NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 400 M 4.0159 8.2931 120.2922 55.4366 34.4548 175.0973 401 G 2.6822 7.6121 103.8968 43.9336 0.0000 170.7510 402 A 4.4797 6.7803 119.1270 51.8461 23.2261 174.5779 403 T 4.6267 8.4225 109.3477 59.7880 71.3361 173.4947 404 A 4.6334 8.3415 126.4867 50.7223 22.2689 175.9324 405 V 4.2861 8.2094 112.4854 60.1434 33.7311 177.2020 406 S 4.7093 8.3946 125.6104 56.9501 61.5924 173.8437 407 E 4.5180 7.7732 121.4261 54.9849 31.0209 175.3190 408 W 4.8760 8.6505 124.3587 55.2520 32.4744 175.3474 409 T 4.4135 8.3233 119.3770 62.5461 70.5074 173.5613 410 E 4.3324 8.8765 127.7597 55.3636 29.3862 175.2624 411 Y 4.6242 8.4046 125.3695 55.4218 40.4445 174.7502 412 K 4.5656 7.9255 126.8422 54.9703 35.4570 175.1511 413 T 4.4740 7.9478 119.9271 62.2767 72.3055 173.5115 414 A 4.1554 8.3507 127.7399 53.9309 19.2312 176.9699 415 D 4.9201 7.6567 113.7361 52.0089 42.8502 178.2074 416 G 3.5554 8.7287 113.0330 48.2043 0.0000 175.1341 417 K 3.5189 7.2292 120.2757 58.8291 32.4007 176.7990 418 T 4.1216 7.2157 114.3010 63.7748 68.9421 173.4925 419 F 5.1167 8.7382 122.0288 55.9572 41.2809 174.5943 420 Y 4.6821 8.6798 125.4823 55.7806 41.6064 173.6376 421 Y 4.3888 7.4276 126.1658 55.6466 42.0191 173.5518 422 N 4.7723 7.7481 123.8587 51.8953 41.5205 173.7416 423 N 4.7929 8.3515 123.5807 51.5300 39.1508 172.9192 424 R 4.2714 7.9993 120.9619 55.7196 31.2366 176.6602 425 T 4.7244 8.1516 117.3357 61.8976 72.4845 173.5040 426 L 4.6963 8.3437 125.4406 54.0595 43.3252 175.3928 427 E 4.4280 8.3421 121.0593 54.9564 31.7818 175.0065 428 S 4.5457 8.6915 121.0622 57.5353 62.9210 174.7088 429 T 4.4265 8.3504 123.7593 62.4399 70.5452 174.1756 430 W 4.4945 8.5869 123.0471 56.3963 28.3031 175.6988 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 400 M 8.29 4.02 0.00 1.85 2.03 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 401 G 7.61 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 402 A 6.78 4.48 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 0.00 403 T 8.42 4.63 4.26 0.00 0.00 0.00 0.00 0.00 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 0.00 404 A 8.34 4.63 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 405 V 8.21 4.29 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 0.80 0.00 0.00 0.95 0.00 0.00 406 S 8.39 4.71 0.00 3.91 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 0.00 407 E 7.77 4.52 0.00 1.98 1.88 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 2.35 2.40 0.00 408 W 8.65 4.88 0.00 3.14 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 0.00 409 T 8.32 4.41 4.25 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 1.26 0.00 0.00 410 E 8.88 4.33 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 411 Y 8.40 4.62 0.00 2.71 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 0.00 412 K 7.93 4.57 0.00 1.62 1.49 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.23 1.38 7.81 413 T 7.95 4.47 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 414 A 8.35 4.16 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 0.00 415 D 7.66 4.92 0.00 2.67 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 416 G 8.73 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 417 K 7.23 3.52 0.00 1.51 1.82 0.00 1.60 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.44 7.81 418 T 7.22 4.12 4.27 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 1.43 0.00 0.00 419 F 8.74 5.12 0.00 3.00 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 420 Y 8.68 4.68 0.00 2.91 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 0.00 421 Y 7.43 4.39 0.00 2.82 2.53 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 0.00 0.00 0.00 0.00 422 N 7.75 4.77 0.00 2.68 2.58 0.00 0.00 6.99 8.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 423 N 8.35 4.79 0.00 2.62 2.82 0.00 0.00 7.37 7.71 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 0.00 424 R 8.00 4.27 0.00 1.84 1.85 0.00 3.19 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.79 0.00 425 T 8.15 4.72 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 426 L 8.34 4.70 0.00 1.71 1.60 0.93 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 427 E 8.34 4.43 0.00 2.24 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 2.29 0.00 428 S 8.69 4.55 0.00 3.94 3.97 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 0.00 429 T 8.35 4.43 4.27 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 1.19 0.00 0.00 430 W 8.59 4.49 0.00 3.47 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00