NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 C 4.6168 8.3444 120.7869 59.5804 32.7272 173.7559 9 C 4.7956 8.8531 122.5668 55.9223 47.1366 171.8578 10 D 4.2962 10.6100 129.5568 56.2871 42.1437 176.2298 11 F 5.0494 8.4038 120.6991 56.0910 40.8150 174.2892 12 C 5.7081 9.1241 124.2318 53.1755 40.5342 171.2514 13 P 4.9267 0.0000 0.0000 62.2710 33.1643 175.6573 14 C 5.5325 8.4470 117.7346 55.2051 44.0564 174.1637 15 T 4.1353 8.8590 113.7629 61.4589 69.3310 174.2855 16 R 4.5813 8.2131 120.1321 56.1883 30.4946 175.7469 17 S 4.7056 7.7836 111.2160 56.5202 65.9078 173.1305 18 I 4.3590 7.8943 120.5221 58.8217 38.3559 174.3538 19 P 4.5323 0.0000 0.0000 61.2365 32.0285 174.5248 20 P 4.5884 0.0000 0.0000 63.0290 32.6017 175.6974 21 Q 4.6734 8.8093 120.6573 54.7283 30.6598 174.0219 22 C 5.6740 9.1093 122.3225 55.1006 38.5157 173.3249 23 Q 4.8812 8.6864 118.8487 54.7286 32.5147 172.7245 24 C 5.1316 8.8307 120.5476 55.2225 44.6900 173.4504 25 T 4.6590 8.4613 117.8600 61.5084 69.0585 174.4074 26 D 4.6101 8.2172 122.2161 55.1257 41.5132 176.0040 27 V 4.3481 8.4072 123.8752 61.7411 32.4834 174.8982 28 R 4.7791 8.9670 126.2076 54.8447 33.9354 174.7743 29 E 4.5446 8.6578 116.4714 57.2217 30.8015 176.6773 30 K 4.0890 7.7603 118.1809 56.3793 32.8673 177.0546 31 C 4.5699 7.4947 122.3524 57.5617 42.7586 172.3436 32 H 4.9537 8.1394 131.1045 55.9583 32.0789 175.0309 33 S 3.9523 8.9659 123.7705 61.7838 63.0271 175.5880 34 A 4.1096 8.0752 121.5918 55.1391 18.3295 178.6714 35 C 4.6292 7.3027 115.1922 56.4502 44.3232 173.1491 36 K 4.0830 9.8136 126.0452 57.1477 33.2010 176.4630 37 S 4.2607 8.7190 116.3000 56.6081 64.5510 173.1571 38 C 5.9805 8.5978 125.0278 53.5216 42.7808 172.8823 39 L 4.9021 8.9602 127.2527 55.0159 42.2524 176.2447 40 C 5.6751 8.6021 118.5760 55.0542 43.7871 174.0896 41 T 4.1530 8.7034 113.2452 61.4893 69.4192 174.0842 42 R 4.5047 8.2469 119.8370 56.3055 30.7123 176.5085 43 S 4.4071 7.7726 111.4446 56.6300 65.5117 172.8055 44 F 5.0757 7.9553 119.3374 54.8836 40.0564 174.5253 45 P 4.6329 0.0000 0.0000 61.7458 31.8419 174.1992 46 P 4.6131 0.0000 0.0000 62.9982 33.2725 175.1423 47 Q 4.9277 8.9723 120.4337 54.8261 30.6591 174.0383 48 C 5.6027 9.8836 123.1712 55.2037 41.6430 173.5682 49 R 5.2237 9.2268 120.2678 54.6383 34.2036 173.6093 50 C 4.9201 8.9607 123.1995 55.3429 44.3905 172.2820 51 Y 4.8682 8.4170 125.6418 57.0075 38.4093 175.8407 52 D 4.4458 8.0572 119.2287 54.9316 41.6028 175.6394 53 I 4.6309 8.1351 123.3528 59.7451 39.4893 175.0507 54 T 4.4726 8.7091 114.6264 59.9743 71.8314 174.1882 55 D 4.3034 8.0800 120.1437 57.1974 41.3737 176.3772 56 F 4.8511 6.1524 113.6566 56.1172 39.3701 173.7986 57 C 4.6875 8.4718 113.1149 58.2251 42.5607 175.4540 58 Y 4.8728 7.9080 122.4106 56.7871 40.6684 172.9218 59 P 4.7753 0.0000 0.0000 63.4328 33.7015 176.8800 60 S 4.3959 8.3654 113.7115 58.4754 62.7594 173.9599 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 8 C 8.34 4.62 0.00 2.88 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 C 8.85 4.80 0.00 3.10 3.29 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 10 D 10.61 4.30 0.00 2.49 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 0.00 0.00 0.00 11 F 8.40 5.05 0.00 3.01 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 12 C 9.12 5.71 0.00 3.00 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 13 P 0.00 4.93 0.00 2.16 2.16 0.00 4.06 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 2.06 2.02 0.00 14 C 8.45 5.53 0.00 2.81 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 15 T 8.86 4.14 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 1.25 0.00 0.00 16 R 8.21 4.58 0.00 1.80 1.95 0.00 3.17 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 17 S 7.78 4.71 0.00 3.94 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 18 I 7.89 4.36 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 1.41 0.95 0.91 0.00 0.00 19 P 0.00 4.53 0.00 2.02 1.97 0.00 3.66 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 20 P 0.00 4.59 0.00 2.05 2.04 0.00 3.72 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.99 0.00 21 Q 8.81 4.67 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 22 C 9.11 5.67 0.00 2.83 2.89 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 0.00 0.00 0.00 23 Q 8.69 4.88 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.84 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 24 C 8.83 5.13 0.00 3.12 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 25 T 8.46 4.66 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 1.26 0.00 0.00 26 D 8.22 4.61 0.00 2.76 2.69 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 0.00 0.00 0.00 0.00 27 V 8.41 4.35 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 0.85 0.00 0.00 0.99 0.00 0.00 28 R 8.97 4.78 0.00 1.85 1.80 0.00 3.13 0.00 0.00 3.08 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 29 E 8.66 4.54 0.00 1.92 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 2.22 2.26 0.00 30 K 7.76 4.09 0.00 1.70 1.59 0.00 1.73 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.44 7.81 31 C 7.49 4.57 0.00 2.96 2.97 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 0.00 0.00 0.00 32 H 8.14 4.95 0.00 3.24 3.12 0.00 5.75 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.97 3.95 0.00 3.92 3.92 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 0.00 0.00 0.00 34 A 8.08 4.11 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.30 4.63 0.00 2.87 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 K 9.81 4.08 0.00 1.64 1.77 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.50 7.81 37 S 8.72 4.26 0.00 3.11 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 38 C 8.60 5.98 0.00 2.85 2.92 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 0.00 0.00 0.00 39 L 8.96 4.90 0.00 1.86 1.95 0.94 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.60 5.68 0.00 2.86 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 41 T 8.70 4.15 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 1.22 0.00 0.00 42 R 8.25 4.50 0.00 1.76 1.90 0.00 3.16 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 43 S 7.77 4.41 0.00 3.90 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.96 5.08 0.00 3.08 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 45 P 0.00 4.63 0.00 2.22 2.15 0.00 3.83 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 2.03 1.99 0.00 46 P 0.00 4.61 0.00 2.18 2.27 0.00 3.72 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.06 0.00 47 Q 8.97 4.93 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.78 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 48 C 9.88 5.60 0.00 2.77 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 49 R 9.23 5.22 0.00 1.76 1.89 0.00 3.16 0.00 0.00 3.15 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.60 0.00 50 C 8.96 4.92 0.00 2.97 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 51 Y 8.42 4.87 0.00 2.96 2.98 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 0.00 0.00 0.00 52 D 8.06 4.45 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 53 I 8.14 4.63 1.85 0.00 0.00 0.90 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 0.46 0.86 0.00 0.00 54 T 8.71 4.47 3.29 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 0.92 0.00 0.00 55 D 8.08 4.30 0.00 2.47 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 F 6.15 4.85 0.00 2.96 2.98 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 0.00 0.00 0.00 57 C 8.47 4.69 0.00 3.03 3.15 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 58 Y 7.91 4.87 0.00 2.78 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 59 P 0.00 4.78 0.00 2.14 2.22 0.00 3.87 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 60 S 8.37 4.40 0.00 3.86 3.99 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