4.2645 7.6697 117.3994 57.1737 41.0345 177.6757 39 N 4.4154 7.6946 115.4749 55.4619 38.5381 176.3055 40 Y 4.6444 6.8888 117.5420 60.4665 38.6139 177.2573 41 K 4.2889 7.6920 117.9925 58.1146 32.9952 177.1827 42 K 4.4569 7.1605 119.7592 54.1477 32.4153 175.8984 43 S 4.2727 8.2095 119.3385 58.8280 63.7097 175.4999 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 I 8.01 4.12 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.35 0.91 0.00 0.00 2 T 8.26 4.49 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 3 A 7.88 4.68 1.21 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 0.00 0.00 0.00 0.00 0.00 4 K 8.29 4.33 0.00 1.88 1.83 0.00 1.59 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.46 7.81 5 P 0.00 4.34 0.00 2.06 2.03 0.00 3.70 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 6 A 8.50 4.02 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.74 4.21 0.00 1.76 1.88 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.43 7.81 8 T 7.31 4.59 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 9 P 0.00 4.02 0.00 2.05 2.07 0.00 3.65 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.28 0.00 10 T 8.48 4.81 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 11 S 8.23 4.38 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 12 P 0.00 4.20 0.00 2.16 2.14 0.00 3.59 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 13 K 7.95 3.92 0.00 1.77 1.79 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.47 7.81 14 E 7.99 3.98 0.00 2.20 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 2.32 2.35 0.00 15 Q 8.53 3.99 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 16 A 8.12 3.91 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 17 I 7.81 3.71 2.04 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 1.44 0.74 0.91 0.00 0.00 18 G 8.14 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.14 3.84 0.00 1.73 1.69 0.46 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.14 4.02 0.00 4.03 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.18 3.63 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 1.07 0.00 0.00 1.04 0.00 0.00 22 T 8.22 4.05 4.64 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 23 F 9.01 4.23 0.00 3.03 3.14 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 24 L 8.52 4.15 0.00 1.97 1.78 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.34 4.16 0.00 4.04 4.08 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 0.00 0.00 0.00 0.00 26 F 8.10 4.29 0.00 3.24 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.32 4.22 0.00 1.78 1.78 0.99 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.34 4.04 0.00 1.77 1.76 0.95 1.31 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 29 P 0.00 4.29 0.00 2.18 2.09 0.00 3.83 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.14 0.00 30 A 7.61 4.20 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.39 3.71 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 0.00 0.00 0.00 32 W 8.74 4.15 0.00 3.53 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.26 3.83 2.41 0.00 0.00 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 1.34 0.00 0.00 34 L 8.17 4.33 0.00 1.89 1.77 0.98 1.02 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 35 Y 7.92 4.09 0.00 3.01 2.95 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 0.00 0.00 0.00 36 H 7.59 4.21 0.00 2.30 2.31 0.00 5.87 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 6.88 3.80 0.00 1.88 1.56 0.92 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 38 D 7.67 4.26 0.00 2.64 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.69 4.42 0.00 2.43 2.76 0.00 0.00 6.88 7.46 0.00 0.00 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 Y 6.89 4.64 0.00 3.02 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 41 K 7.69 4.29 0.00 1.73 1.92 0.00 1.63 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.73 7.81 42 K 7.16 4.46 0.00 1.68 1.67 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.12 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.41 7.81 43 S 8.21 4.27 0.00 4.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00