NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.0680 8.2876 121.4554 55.5871 31.4735 176.6564 20 I 4.4491 7.4853 107.9332 59.0921 38.5614 172.6422 21 D 4.6732 7.3971 118.9345 53.6248 44.8794 175.4664 22 Y 4.4086 8.2129 121.6512 58.9240 38.8822 176.9549 23 K 3.7567 6.9439 118.5852 59.5675 33.1407 177.1396 24 D 4.6571 8.9604 121.4952 53.3554 39.2375 176.7494 25 I 3.7532 7.6298 116.4765 64.1675 37.5297 177.9151 26 A 3.9407 7.8469 121.1937 55.3638 18.6973 179.1254 27 T 3.9968 8.4703 114.2011 67.0034 68.6090 176.6191 28 L 4.3564 7.8187 120.2424 58.1249 41.5136 179.6039 29 K 4.0724 7.7241 116.4589 58.6931 32.0328 178.1373 30 N 4.4733 8.3735 116.5239 54.5845 38.8379 175.6682 31 Y 4.7369 8.3716 118.1530 56.6698 39.4564 175.0378 32 I 4.8811 7.0825 118.9424 59.8282 41.3111 175.5134 33 T 4.3988 8.2452 114.4762 60.5538 70.3907 175.3725 34 E 4.1606 8.5582 119.9572 59.3057 30.0204 178.9049 35 S 4.1935 8.3579 115.5453 60.5006 63.2059 175.2976 36 G 4.0527 7.7390 109.8883 45.9385 0.0000 175.0634 37 K 4.0594 8.0718 119.6505 56.1893 33.0680 176.3055 38 I 4.3193 8.1281 115.2454 61.3125 38.5708 175.1350 39 V 4.2661 8.3274 116.3396 59.5331 32.8161 175.1511 40 P 4.5251 0.0000 0.0000 63.0777 31.3671 175.7581 41 S 5.2439 8.8644 112.8659 59.9157 64.2397 175.9243 42 R 4.0653 8.0236 117.3549 59.2024 29.5856 178.3938 43 I 4.5314 7.5284 119.0023 60.5248 36.9442 175.6736 44 T 4.2065 8.1038 111.3926 60.8569 72.6361 175.9682 45 G 4.0824 7.7427 110.1224 46.5392 0.0000 173.9070 46 T 3.7750 7.9205 113.1067 61.7718 67.7790 174.0199 47 R 3.9574 8.6881 127.0804 56.7265 31.9868 176.4898 48 A 4.0099 8.3887 121.1412 54.3633 18.4145 179.5127 49 K 3.7867 7.9222 115.9121 59.9515 32.2372 178.5949 50 Y 4.2120 7.8475 116.2014 61.0217 37.9857 177.4893 51 Q 3.9179 8.4136 120.5732 59.7504 28.9514 178.9752 52 R 3.8631 8.0870 118.5191 59.6250 29.9471 178.7102 53 Q 3.9383 8.0647 118.4294 59.0274 29.0551 178.3365 54 L 3.9782 8.9378 123.1672 57.4638 42.1562 178.4152 55 A 3.9173 8.3080 120.9832 55.5188 18.2224 179.3750 56 R 3.7359 7.6071 115.9310 59.6505 30.2010 178.6790 57 A 4.0092 7.5847 119.8415 55.4565 18.3199 179.5484 58 I 3.5914 7.3806 117.4138 64.5210 37.0001 178.6294 59 K 3.5457 7.5417 117.4092 59.4204 32.1669 179.0408 60 R 3.4894 7.6084 117.8187 59.3435 30.0161 178.9883 61 A 4.1415 7.9490 120.0583 55.1999 18.1315 179.5784 62 R 4.8196 7.5988 116.4322 58.0091 30.1283 177.5311 63 Y 4.8968 8.1069 115.3320 58.1041 38.8471 176.5626 64 L 4.6006 7.5997 118.3739 53.6388 42.2336 176.0804 65 S 3.8712 7.9430 110.9244 59.3013 60.6990 172.0617 66 L 4.4740 7.9003 116.7167 54.9164 42.0750 176.7452 67 L 4.5154 7.3112 117.6508 53.0483 45.5512 172.6951 68 P 5.0477 0.0000 0.0000 62.2975 32.6986 175.9536 69 Y 4.1355 8.9118 117.6560 61.1584 38.5768 176.0779 70 T 4.8119 7.4944 111.3693 60.7961 70.2164 173.5354 71 D 4.5251 8.4374 125.4866 56.4418 41.6102 177.3444 72 R 4.0084 8.0588 118.6702 59.7794 30.1010 175.3007 73 H 4.1908 7.7679 119.6162 56.8433 30.6244 173.0767 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 19 E 8.29 4.07 0.00 1.93 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 1.96 1.83 0.00 20 I 7.49 4.45 1.80 0.00 0.00 0.78 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 0.88 0.80 0.00 0.00 21 D 7.40 4.67 0.00 2.50 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 0.00 0.00 0.00 0.00 22 Y 8.21 4.41 0.00 3.11 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 23 K 6.94 3.76 0.00 1.67 1.43 0.00 1.36 0.00 0.00 1.52 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.19 1.66 7.81 24 D 8.96 4.66 0.00 2.70 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.63 3.75 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.70 1.03 0.00 0.00 26 A 7.85 3.94 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 27 T 8.47 4.00 4.33 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 0.00 0.00 0.00 1.44 0.00 0.00 28 L 7.82 4.36 0.00 1.74 1.82 0.99 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.72 4.07 0.00 1.89 1.88 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.75 7.81 30 N 8.37 4.47 0.00 2.17 2.32 0.00 0.00 6.85 7.48 0.00 0.00 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 Y 8.37 4.74 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 32 I 7.08 4.88 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.84 0.98 0.00 0.00 33 T 8.25 4.40 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 34 E 8.56 4.16 0.00 1.97 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 0.00 2.31 2.39 0.00 35 S 8.36 4.19 0.00 3.90 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 36 G 7.74 4.05 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 0.00 0.00 0.00 37 K 8.07 4.06 0.00 1.97 1.99 0.00 1.53 0.00 0.00 1.89 0.00 0.00 3.11 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.46 7.81 38 I 8.13 4.32 2.02 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.88 0.91 0.00 0.00 39 V 8.33 4.27 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 0.74 0.00 0.00 1.04 0.00 0.00 40 P 0.00 4.53 0.00 1.95 2.06 0.00 3.69 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 41 S 8.86 5.24 0.00 3.98 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 42 R 8.02 4.07 0.00 2.02 2.23 0.00 2.97 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 43 I 7.53 4.53 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.55 0.92 0.00 0.00 44 T 8.10 4.21 4.37 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 1.27 0.00 0.00 45 G 7.74 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 0.00 0.00 0.00 46 T 7.92 3.78 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 47 R 8.69 3.96 0.00 0.83 1.31 0.00 2.88 0.00 0.00 2.25 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.38 0.00 48 A 8.39 4.01 1.23 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 0.00 0.00 0.00 49 K 7.92 3.79 0.00 1.80 1.82 0.00 1.76 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.67 1.64 7.81 50 Y 7.85 4.21 0.00 3.14 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Q 8.41 3.92 0.00 2.29 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 52 R 8.09 3.86 0.00 2.08 1.96 0.00 3.18 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 53 Q 8.06 3.94 0.00 2.28 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 54 L 8.94 3.98 0.00 1.68 1.69 -0.55 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.31 3.92 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 56 R 7.61 3.74 0.00 1.95 1.97 0.00 3.13 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 57 A 7.58 4.01 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 58 I 7.38 3.59 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.91 0.86 0.00 0.00 59 K 7.54 3.55 0.00 1.60 1.37 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.36 7.81 60 R 7.61 3.49 0.00 1.67 1.51 0.00 3.04 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.55 0.00 61 A 7.95 4.14 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.60 4.82 0.00 1.67 1.43 0.00 2.79 0.00 0.00 2.50 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 63 Y 8.11 4.90 0.00 2.90 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 64 L 7.60 4.60 0.00 1.62 1.73 0.88 0.82 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 65 S 7.94 3.87 0.00 4.06 3.98 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 0.00 0.00 0.00 66 L 7.90 4.47 0.00 1.87 1.75 1.09 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.31 4.52 0.00 1.66 1.50 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 5.05 0.00 2.42 2.11 0.00 3.79 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 69 Y 8.91 4.14 0.00 2.95 3.13 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 0.00 0.00 0.00 70 T 7.49 4.81 4.33 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 0.00 0.00 0.00 1.28 0.00 0.00 71 D 8.44 4.53 0.00 2.92 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 8.06 4.01 0.00 1.83 2.01 0.00 3.35 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 73 H 7.77 4.19 0.00 3.20 3.04 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00