NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 S 4.4341 8.1927 115.4127 58.3379 65.4868 175.4490 30 K 3.7105 8.0521 122.8268 56.8978 32.6848 177.0941 31 Q 4.1868 8.7261 118.5049 58.8917 29.3921 177.5330 32 K 4.0665 7.9681 119.9634 58.5863 32.0450 179.6769 33 V 3.6423 7.5450 120.0178 64.8550 31.4196 178.3162 34 Q 3.8324 7.9791 118.6966 58.9070 28.6990 178.7062 35 M 4.0698 7.7741 119.0312 58.4864 31.8597 179.2393 36 S 3.7193 7.7136 115.2183 61.5550 63.0574 176.5061 37 I 3.8133 7.8270 122.5383 64.8231 36.7246 178.1493 38 H 4.2020 8.4497 117.2029 59.0965 28.6248 177.7305 39 Q 3.8397 7.7392 120.7459 58.9786 28.8011 178.0529 40 F 4.2317 8.4008 119.3079 60.7562 38.9534 177.6036 41 T 3.9174 8.2004 115.5098 66.7518 68.2045 175.9301 42 N 4.2919 8.3320 118.9096 56.8165 38.3965 176.9474 43 I 3.7333 7.8296 120.8848 64.8018 37.2134 177.9346 44 C 4.4103 8.6793 117.8081 59.7304 41.1563 175.7852 45 F 4.0768 8.8209 122.7808 61.3174 38.7226 177.0936 46 K 3.8654 7.5346 116.0815 59.8273 32.0296 179.1897 47 K 4.1433 7.5674 115.8917 58.7597 32.0567 177.9314 48 C 4.8477 8.3474 115.4401 56.3062 41.9525 174.0242 49 V 3.8811 7.1486 120.3896 61.0201 30.0671 174.8559 50 E 4.0440 8.4448 127.0128 58.0600 29.9917 177.3881 51 S 4.4781 7.5186 111.2498 56.5904 65.7702 173.1108 52 V 4.0737 8.3962 125.0744 61.8751 31.7147 174.9528 53 N 5.0199 8.6288 121.7658 52.2731 38.8013 172.8007 54 D 4.6666 7.7413 117.3464 53.0040 42.2013 174.7368 55 S 4.5804 8.4688 111.7507 58.3233 63.6679 173.7005 56 N 4.7428 7.7591 119.6894 52.2881 39.3763 174.6835 57 L 4.3967 8.3175 123.0085 54.0617 42.5546 177.2700 58 S 4.5028 9.2067 119.1810 57.3833 64.2380 175.5637 59 S 4.1176 8.6150 115.5099 61.9250 62.9194 175.7047 60 Q 4.0327 8.1186 123.4865 58.7201 28.7382 177.8392 61 E 4.0529 8.3021 118.1225 58.6946 29.3414 178.5246 62 E 3.9743 7.9183 121.0975 59.0797 29.6599 178.1635 63 Q 3.9611 8.1529 119.7636 58.9854 29.0838 176.8683 64 C 4.1446 8.1937 119.1417 59.7298 38.8504 175.1715 65 L 3.9083 7.6714 122.0612 58.1644 41.7258 179.1047 66 S 4.1587 7.8384 113.9836 61.1766 63.3005 175.7711 67 N 4.1934 8.2734 120.5019 56.3526 38.3056 175.9788 68 C 4.0683 8.3858 119.7353 60.0004 44.8261 175.8142 69 V 3.2560 7.4349 119.3846 66.0373 30.9709 177.7199 70 N 4.2357 7.9649 115.7568 56.4523 38.5191 177.3040 71 R 3.8686 8.4500 120.3956 59.4131 30.0666 178.3091 72 F 3.6779 8.4472 120.4847 61.1816 39.5509 177.1180 73 L 4.0973 8.0617 118.6527 57.9103 41.4148 179.1252 74 D 4.3774 8.4395 119.1800 57.6963 40.6726 179.0672 75 T 3.7574 7.7116 115.8396 66.6665 68.3796 176.0690 76 N 4.2746 8.0303 118.2757 56.6469 38.6609 177.4396 77 I 3.6843 7.5720 120.1732 64.3731 37.2008 178.3127 78 R 3.8744 7.9883 119.4463 59.5879 29.8659 178.5769 79 I 3.6932 8.0237 119.8904 64.3619 36.9228 178.8951 80 V 3.6491 7.8912 118.9959 64.7564 31.3502 177.7068 81 N 4.5332 8.4698 116.7842 56.2165 38.5719 177.1801 82 G 3.8404 7.9945 105.3966 47.7806 0.0000 173.7564 83 L 4.3300 7.7422 124.5540 54.9214 41.8637 176.6732 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 29 S 8.19 4.43 0.00 4.02 4.13 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 30 K 8.05 3.71 0.00 1.85 1.87 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.55 7.81 31 Q 8.73 4.19 0.00 2.31 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 32 K 7.97 4.07 0.00 1.82 1.89 0.00 1.71 0.00 0.00 1.87 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.49 7.81 33 V 7.54 3.64 2.18 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 0.85 0.00 0.00 0.94 0.00 0.00 34 Q 7.98 3.83 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.90 0.00 0.00 0.00 0.00 0.00 2.57 2.38 0.00 35 M 7.77 4.07 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.58 0.00 36 S 7.71 3.72 0.00 3.86 3.63 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.83 3.81 1.96 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.88 0.95 0.00 0.00 38 H 8.45 4.20 0.00 3.23 3.26 0.00 5.62 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 39 Q 7.74 3.84 0.00 1.99 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.81 0.00 0.00 0.00 0.00 0.00 2.18 2.19 0.00 40 F 8.40 4.23 0.00 3.03 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.20 3.92 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 1.20 0.00 0.00 42 N 8.33 4.29 0.00 2.87 2.95 0.00 0.00 7.30 8.38 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 43 I 7.83 3.73 1.81 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.04 0.96 0.00 0.00 44 C 8.68 4.41 0.00 3.08 3.18 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 45 F 8.82 4.08 0.00 3.15 3.11 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 0.00 0.00 0.00 46 K 7.53 3.87 0.00 2.12 1.91 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.58 1.81 7.81 47 K 7.57 4.14 0.00 1.79 1.89 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.65 7.81 48 C 8.35 4.85 0.00 2.95 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 49 V 7.15 3.88 0.99 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 0.42 0.00 0.00 0.71 0.00 0.00 50 E 8.44 4.04 0.00 1.91 1.89 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 2.25 2.21 0.00 51 S 7.52 4.48 0.00 3.94 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.40 4.07 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 0.89 0.00 0.00 1.00 0.00 0.00 53 N 8.63 5.02 0.00 2.78 2.81 0.00 0.00 6.07 8.06 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 54 D 7.74 4.67 0.00 2.76 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.47 4.58 0.00 4.01 4.02 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.76 4.74 0.00 2.96 2.79 0.00 0.00 6.96 7.75 0.00 0.00 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 L 8.32 4.40 0.00 1.65 1.62 0.96 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 58 S 9.21 4.50 0.00 3.97 4.01 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 0.00 0.00 0.00 59 S 8.62 4.12 0.00 4.04 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 60 Q 8.12 4.03 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 61 E 8.30 4.05 0.00 2.23 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 0.00 2.33 2.31 0.00 62 E 7.92 3.97 0.00 2.34 2.03 0.00 0.00 0.00 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 2.32 0.00 63 Q 8.15 3.96 0.00 2.21 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.53 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 64 C 8.19 4.14 0.00 3.02 3.23 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 65 L 7.67 3.91 0.00 2.05 1.72 0.97 1.02 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 66 S 7.84 4.16 0.00 4.06 4.09 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 0.00 0.00 0.00 0.00 67 N 8.27 4.19 0.00 2.96 2.93 0.00 0.00 6.64 8.19 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 68 C 8.39 4.07 0.00 3.12 3.35 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 69 V 7.43 3.26 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 0.53 0.00 0.00 0.95 0.00 0.00 70 N 7.96 4.24 0.00 2.93 2.82 0.00 0.00 6.70 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 71 R 8.45 3.87 0.00 2.11 1.96 0.00 3.13 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 72 F 8.45 3.68 0.00 3.33 2.99 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 73 L 8.06 4.10 0.00 1.86 1.71 0.83 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.44 4.38 0.00 2.80 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 75 T 7.71 3.76 4.07 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 0.99 0.00 0.00 76 N 8.03 4.27 0.00 3.00 2.96 0.00 0.00 7.11 6.61 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 77 I 7.57 3.68 1.87 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 1.42 0.82 0.91 0.00 0.00 78 R 7.99 3.87 0.00 2.08 2.00 0.00 3.13 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 79 I 8.02 3.69 2.07 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.59 0.91 0.00 0.00 80 V 7.89 3.65 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 0.84 0.00 0.00 0.94 0.00 0.00 81 N 8.47 4.53 0.00 2.75 2.93 0.00 0.00 7.02 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 7.99 3.84 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 0.00 0.00 0.00 83 L 7.74 4.33 0.00 1.81 1.59 0.92 0.62 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