NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.3577 8.1127 119.6560 56.1242 32.1603 173.7869 5 E 4.7774 8.4780 121.5727 53.2523 32.3982 173.7388 6 C 4.4163 9.7662 127.2019 59.2476 32.7445 173.6606 7 D 4.4844 8.7014 126.2823 55.8977 39.7549 175.6486 8 Y 4.4968 7.1639 118.1642 58.7262 41.3568 176.2422 9 C 3.9390 8.0190 114.5134 59.0629 30.7762 175.5079 10 G 4.1056 8.3626 107.7364 45.0334 0.0000 173.2868 11 T 4.4410 7.6022 109.5975 60.9938 70.4203 173.0535 12 D 4.9575 8.5172 121.6308 54.2526 41.8470 176.7349 13 I 4.1912 8.4801 124.6826 59.6490 37.6619 175.3399 14 E 3.8090 8.9853 128.4398 55.6382 29.5903 175.0686 15 P 4.2397 0.0000 0.0000 64.5090 31.5259 175.7617 16 G 3.8373 9.5997 107.0185 46.6070 0.0000 173.1519 17 T 4.4694 7.8168 113.3208 62.9595 72.6252 174.4219 18 G 4.0815 8.8414 109.6698 45.6940 0.0000 172.4104 19 T 4.8455 8.5540 113.7688 61.7615 73.0446 173.3948 20 M 5.1076 8.6234 122.5331 53.8732 34.6199 174.4158 21 F 4.6303 9.5216 130.5689 57.4541 41.0119 174.6334 22 V 4.2358 7.7050 126.9424 61.4297 31.6500 175.2684 23 H 4.0136 8.2014 125.6195 55.1635 29.4002 176.7916 24 K 3.7936 8.7800 122.4992 59.8116 31.8424 177.4895 25 D 4.4711 7.9675 114.8500 53.8297 39.7299 176.7420 26 G 3.8804 8.1616 108.1262 44.9425 0.0000 173.4493 27 A 4.2921 9.0371 122.7929 52.7867 19.9536 176.5567 28 T 4.9182 8.1994 114.3396 62.8312 72.5678 174.0238 29 T 4.5941 9.1390 123.8037 62.0469 71.5718 173.0609 30 H 5.0883 9.7010 125.5286 54.9331 30.1279 174.4313 31 F 5.2946 9.3317 123.7380 56.0420 40.6478 177.0178 32 C 4.4203 9.0949 117.0939 59.6999 30.7221 173.6331 33 S 4.6104 7.5708 114.3007 56.3712 66.1190 176.0999 34 S 4.2040 8.3072 118.8340 60.8176 62.8111 176.0436 35 K 3.7013 8.0903 122.9767 59.5632 31.7471 178.0991 36 C 4.2426 7.6894 115.8135 62.9298 27.6505 175.6923 37 E 2.6463 7.5318 119.5158 59.4141 29.0964 179.4446 38 N 4.2425 8.3958 116.2929 56.2980 38.5895 177.3056 39 N 4.4217 8.0322 117.4082 56.0939 38.6883 177.3078 40 A 4.0824 7.6776 122.2626 55.2993 18.1671 179.4716 41 D 4.2607 7.7295 116.6231 57.2165 40.9918 178.3725 42 L 4.2368 7.4776 117.0094 55.2451 41.5717 177.5971 43 G 3.8815 7.7936 107.1082 46.3147 0.0000 173.8584 44 R 4.4940 7.7605 117.3866 54.6500 31.6621 175.8851 45 E 4.5808 8.4122 119.7098 54.5292 31.4922 176.8917 46 A 3.2868 8.3196 127.2902 55.3198 18.4302 179.6273 47 R 3.8460 7.6577 112.8883 58.7063 30.2290 177.1129 48 N 4.5534 8.3920 113.7562 52.9342 39.0633 174.6754 49 L 4.4754 7.2574 120.1001 52.6428 42.6205 176.6987 50 E 3.8568 9.0222 124.7061 59.3953 29.4309 178.9368 51 W 4.4735 7.9663 110.6671 57.3517 28.2131 175.3857 52 T 4.2020 7.2080 117.2474 62.0725 69.1469 175.2196 53 D 4.3290 8.8555 126.2649 58.0482 41.1610 178.7982 54 T 3.7623 8.2411 114.3587 66.8041 68.6790 175.2447 55 A 4.0133 7.8932 121.9479 55.2605 18.5324 177.5213 56 R 4.0707 8.3667 118.1756 56.6310 30.0040 176.6767 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 4 R 8.11 4.36 0.00 1.77 1.88 0.00 3.00 0.00 0.00 3.22 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 5 E 8.48 4.78 0.00 1.96 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 6 C 9.77 4.42 0.00 3.05 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.70 4.48 0.00 2.52 2.63 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 8 Y 7.16 4.50 0.00 2.94 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 9 C 8.02 3.94 0.00 3.12 3.33 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 10 G 8.36 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 0.00 0.00 0.00 11 T 7.60 4.44 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 12 D 8.52 4.96 0.00 2.61 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 13 I 8.48 4.19 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.62 0.96 0.00 0.00 14 E 8.99 3.81 0.00 1.92 1.94 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 2.32 2.42 0.00 15 P 0.00 4.24 0.00 2.22 2.07 0.00 3.91 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 2.01 2.00 0.00 16 G 9.60 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 17 T 7.82 4.47 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 18 G 8.84 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 19 T 8.55 4.85 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 1.30 0.00 0.00 20 M 8.62 5.11 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.31 0.00 21 F 9.52 4.63 0.00 3.31 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 22 V 7.70 4.24 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 0.76 0.00 0.00 0.83 0.00 0.00 23 H 8.20 4.01 0.00 3.29 3.24 0.00 5.69 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.78 3.79 0.00 1.74 1.89 0.00 1.80 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.45 7.81 25 D 7.97 4.47 0.00 2.83 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.16 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 9.04 4.29 1.24 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 0.00 0.00 0.00 28 T 8.20 4.92 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 1.12 0.00 0.00 29 T 9.14 4.59 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 0.53 0.00 0.00 30 H 9.70 5.09 0.00 3.05 3.26 0.00 5.79 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.33 5.29 0.00 3.06 2.94 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 32 C 9.09 4.42 0.00 3.17 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 33 S 7.57 4.61 0.00 4.03 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 34 S 8.31 4.20 0.00 3.99 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 35 K 8.09 3.70 0.00 1.75 1.85 0.00 1.39 0.00 0.00 1.41 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.44 1.38 7.81 36 C 7.69 4.24 0.00 3.49 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 37 E 7.53 2.65 0.00 1.82 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 1.47 1.62 0.00 38 N 8.40 4.24 0.00 2.72 2.78 0.00 0.00 7.12 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 N 8.03 4.42 0.00 3.08 3.11 0.00 0.00 6.84 7.38 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 40 A 7.68 4.08 1.16 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 0.00 0.00 41 D 7.73 4.26 0.00 2.71 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 42 L 7.48 4.24 0.00 1.84 1.74 0.94 0.85 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 43 G 7.79 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 R 7.76 4.49 0.00 2.12 1.96 0.00 3.25 0.00 0.00 3.37 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 45 E 8.41 4.58 0.00 1.98 1.80 0.00 0.00 0.00 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 2.30 0.00 46 A 8.32 3.29 0.48 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 0.00 0.00 0.00 0.00 0.00 0.00 47 R 7.66 3.85 0.00 1.72 1.91 0.00 3.13 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 48 N 8.39 4.55 0.00 2.70 2.81 0.00 0.00 6.84 8.47 0.00 0.00 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 L 7.26 4.48 0.00 1.25 0.87 1.06 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 50 E 9.02 3.86 0.00 2.01 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 0.00 2.32 2.32 0.00 51 W 7.97 4.47 0.00 3.58 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 52 T 7.21 4.20 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 0.98 0.00 0.00 53 D 8.86 4.33 0.00 2.96 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.24 3.76 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 1.07 0.00 0.00 55 A 7.89 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 56 R 8.37 4.07 0.00 1.87 1.85 0.00 3.21 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00