NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 H 4.8290 8.4293 117.8385 55.5717 30.0662 172.1682 20 K 4.2474 8.5084 124.1901 52.7706 33.8418 174.2349 21 P 4.5007 0.0000 0.0000 61.2438 33.0759 175.0763 22 P 4.4662 0.0000 0.0000 61.6953 31.8593 174.2157 23 P 4.4851 0.0000 0.0000 62.6256 31.8717 175.7079 24 E 4.7740 8.2021 118.8497 53.6806 32.1627 174.6760 25 P 4.1906 0.0000 0.0000 62.5186 32.1194 175.1923 26 D 4.6244 8.1329 119.5112 53.0466 41.6385 176.1008 27 W 4.6395 8.7335 125.5081 56.5594 29.7878 177.1967 28 S 4.1993 8.9239 116.7909 61.0676 62.3233 174.2820 29 N 4.8714 8.1011 118.9021 52.1304 39.5767 173.2483 30 T 4.8378 8.3394 122.0942 61.9640 71.2528 174.1517 31 V 4.5345 7.9022 122.4970 60.8554 34.6355 172.4371 32 P 4.5052 0.0000 0.0000 62.4500 32.0607 177.0714 33 V 3.6116 8.3922 121.8779 66.0673 31.6755 176.8229 34 N 4.6614 7.8756 121.6607 52.1447 37.3165 175.1621 35 K 4.1678 8.4962 124.1163 58.6091 32.5519 177.4672 36 T 4.7209 7.3546 106.4193 59.5405 71.9073 173.0345 37 I 4.0296 8.1559 123.4344 59.9002 37.7002 174.7045 38 P 4.5727 0.0000 0.0000 62.5586 32.1041 175.7757 39 V 4.3463 7.8805 111.2074 59.4625 34.7050 175.2211 40 D 4.6348 8.6118 123.7621 53.5281 40.8703 175.4843 41 T 4.4682 8.3500 118.0089 62.1574 69.3995 174.8391 42 Q 4.1891 8.0428 126.8751 57.0367 29.3706 175.4123 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 19 H 8.43 4.83 0.00 3.17 3.29 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.51 4.25 0.00 1.95 1.82 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.50 7.81 21 P 0.00 4.50 0.00 2.21 2.12 0.00 3.78 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 22 P 0.00 4.47 0.00 2.19 2.10 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 23 P 0.00 4.49 0.00 2.03 2.01 0.00 3.61 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 24 E 8.20 4.77 0.00 1.94 1.87 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 2.23 2.24 0.00 25 P 0.00 4.19 0.00 1.23 1.61 0.00 3.80 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.72 0.00 26 D 8.13 4.62 0.00 2.60 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 27 W 8.73 4.64 0.00 3.31 3.24 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 28 S 8.92 4.20 0.00 3.83 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 29 N 8.10 4.87 0.00 2.64 2.72 0.00 0.00 6.80 7.70 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 30 T 8.34 4.84 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 1.43 0.00 0.00 31 V 7.90 4.53 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 0.78 0.00 0.00 1.01 0.00 0.00 32 P 0.00 4.51 0.00 2.10 1.98 0.00 3.75 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 33 V 8.39 3.61 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.97 0.00 0.00 34 N 7.88 4.66 0.00 2.76 3.03 0.00 0.00 6.92 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 35 K 8.50 4.17 0.00 1.75 1.88 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.37 7.81 36 T 7.35 4.72 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 37 I 8.16 4.03 1.87 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 1.47 0.42 0.91 0.00 0.00 38 P 0.00 4.57 0.00 2.18 2.07 0.00 3.71 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 1.99 1.99 0.00 39 V 7.88 4.35 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 0.73 0.00 0.00 0.93 0.00 0.00 40 D 8.61 4.63 0.00 2.61 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 8.35 4.47 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 42 Q 8.04 4.19 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.58 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00