NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 D 4.5935 8.2233 120.1923 53.9127 42.7262 175.5473 10 E 3.7265 8.9819 127.1187 59.4662 29.3863 177.8885 11 D 4.3930 8.3979 118.4870 57.4905 41.3418 178.3227 12 L 3.0822 7.4868 120.0827 57.8665 42.0048 178.7924 13 L 3.8843 7.5413 118.5516 57.8558 41.6415 179.4934 14 K 3.8734 8.0097 119.0955 59.3982 32.0759 178.6868 15 A 3.9478 7.9843 121.1699 55.0627 18.1986 179.8422 16 V 3.4924 7.8504 116.9016 66.2626 31.7783 178.2599 17 R 3.9279 8.0959 117.9116 59.3316 29.8967 178.8644 18 L 4.0831 7.9539 119.8360 58.2231 42.1394 178.9505 19 I 3.7244 7.9415 119.8569 64.2027 36.9848 178.1142 20 K 4.0090 8.4485 120.7345 59.7814 31.9888 178.3664 21 F 4.4235 8.2262 120.3580 61.5981 39.0139 177.0735 22 L 3.7591 7.8249 117.3262 57.3274 41.4667 178.5052 23 Y 4.2860 7.6989 116.4885 60.5017 37.8310 177.8179 24 Q 4.0713 8.1611 118.4021 58.2643 29.1923 177.6297 25 S 4.1569 7.3657 114.5449 58.9627 63.9980 173.5091 26 N 4.2505 8.4635 117.8827 53.9426 35.4908 171.3946 27 P 5.0786 0.0000 0.0000 60.6982 34.5968 174.2862 28 P 3.2910 0.0000 0.0000 62.1742 32.9275 175.4354 29 P 4.3176 0.0000 0.0000 64.4010 29.4360 175.8196 30 N 4.7272 8.9123 109.3018 52.9163 41.5129 172.1866 31 P 4.7313 0.0000 0.0000 61.4810 33.2254 175.0166 32 E 4.6124 8.4892 119.4812 54.4956 32.6516 175.4201 33 G 4.0134 8.5178 112.8914 44.5372 0.0000 173.2155 34 T 4.1917 8.2147 110.1442 60.3607 71.3160 172.5792 35 R 3.9227 8.6029 124.3234 57.8421 30.2563 178.2286 36 Q 3.5798 8.9256 120.3173 57.3122 28.0491 175.5071 37 A 4.2340 7.9955 118.4443 54.0648 18.8232 179.3880 38 R 3.9789 8.1939 118.1167 59.7451 30.0319 178.7357 39 R 4.0855 7.9118 116.4311 58.1558 30.0030 178.2549 40 N 4.3367 7.6682 116.5141 56.7772 38.9438 176.8706 41 R 4.1114 7.7110 118.1574 58.3671 30.1602 179.1605 42 R 4.0569 7.8792 118.1076 59.3934 30.2172 178.6164 43 R 3.9419 7.6695 117.4996 59.4362 30.1257 179.0936 44 R 4.0121 7.7044 118.1901 59.4152 30.1246 178.4747 45 W 4.0425 8.9679 128.6940 60.0993 30.6301 178.3021 46 R 3.8701 8.7662 118.6104 59.2348 29.5932 178.4426 47 E 3.8603 8.1026 118.3077 59.6433 29.5498 179.6584 48 R 3.6674 7.7576 118.2125 59.4468 30.1018 178.3755 49 Q 3.5534 7.5534 119.4794 58.9537 28.7948 178.0999 50 R 3.8955 8.3801 119.5103 59.3858 30.0178 178.5613 51 Q 3.9165 7.9530 119.3553 58.9844 29.0388 177.8556 52 I 3.4224 7.6341 120.5825 64.8385 37.0929 177.4132 53 H 4.2824 8.7479 120.5602 58.9186 29.6383 177.3371 54 S 4.1458 7.9516 115.8050 61.3685 62.7994 176.5266 55 I 3.6611 7.8660 123.3256 64.3103 36.8311 178.4495 56 S 4.1086 8.1793 116.1279 61.5590 62.6945 176.0503 57 E 3.9340 8.3907 122.1551 59.7074 29.0766 179.2790 58 R 4.0117 8.0427 118.8354 58.8050 29.9718 179.0728 59 I 3.8793 8.0538 118.5274 64.5671 37.4573 178.2562 60 L 4.3448 8.4257 120.3163 57.7882 41.5564 179.4375 61 S 4.4395 8.3317 114.5137 61.8067 62.3684 176.5670 62 T 4.0941 7.5576 110.5260 63.6902 68.5850 174.5754 63 Y 4.5543 8.1211 118.9930 57.6652 37.3945 175.7386 64 L 4.6358 7.7644 116.4723 52.7334 44.9549 176.9869 65 G 3.7168 8.0226 114.3082 46.7120 0.0000 171.8826 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 9 D 8.22 4.59 0.00 2.73 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.98 3.73 0.00 2.11 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 2.42 2.41 0.00 11 D 8.40 4.39 0.00 3.11 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 12 L 7.49 3.08 0.00 1.37 1.72 0.46 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.54 3.88 0.00 1.83 1.68 0.94 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.01 3.87 0.00 2.01 1.91 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.45 7.81 15 A 7.98 3.95 1.17 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 0.00 0.00 16 V 7.85 3.49 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 1.10 0.00 0.00 0.88 0.00 0.00 17 R 8.10 3.93 0.00 2.12 1.98 0.00 3.16 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 18 L 7.95 4.08 0.00 1.89 1.96 1.06 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 19 I 7.94 3.72 2.06 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 1.43 1.02 1.11 0.00 0.00 20 K 8.45 4.01 0.00 2.12 1.92 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.50 7.81 21 F 8.23 4.42 0.00 3.19 3.31 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 22 L 7.82 3.76 0.00 1.69 1.41 0.96 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 23 Y 7.70 4.29 0.00 3.17 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 24 Q 8.16 4.07 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.94 0.00 0.00 0.00 0.00 0.00 2.48 2.64 0.00 25 S 7.37 4.16 0.00 3.41 3.52 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.46 4.25 0.00 2.79 2.87 0.00 0.00 6.94 8.02 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 27 P 0.00 5.08 0.00 2.19 2.30 0.00 3.88 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.10 0.00 28 P 0.00 3.29 0.00 1.90 1.67 0.00 3.73 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.82 0.00 29 P 0.00 4.32 0.00 2.11 1.57 0.00 3.18 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.85 0.00 30 N 8.91 4.73 0.00 2.76 2.77 0.00 0.00 6.76 8.02 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 31 P 0.00 4.73 0.00 2.13 1.97 0.00 3.67 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.92 0.00 32 E 8.49 4.61 0.00 1.91 1.84 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 2.18 2.25 0.00 33 G 8.52 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 0.00 0.00 0.00 34 T 8.21 4.19 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 35 R 8.60 3.92 0.00 1.89 1.96 0.00 3.26 0.00 0.00 3.34 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 36 Q 8.93 3.58 0.00 2.28 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.92 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 37 A 8.00 4.23 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 R 8.19 3.98 0.00 2.09 1.93 0.00 3.08 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.87 0.00 39 R 7.91 4.09 0.00 1.95 1.97 0.00 3.24 0.00 0.00 3.27 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 40 N 7.67 4.34 0.00 3.03 2.99 0.00 0.00 7.05 7.53 0.00 0.00 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 R 7.71 4.11 0.00 2.06 2.01 0.00 3.19 0.00 0.00 3.18 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 42 R 7.88 4.06 0.00 2.12 2.04 0.00 3.16 0.00 0.00 3.36 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 43 R 7.67 3.94 0.00 2.03 2.02 0.00 3.14 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.90 0.00 44 R 7.70 4.01 0.00 1.87 2.19 0.00 3.12 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 45 W 8.97 4.04 0.00 3.52 3.27 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.77 3.87 0.00 2.09 1.97 0.00 3.24 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.95 0.00 47 E 8.10 3.86 0.00 2.24 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 2.31 2.38 0.00 48 R 7.76 3.67 0.00 1.78 1.67 0.00 2.98 0.00 0.00 2.99 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.37 0.00 49 Q 7.55 3.55 0.00 1.06 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.55 0.00 0.00 0.00 0.00 0.00 1.98 1.77 0.00 50 R 8.38 3.90 0.00 1.99 1.91 0.00 3.16 0.00 0.00 3.06 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 51 Q 7.95 3.92 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.70 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 52 I 7.63 3.42 1.38 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.36 -0.15 0.00 0.00 53 H 8.75 4.28 0.00 3.42 3.47 0.00 5.83 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 54 S 7.95 4.15 0.00 4.04 4.11 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 55 I 7.87 3.66 1.79 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 1.48 0.65 0.88 0.00 0.00 56 S 8.18 4.11 0.00 4.04 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.39 3.93 0.00 2.28 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 2.34 2.41 0.00 58 R 8.04 4.01 0.00 2.17 1.97 0.00 3.20 0.00 0.00 3.34 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.54 0.00 59 I 8.05 3.88 1.94 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 1.57 0.76 1.07 0.00 0.00 60 L 8.43 4.34 0.00 1.79 1.76 0.97 0.74 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 61 S 8.33 4.44 0.00 4.07 4.29 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.56 4.09 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 1.22 0.00 0.00 63 Y 8.12 4.55 0.00 3.07 3.01 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 64 L 7.76 4.64 0.00 1.65 1.51 0.96 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.02 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 0.00 0.00 0.00