NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 E 4.3502 8.3033 118.7727 55.8243 31.1270 175.6200 7 N 4.6381 8.7426 115.1659 55.3793 38.8936 175.9476 8 S 4.2946 8.5357 113.2208 61.7726 63.5974 176.1914 9 V 3.6815 7.4511 120.1091 66.1657 31.0060 178.0819 10 F 4.2707 7.8749 115.6554 59.9464 38.6589 176.6124 11 F 4.6707 8.1868 114.9386 57.0831 39.1700 176.5362 12 G 3.9606 8.1627 107.7758 44.7417 0.0000 174.0842 13 K 4.0171 7.8502 121.6465 56.2940 32.3305 175.9865 14 K 4.4697 8.4433 126.4915 54.3588 33.4038 176.5790 15 K 4.1255 8.4658 123.6387 56.5011 33.1997 177.0494 16 K 4.2187 8.5080 122.7339 56.2453 32.8325 176.6321 17 V 4.4396 7.8746 114.8721 59.1921 34.1429 175.7240 18 S 4.1648 8.5031 117.7809 58.0292 62.8036 173.1312 19 L 4.5902 8.4644 128.8885 53.4103 43.6141 174.7518 20 H 4.9621 8.8426 125.9058 54.1848 31.7074 172.3085 21 L 4.6975 8.1855 125.4728 54.1082 43.3923 175.1822 22 L 4.4693 8.1988 119.6626 53.9802 42.7583 176.8322 23 V 4.5678 7.8663 114.6599 59.1096 35.7026 175.3005 24 D 4.5192 8.4491 122.1289 53.5588 41.5647 175.8648 25 P 4.2888 0.0000 0.0000 66.2998 30.7465 178.5162 26 D 4.3516 8.0140 118.2848 56.5598 39.4375 178.1366 27 M 4.0311 7.9876 119.7048 58.0069 32.2009 178.1583 28 K 3.9618 7.9734 119.4918 59.6233 32.4573 178.3116 29 D 4.5143 8.1998 119.1344 57.5079 40.7997 178.7086 30 E 4.0656 7.9476 119.1806 59.1517 29.4937 179.2764 31 I 3.8479 7.8744 120.1174 64.2320 37.0627 178.5255 32 I 3.7738 8.2858 121.2909 64.2307 36.9564 178.3451 33 K 4.1020 8.3333 120.6726 59.7011 31.8981 178.2545 34 Y 3.9616 8.0988 119.2997 60.4855 38.6351 177.6800 35 A 4.3207 8.2097 123.2319 54.6334 18.2406 179.6812 36 Q 3.9505 8.1678 116.0000 59.3546 28.9420 178.6473 37 E 4.0533 7.9949 118.1104 58.3318 29.4975 178.5055 38 K 4.2304 7.8899 116.8291 56.2527 33.9453 176.5687 39 D 4.7344 8.0177 119.1061 54.0536 41.7105 175.8505 40 F 3.8670 8.8508 113.6406 59.0080 36.5098 175.6677 41 D 4.3953 8.2982 114.3246 55.2810 39.9034 173.8708 42 N 4.6438 8.0472 117.5385 52.2687 37.9072 175.1174 43 V 3.6303 8.2100 126.7024 65.9342 31.7705 177.3577 44 S 4.1308 8.1597 114.1972 61.8309 62.8150 176.4299 45 Q 3.9999 8.5732 121.8924 58.9609 28.6824 178.0724 46 A 4.5405 8.2246 122.1936 55.1872 18.4033 179.7881 47 G 3.5513 8.5121 104.6898 47.9024 0.0000 176.2068 48 R 3.9142 7.9834 120.2123 59.1837 30.1821 178.9451 49 E 3.9538 8.0595 118.1278 59.4388 29.4711 179.6190 50 I 3.4706 7.8249 119.8941 64.3386 37.0976 178.4491 51 L 3.9597 8.1310 120.1872 57.6921 41.4136 179.5709 52 K 3.9281 8.3078 119.7862 59.4113 31.9936 179.0909 53 K 4.2529 8.0965 118.9778 59.3555 31.8672 179.6119 54 G 3.5809 8.1649 106.0760 47.8022 0.0000 175.8357 55 L 4.1407 8.3064 121.7204 57.5159 41.3747 179.4192 56 E 4.0576 8.0582 117.9012 59.9855 29.3848 178.2603 57 Q 4.0054 8.2694 118.1958 57.0727 28.6820 179.6874 58 I 2.6158 7.8780 115.2630 62.6587 38.2227 175.7151 59 A 4.1617 6.0473 130.7086 53.2488 18.1205 178.1954 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 6 E 8.30 4.35 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 7 N 8.74 4.64 0.00 3.06 3.16 0.00 0.00 6.56 6.68 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 8 S 8.54 4.29 0.00 4.09 4.18 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.45 3.68 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.84 0.00 0.00 10 F 7.87 4.27 0.00 3.11 2.60 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 0.00 11 F 8.19 4.67 0.00 3.04 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 12 G 8.16 3.96 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 0.00 0.00 0.00 13 K 7.85 4.02 0.00 1.79 1.85 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.47 7.81 14 K 8.44 4.47 0.00 1.78 1.72 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.58 7.81 15 K 8.47 4.13 0.00 1.85 1.81 0.00 1.56 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.45 7.81 16 K 8.51 4.22 0.00 1.77 1.78 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.46 7.81 17 V 7.87 4.44 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 0.70 0.00 0.00 0.93 0.00 0.00 18 S 8.50 4.16 0.00 3.82 3.77 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 19 L 8.46 4.59 0.00 1.58 1.52 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 20 H 8.84 4.96 0.00 3.05 3.14 0.00 5.78 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 L 8.19 4.70 0.00 1.71 1.55 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.20 4.47 0.00 1.63 1.61 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.87 4.57 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 0.94 0.00 0.00 24 D 8.45 4.52 0.00 2.66 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 25 P 0.00 4.29 0.00 2.26 2.33 0.00 3.70 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 26 D 8.01 4.35 0.00 2.89 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 27 M 7.99 4.03 0.00 2.24 2.09 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.53 0.00 28 K 7.97 3.96 0.00 1.87 1.93 0.00 1.80 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.54 7.81 29 D 8.20 4.51 0.00 2.91 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.95 4.07 0.00 2.14 2.00 0.00 0.00 0.00 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 2.36 0.00 31 I 7.87 3.85 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.88 0.93 0.00 0.00 32 I 8.29 3.77 2.10 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.87 0.94 0.00 0.00 33 K 8.33 4.10 0.00 1.94 1.99 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.63 1.47 7.81 34 Y 8.10 3.96 0.00 3.16 3.11 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 A 8.21 4.32 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 8.17 3.95 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.42 2.67 0.00 37 E 7.99 4.05 0.00 1.73 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 2.30 2.43 0.00 38 K 7.89 4.23 0.00 1.04 1.45 0.00 1.46 0.00 0.00 1.46 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.75 0.76 7.81 39 D 8.02 4.73 0.00 2.65 2.60 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 0.00 40 F 8.85 3.87 0.00 3.16 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 41 D 8.30 4.40 0.00 2.85 2.80 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 42 N 8.05 4.64 0.00 2.89 2.82 0.00 0.00 6.83 7.23 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 43 V 8.21 3.63 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 1.12 0.00 0.00 0.96 0.00 0.00 44 S 8.16 4.13 0.00 4.09 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 45 Q 8.57 4.00 0.00 2.16 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.54 2.40 0.00 46 A 8.22 4.54 1.64 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 0.00 0.00 47 G 8.51 3.55 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 0.00 0.00 0.00 48 R 7.98 3.91 0.00 2.08 1.99 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 49 E 8.06 3.95 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.73 0.00 50 I 7.82 3.47 1.88 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.49 0.76 0.00 0.00 51 L 8.13 3.96 0.00 1.85 1.70 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.31 3.93 0.00 1.92 1.95 0.00 1.51 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.43 1.52 7.81 53 K 8.10 4.25 0.00 1.95 1.80 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.63 7.81 54 G 8.16 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.31 4.14 0.00 1.82 1.72 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.06 4.06 0.00 2.17 2.01 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 2.34 2.45 0.00 57 Q 8.27 4.01 0.00 2.20 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.65 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 58 I 7.88 2.62 2.03 0.00 0.00 0.85 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 0.70 0.90 0.00 0.00 59 A 6.05 4.16 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