NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 E 4.2494 8.4444 121.4703 54.6667 30.3422 177.1307 13 L 4.8661 8.2379 120.1762 54.0434 45.1215 166.4953 14 V 4.2902 8.2119 124.9838 60.8179 35.1253 173.5677 15 D 4.4854 8.7152 127.5151 53.1577 41.5001 174.8527 16 P 4.2498 0.0000 0.0000 65.7532 30.9778 178.0518 17 L 3.9634 7.9349 120.7135 58.2920 41.9174 179.0888 18 T 3.8901 8.1199 115.9490 67.2433 68.4583 176.2623 19 T 3.8404 8.0708 116.8083 67.3623 68.3647 176.1615 20 I 3.7743 8.2820 121.1104 64.6669 37.3223 178.8443 21 R 3.9534 8.1656 118.7958 59.3602 29.6642 179.0039 22 E 4.2825 8.0177 118.7805 59.0012 29.7230 178.6014 23 H 4.3542 8.3033 118.3368 59.6490 30.0466 176.8207 24 C 4.2837 8.5853 118.5712 59.8016 38.7464 175.4149 25 E 4.1013 8.2207 118.9113 58.0265 28.8713 178.1926 26 Q 4.2638 7.7025 117.3933 56.2665 29.6784 176.3316 27 T 4.0061 7.3592 118.1755 63.0594 69.4340 174.4346 28 E 4.0127 9.0472 126.3639 59.8190 29.4199 179.4163 29 K 3.9008 8.1051 117.4254 59.8643 31.8399 178.9758 30 C 4.2622 8.0031 116.1078 62.8338 28.1378 175.9210 31 V 3.7265 8.5973 120.5485 66.1073 31.0820 178.2210 32 K 3.9533 8.5791 118.1241 59.3464 31.9513 179.1720 33 A 4.0352 8.2505 121.0743 55.2320 18.3361 179.3421 34 R 3.4207 9.1559 118.1575 59.5528 30.1083 177.9753 35 E 3.8662 8.3717 119.0306 59.6832 29.6648 179.1911 36 R 3.9679 8.0816 117.7363 58.8426 30.0223 179.0011 37 L 3.8686 7.8513 120.3348 58.2799 42.1278 178.7010 38 E 3.9882 8.2213 118.6196 59.4319 29.3424 179.5524 39 L 3.9385 7.7599 118.4284 57.7774 41.6231 178.6153 40 C 4.1525 8.0486 118.2756 59.6960 42.1537 174.6923 41 D 4.2849 8.5396 119.7004 57.5242 40.8175 178.0604 42 A 3.9793 8.0914 121.1317 55.4657 18.1678 179.8734 43 R 3.9776 7.6416 114.2423 58.8495 29.6473 178.8534 44 V 3.7075 8.1256 119.3139 65.9062 31.3297 178.2934 45 S 4.1515 8.2934 114.5564 61.2247 62.6286 176.2056 46 S 4.3103 8.0257 115.8411 58.8900 63.0767 173.8249 47 R 4.4834 6.9123 122.3763 55.0677 31.5507 175.7153 48 S 4.7032 8.4207 116.6010 58.7365 64.2669 174.7030 49 H 4.9131 7.6893 118.9403 55.4185 29.9909 172.7253 50 T 4.6337 7.3052 113.6619 60.3424 70.7124 173.2824 51 E 4.1037 8.7335 126.8995 58.2718 30.1011 176.8929 52 E 4.0214 7.2671 118.7718 56.8719 30.1394 175.8964 53 Q 4.6081 8.1032 120.2015 54.2126 32.9880 175.6570 54 C 5.6309 8.2932 116.9072 56.6149 36.8241 176.6596 55 T 3.4562 7.6998 118.8905 66.6476 68.0400 175.1747 56 E 3.8014 7.9739 120.4400 59.7226 29.4836 178.7618 57 E 4.0710 8.0583 117.6895 59.1984 29.5712 178.9114 58 L 4.0942 8.1230 120.5555 58.2036 42.0776 179.1397 59 F 4.5267 8.8463 117.9693 60.9659 39.0051 177.1933 60 D 4.3275 8.7690 118.9370 57.6206 40.5731 178.8477 61 F 4.2235 8.6282 121.0038 61.3014 39.4650 177.0369 62 L 3.7065 8.7758 118.8389 58.1023 41.5887 179.2079 63 H 3.9570 8.9625 118.3841 59.2334 29.7002 177.2810 64 A 3.9999 7.8212 122.0725 54.9922 18.1417 179.4717 65 R 3.6853 7.9476 117.5847 59.7755 30.1019 178.4970 66 D 4.2627 8.1986 118.8680 57.5723 40.5378 178.4054 67 H 3.9981 7.7819 117.6586 59.2398 29.6182 176.2706 68 C 4.4371 7.8968 120.5020 59.5460 41.4410 175.5626 69 V 3.5309 7.9214 119.8307 66.0813 30.8750 177.4797 70 A 3.8199 7.8711 119.2573 55.9528 18.1365 179.1213 71 H 4.1520 7.8392 112.6114 58.1326 28.9676 177.3498 72 K 4.3266 7.8799 119.1082 58.1688 33.0680 178.2104 73 L 3.9582 8.1707 121.2148 58.6406 41.9453 179.3210 74 F 4.4545 8.3815 116.3166 60.0716 38.6660 177.2122 75 N 4.4259 8.3912 115.9554 55.4849 38.3814 176.4106 76 K 4.3708 7.8042 117.1608 55.7578 33.0419 176.6925 77 L 4.3814 6.7771 119.2997 53.5143 42.9627 176.6712 78 K 4.0857 8.2717 120.2275 56.6747 32.1491 176.3279 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 12 E 8.44 4.25 0.00 1.95 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 2.19 2.31 0.00 13 L 8.24 4.87 0.00 1.78 1.57 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 14 V 8.21 4.29 2.09 0.00 0.00 0.00 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 0.94 0.00 0.00 15 D 8.72 4.49 0.00 2.76 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.25 0.00 2.32 2.32 0.00 3.76 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.04 0.00 17 L 7.93 3.96 0.00 1.76 1.85 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.12 3.89 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 1.23 0.00 0.00 19 T 8.07 3.84 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 20 I 8.28 3.77 1.97 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 1.55 0.86 0.95 0.00 0.00 21 R 8.17 3.95 0.00 2.19 2.02 0.00 3.25 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 22 E 8.02 4.28 0.00 2.15 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 2.39 2.51 0.00 23 H 8.30 4.35 0.00 3.27 3.50 0.00 5.78 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 24 C 8.59 4.28 0.00 3.17 3.08 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 25 E 8.22 4.10 0.00 2.28 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 2.70 2.59 0.00 26 Q 7.70 4.26 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.85 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 27 T 7.36 4.01 4.39 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 1.21 0.00 0.00 28 E 9.05 4.01 0.00 2.03 1.97 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 2.39 2.44 0.00 29 K 8.11 3.90 0.00 1.82 1.86 0.00 1.68 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.54 7.81 30 C 8.00 4.26 0.00 3.20 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.60 3.73 2.26 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 1.14 0.00 0.00 1.06 0.00 0.00 32 K 8.58 3.95 0.00 1.97 1.86 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.69 7.81 33 A 8.25 4.04 1.61 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 0.00 0.00 0.00 0.00 0.00 0.00 34 R 9.16 3.42 0.00 1.46 2.21 0.00 3.11 0.00 0.00 2.75 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 35 E 8.37 3.87 0.00 2.28 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 2.35 0.00 36 R 8.08 3.97 0.00 2.04 1.97 0.00 3.19 0.00 0.00 3.11 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.94 0.00 37 L 7.85 3.87 0.00 1.72 1.74 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.22 3.99 0.00 2.12 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 2.24 2.52 0.00 39 L 7.76 3.94 0.00 1.86 1.69 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.05 4.15 0.00 2.99 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.54 4.28 0.00 2.80 2.80 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 42 A 8.09 3.98 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.64 3.98 0.00 1.99 2.07 0.00 3.06 0.00 0.00 2.99 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.50 0.00 44 V 8.13 3.71 2.06 0.00 0.00 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 0.93 0.00 0.00 45 S 8.29 4.15 0.00 3.99 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 S 8.03 4.31 0.00 4.08 4.18 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 47 R 6.91 4.48 0.00 1.74 1.84 0.00 3.34 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 48 S 8.42 4.70 0.00 3.88 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 49 H 7.69 4.91 0.00 3.00 3.18 0.00 5.87 0.00 0.00 0.00 0.00 8.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.31 4.63 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 51 E 8.73 4.10 0.00 1.97 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 2.25 2.20 0.00 52 E 7.27 4.02 0.00 1.89 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 53 Q 8.10 4.61 0.00 1.95 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.28 0.00 0.00 0.00 0.00 0.00 2.22 2.50 0.00 54 C 8.29 5.63 0.00 2.90 3.07 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 55 T 7.70 3.46 3.89 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 0.20 0.00 0.00 56 E 7.97 3.80 0.00 1.97 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 57 E 8.06 4.07 0.00 2.08 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 2.39 2.43 0.00 58 L 8.12 4.09 0.00 1.83 1.90 1.12 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.85 4.53 0.00 3.22 3.05 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 0.00 0.00 0.00 60 D 8.77 4.33 0.00 2.89 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 F 8.63 4.22 0.00 3.23 3.40 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 62 L 8.78 3.71 0.00 1.80 1.70 1.09 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.96 3.96 0.00 3.22 3.48 0.00 5.58 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 7.82 4.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 R 7.95 3.69 0.00 1.07 1.45 0.00 3.09 0.00 0.00 3.01 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 66 D 8.20 4.26 0.00 2.76 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 H 7.78 4.00 0.00 3.18 3.45 0.00 5.76 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 C 7.90 4.44 0.00 2.97 3.34 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 69 V 7.92 3.53 2.17 0.00 0.00 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 1.00 0.00 0.00 70 A 7.87 3.82 1.18 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 0.00 0.00 71 H 7.84 4.15 0.00 3.25 3.38 0.00 5.84 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 7.88 4.33 0.00 1.87 1.86 0.00 1.70 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.56 7.81 73 L 8.17 3.96 0.00 1.85 1.78 1.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 74 F 8.38 4.45 0.00 2.97 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 N 8.39 4.43 0.00 2.96 2.91 0.00 0.00 6.92 7.13 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 76 K 7.80 4.37 0.00 1.89 1.86 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.48 7.81 77 L 6.78 4.38 0.00 1.36 1.40 0.79 0.77 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 78 K 8.27 4.09 0.00 1.67 1.62 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.39 7.81