NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 K 4.2281 8.1727 120.1315 56.2695 34.4402 176.9414 22 L 3.6452 7.8270 120.0035 57.7621 41.6326 177.0886 23 L 4.0930 8.5116 120.5326 57.6935 42.7280 178.0804 24 I 3.6998 7.8240 118.1170 63.9501 36.9849 177.3798 25 T 4.2964 8.0021 116.5582 65.4670 69.1911 177.0160 26 I 3.7282 7.6799 121.5586 64.7357 37.0739 177.8983 27 H 4.1838 8.6005 117.3979 58.3939 29.7624 175.4614 28 D 4.8189 7.6978 118.8565 56.1487 42.4461 178.1045 29 R 4.0606 9.5412 115.9785 58.5545 28.9581 178.5255 30 K 3.8862 8.0798 121.1849 59.5607 32.0793 178.2740 31 E 4.1362 8.5000 118.8957 58.8919 29.7706 178.5571 32 F 3.8362 8.2839 119.9675 61.4088 39.3372 176.9462 33 A 4.3701 9.0197 120.8980 54.0365 18.3576 179.1267 34 K 4.1159 7.6357 118.2979 59.3855 32.5764 178.7577 35 F 3.9116 9.3359 118.3731 59.3367 38.4169 177.1474 36 E 3.8466 7.9654 117.7912 59.7895 28.9141 178.6463 37 E 3.9625 7.9584 118.9439 59.0278 29.4792 178.5244 38 E 4.2211 8.2914 118.3227 58.1371 29.9336 177.6410 39 R 4.4704 7.2408 111.9663 56.2668 29.9944 177.3250 40 A 3.8426 8.9715 123.4141 54.1608 18.5298 179.0467 41 R 2.0000 12.0000 118.4411 57.1674 30.6719 178.2473 42 A 4.4952 7.8520 117.7903 52.5099 18.1444 177.5460 43 K 4.5201 7.1437 114.8385 56.9965 34.3074 177.6699 44 W 5.1997 6.3094 113.7959 56.3594 28.4107 173.8452 45 D 4.1188 7.4234 124.8273 53.6404 47.2015 176.7531 46 T 3.5073 8.6577 115.8747 61.5818 68.5072 173.5570 47 A 3.3884 7.2419 122.0043 52.0552 21.8210 180.9139 48 N 4.1441 8.0746 107.8536 52.3049 39.0781 174.4671 49 N 5.0654 5.7700 112.0852 50.2980 42.3593 172.8436 50 P 4.3824 0.0000 0.0000 64.4062 31.2944 178.0818 51 L 3.9434 8.2652 121.0987 58.6057 41.7760 178.2984 52 Y 4.0529 8.1629 115.5460 60.2358 37.5178 177.9313 53 K 3.3154 8.7535 120.9939 58.0695 32.2590 178.3447 54 E 3.8291 7.8113 118.0315 58.4194 29.1482 178.1010 55 A 4.1120 9.0876 123.6587 54.6484 18.2607 179.6776 56 T 3.9817 7.3786 108.1857 64.6539 68.3923 177.2550 57 S 4.1778 8.1385 116.9164 61.1355 62.8607 176.2546 58 T 4.2492 7.4460 118.6812 65.8972 67.8925 176.0061 59 F 3.9091 8.2065 123.1143 61.4565 39.0981 177.3151 60 T 4.1290 7.9223 114.2763 65.5266 68.3934 175.9531 61 N 3.8283 9.2530 118.6121 55.1467 38.9307 175.0510 62 I 4.3317 7.0899 116.3709 62.6417 38.3298 176.8038 63 T 4.6160 7.6264 115.2982 63.2062 70.0913 174.9480 64 Y 4.3998 9.4759 119.8649 59.3671 37.9046 178.1319 65 R 3.5544 7.7202 118.7294 56.6912 30.3614 176.3421 66 G 3.6565 8.3273 107.0540 46.8708 0.0000 173.8746 67 T 3.7727 8.0916 121.2197 63.7601 68.7189 172.3070 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 21 K 8.17 4.23 0.00 1.79 1.90 0.00 1.65 0.00 0.00 1.78 0.00 0.00 2.86 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.36 7.81 22 L 7.83 3.65 0.00 1.82 1.67 0.92 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.51 4.09 0.00 1.79 1.61 0.93 0.93 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 24 I 7.82 3.70 1.86 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 1.62 0.60 0.90 0.00 0.00 25 T 8.00 4.30 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 1.17 0.00 0.00 26 I 7.68 3.73 1.90 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 0.70 0.94 0.00 0.00 27 H 8.60 4.18 0.00 3.22 3.35 0.00 5.71 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 D 7.70 4.82 0.00 2.89 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 29 R 9.54 4.06 0.00 2.07 2.43 0.00 2.83 0.00 0.00 3.12 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 30 K 8.08 3.89 0.00 1.99 1.86 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.51 7.81 31 E 8.50 4.14 0.00 2.04 1.98 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 2.36 2.44 0.00 32 F 8.28 3.84 0.00 3.14 3.12 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 0.00 0.00 0.00 0.00 33 A 9.02 4.37 1.43 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 0.00 0.00 0.00 34 K 7.64 4.12 0.00 2.13 2.19 0.00 1.50 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.43 7.81 35 F 9.34 3.91 0.00 2.86 3.02 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 36 E 7.97 3.85 0.00 2.25 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 2.55 2.38 0.00 37 E 7.96 3.96 0.00 1.97 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 2.31 2.38 0.00 38 E 8.29 4.22 0.00 2.10 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 2.16 0.00 39 R 7.24 4.47 0.00 1.96 2.15 0.00 2.90 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.51 0.00 40 A 8.97 3.84 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 12.00 2.00 0.00 1.57 1.23 0.00 3.10 0.00 0.00 3.42 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.27 0.00 42 A 7.85 4.50 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.14 4.52 0.00 2.02 2.00 0.00 1.60 0.00 0.00 1.94 0.00 0.00 3.16 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.95 1.66 7.81 44 W 6.31 5.20 0.00 3.57 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 D 7.42 4.12 0.00 2.01 2.36 0.00 0.00 0.00 0.00 0.00 0.00 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 8.66 3.51 4.03 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 0.00 0.00 0.84 0.00 0.00 47 A 7.24 3.39 0.95 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 0.00 0.00 48 N 8.07 4.14 0.00 3.07 2.99 0.00 0.00 5.86 8.05 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 49 N 5.77 5.07 0.00 2.88 2.75 0.00 0.00 7.69 7.61 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 50 P 0.00 4.38 0.00 2.23 2.17 0.00 3.74 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 51 L 8.27 3.94 0.00 1.73 1.96 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 52 Y 8.16 4.05 0.00 3.18 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 K 8.75 3.32 0.00 1.85 1.88 0.00 1.42 0.00 0.00 1.30 0.00 0.00 3.27 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.40 1.36 7.81 54 E 7.81 3.83 0.00 2.15 1.92 0.00 0.00 0.00 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 2.51 0.00 55 A 9.09 4.11 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.38 3.98 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 1.11 0.00 0.00 57 S 8.14 4.18 0.00 4.02 4.12 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 0.00 0.00 0.00 0.00 58 T 7.45 4.25 4.31 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 1.14 0.00 0.00 59 F 8.21 3.91 0.00 3.17 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 60 T 7.92 4.13 4.34 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 1.29 0.00 0.00 61 N 9.25 3.83 0.00 2.53 2.62 0.00 0.00 6.86 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 62 I 7.09 4.33 1.77 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.72 0.86 0.00 0.00 63 T 7.63 4.62 4.31 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 1.27 0.00 0.00 64 Y 9.48 4.40 0.00 3.19 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 7.72 3.55 0.00 1.70 1.84 0.00 3.34 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.54 0.00 66 G 8.33 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.09 3.77 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