NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 A 4.4808 8.1233 123.5830 52.2017 21.0259 179.1311 21 K 3.8287 7.9130 115.2175 58.2038 31.7658 177.5444 22 K 3.9000 8.7927 120.1443 60.2960 32.6674 177.4453 23 D 4.3997 8.1586 117.4904 57.5467 40.7628 178.2957 24 I 3.8698 8.1919 115.7951 63.5137 38.0487 176.5203 25 M 4.5459 7.5177 119.0792 54.5232 33.9683 177.4276 26 G 4.1534 7.9040 109.2457 46.1800 0.0000 174.9465 27 D 4.9602 8.6915 123.8343 52.2095 43.0013 174.5106 28 K 4.7103 8.1456 120.8912 55.1073 35.6985 175.1089 29 T 4.7838 8.1773 110.5147 59.7087 71.4940 173.6019 30 V 4.4467 7.9812 121.0750 60.2586 34.4366 174.3818 31 R 4.4202 8.4671 120.7532 54.8773 31.0306 176.4649 32 V 4.3340 7.9473 115.8568 58.9836 34.3932 176.3666 33 R 3.8973 8.4189 119.6291 56.8272 30.7272 177.6693 34 A 4.0277 8.8294 126.0710 55.4103 18.1899 179.1403 35 D 4.3682 8.0457 117.1332 56.4930 39.5696 178.7737 36 L 4.0161 7.8476 120.0110 57.8409 41.7160 178.5857 37 H 4.1307 8.4265 118.2889 59.5172 29.7281 176.7445 38 H 4.1556 8.7438 120.4852 59.1854 29.6880 177.2547 39 I 3.6519 7.5239 121.5935 64.6476 37.0244 178.5484 40 I 3.7424 7.7066 120.4373 64.0196 36.8320 178.8115 41 K 3.8462 8.0893 119.6899 59.4724 31.9001 179.1049 42 I 3.6290 7.6518 120.1062 64.5022 36.9756 178.0817 43 E 3.8779 8.1708 119.8597 59.6084 29.3789 178.9868 44 T 4.5543 8.4080 109.6876 64.0434 68.6614 176.0361 45 A 4.0740 7.7278 123.1557 54.9851 18.5863 179.2600 46 K 4.0002 8.1834 115.9203 59.3376 32.5811 177.2576 47 N 4.9135 8.0855 114.4921 51.1451 41.4866 175.1504 48 G 3.7357 8.0979 106.9549 46.4835 0.0000 172.8221 49 G 4.0365 9.9660 109.4416 45.9291 0.0000 172.0393 50 N 4.7799 7.9904 114.6997 50.6799 41.1405 175.1872 51 V 3.5616 8.2657 119.4600 66.1457 31.4171 177.6172 52 K 3.9520 8.0451 118.9873 59.4927 31.9614 178.2778 53 E 4.0368 8.0869 117.0943 58.8207 29.6816 179.1242 54 V 3.5914 7.4875 118.9919 66.0533 31.5375 177.7669 55 M 4.0347 8.0566 118.4315 58.5930 31.7762 178.2879 56 D 4.3651 8.3722 119.2666 57.5356 40.9268 178.9650 57 Q 3.9028 7.9373 119.4626 59.1476 29.2826 177.6651 58 A 4.0082 8.6984 122.4152 55.2672 18.3505 179.4658 59 L 3.9228 8.2254 118.8161 58.1987 42.1747 178.6552 60 E 3.9946 8.4157 119.4583 59.5329 29.4981 178.7295 61 E 4.0278 8.5785 118.8188 59.2928 29.3949 178.6690 62 Y 4.1358 8.0726 119.3752 60.9693 38.9691 178.3017 63 I 3.8139 8.2279 120.6904 64.6009 36.9844 178.7435 64 R 3.9838 8.2761 118.4288 58.9716 29.8732 178.6272 65 K 3.8135 8.0180 119.6039 59.0675 32.3147 177.9133 66 Y 4.3463 8.1918 116.9644 58.5823 39.1839 175.8618 67 L 4.9409 7.8688 120.0933 53.4072 42.4614 176.4169 68 P 4.3996 0.0000 0.0000 65.0687 31.7172 177.5979 69 D 4.5962 8.0176 117.2752 54.7318 39.6342 176.8466 70 K 4.3236 8.0608 118.7414 56.8832 32.8744 176.6384 71 L 4.3632 7.4608 122.4746 54.7518 42.0321 176.0888 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 20 A 8.12 4.48 1.33 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 0.00 0.00 0.00 21 K 7.91 3.83 0.00 1.87 1.87 0.00 1.70 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.50 7.81 22 K 8.79 3.90 0.00 1.75 1.85 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.54 7.81 23 D 8.16 4.40 0.00 2.86 2.64 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 24 I 8.19 3.87 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 1.71 0.53 0.97 0.00 0.00 25 M 7.52 4.55 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.48 0.00 26 G 7.90 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 D 8.69 4.96 0.00 2.64 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.15 4.71 0.00 1.62 1.62 0.00 1.60 0.00 0.00 1.75 0.00 0.00 3.15 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.46 7.81 29 T 8.18 4.78 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 1.21 0.00 0.00 30 V 7.98 4.45 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 0.73 0.00 0.00 0.90 0.00 0.00 31 R 8.47 4.42 0.00 1.79 1.88 0.00 3.16 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 32 V 7.95 4.33 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 0.72 0.00 0.00 0.96 0.00 0.00 33 R 8.42 3.90 0.00 1.85 2.14 0.00 3.14 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 34 A 8.83 4.03 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 35 D 8.05 4.37 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 36 L 7.85 4.02 0.00 1.87 1.77 0.93 1.03 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 37 H 8.43 4.13 0.00 3.20 3.45 0.00 5.59 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 H 8.74 4.16 0.00 3.41 3.45 0.00 5.67 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 39 I 7.52 3.65 2.08 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.96 0.91 0.00 0.00 40 I 7.71 3.74 1.94 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 1.73 0.78 0.88 0.00 0.00 41 K 8.09 3.85 0.00 1.84 1.79 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.24 7.81 42 I 7.65 3.63 1.92 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.80 0.87 0.00 0.00 43 E 8.17 3.88 0.00 2.18 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 2.29 2.35 0.00 44 T 8.41 4.55 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 1.22 0.00 0.00 45 A 7.73 4.07 1.39 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 0.00 0.00 0.00 46 K 8.18 4.00 0.00 1.69 1.88 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.48 7.81 47 N 8.09 4.91 0.00 2.65 2.76 0.00 0.00 7.13 7.59 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 48 G 8.10 3.74 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 0.00 0.00 0.00 49 G 9.97 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 0.00 0.00 0.00 50 N 7.99 4.78 0.00 2.91 2.90 0.00 0.00 5.60 7.68 0.00 0.00 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 V 8.27 3.56 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 1.04 0.00 0.00 0.89 0.00 0.00 52 K 8.05 3.95 0.00 1.86 1.79 0.00 1.77 0.00 0.00 1.87 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.65 1.50 7.81 53 E 8.09 4.04 0.00 2.24 2.19 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 2.55 2.36 0.00 54 V 7.49 3.59 2.23 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 1.02 0.00 0.00 0.93 0.00 0.00 55 M 8.06 4.03 0.00 2.08 2.23 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.95 0.00 56 D 8.37 4.37 0.00 2.83 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 57 Q 7.94 3.90 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 58 A 8.70 4.01 1.39 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 0.00 0.00 0.00 59 L 8.23 3.92 0.00 1.88 1.84 0.82 1.05 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 60 E 8.42 3.99 0.00 2.10 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 0.00 2.33 2.38 0.00 61 E 8.58 4.03 0.00 2.10 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 2.56 0.00 62 Y 8.07 4.14 0.00 3.16 3.17 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 0.00 0.00 0.00 0.00 63 I 8.23 3.81 2.11 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.16 1.03 0.00 0.00 64 R 8.28 3.98 0.00 1.86 1.97 0.00 3.34 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 65 K 8.02 3.81 0.00 1.57 1.48 0.00 1.51 0.00 0.00 1.07 0.00 0.00 2.56 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.30 0.99 7.81 66 Y 8.19 4.35 0.00 2.39 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.87 4.94 0.00 1.84 1.63 1.12 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.40 0.00 2.19 2.47 0.00 3.75 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.91 0.00 69 D 8.02 4.60 0.00 2.81 2.84 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.06 4.32 0.00 1.88 1.92 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.58 7.81 71 L 7.46 4.36 0.00 1.65 1.53 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00