NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 H 4.8247 8.4293 117.8383 55.5684 30.1275 172.1075 20 K 4.3022 8.4663 123.7718 52.4551 33.9589 174.0589 21 P 4.4715 0.0000 0.0000 61.4438 32.9186 175.2285 22 P 4.4658 0.0000 0.0000 61.6620 31.8906 174.4532 23 P 4.4065 0.0000 0.0000 62.9077 31.8259 175.7613 24 E 4.7376 8.2384 119.3894 53.7278 31.9309 174.5403 25 P 4.2089 0.0000 0.0000 62.5135 32.1409 175.1338 26 D 4.6648 8.1454 119.4087 53.0077 41.7807 176.1499 27 W 4.7306 8.7953 125.3747 56.6387 29.8941 177.2892 28 S 4.1764 8.7034 116.6425 61.0208 62.3121 174.2407 29 N 4.8684 8.1102 119.0556 52.1467 39.5445 173.2275 30 T 4.8499 8.3038 122.0728 61.9934 71.2202 174.2637 31 V 4.5162 7.9059 122.3804 60.9027 34.5808 172.3293 32 P 4.4825 0.0000 0.0000 62.5903 32.0473 176.9824 33 V 3.6440 8.3985 121.7485 65.9995 31.6810 176.8502 34 N 4.6711 7.8623 121.1561 52.0568 37.1910 175.1153 35 K 4.1694 8.4545 123.8856 58.6388 32.5666 177.4629 36 T 4.7103 7.3379 106.4704 59.6298 71.8356 173.0579 37 I 4.0388 8.1611 123.6018 59.8744 37.7148 174.7024 38 P 4.5366 0.0000 0.0000 62.6473 32.0145 175.8322 39 V 4.3292 7.9338 111.6011 59.5138 34.7979 175.3076 40 D 4.6482 8.4676 123.5450 53.3357 40.6978 176.1086 41 T 4.4369 8.2968 118.2349 62.0952 69.2069 174.8374 42 Q 4.1048 8.1555 127.0899 57.1519 29.7477 175.1162 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 4.82 0.00 3.17 3.28 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.47 4.30 0.00 1.94 1.82 0.00 1.59 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.50 7.81 21 P 0.00 4.47 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 1.97 0.00 22 P 0.00 4.47 0.00 2.19 2.09 0.00 3.78 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 1.99 1.98 0.00 23 P 0.00 4.41 0.00 2.03 2.01 0.00 3.62 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 2.01 2.10 0.00 24 E 8.24 4.74 0.00 1.95 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 2.24 2.24 0.00 25 P 0.00 4.21 0.00 1.23 1.61 0.00 3.79 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 26 D 8.15 4.66 0.00 2.61 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 8.80 4.73 0.00 3.27 3.21 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 0.00 28 S 8.70 4.18 0.00 3.84 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 0.00 29 N 8.11 4.87 0.00 2.64 2.72 0.00 0.00 6.81 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 8.30 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 1.41 0.00 0.00 31 V 7.91 4.52 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 0.77 0.00 0.00 1.02 0.00 0.00 32 P 0.00 4.48 0.00 2.10 1.98 0.00 3.74 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 8.40 3.64 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 7.86 4.67 0.00 2.76 3.02 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 8.45 4.17 0.00 1.75 1.88 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.37 7.81 36 T 7.34 4.71 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 4.04 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 4.54 0.00 2.18 2.06 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 7.93 4.33 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 0.74 0.00 0.00 0.93 0.00 0.00 40 D 8.47 4.65 0.00 2.75 2.56 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 41 T 8.30 4.44 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 8.16 4.10 0.00 2.22 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.58 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00