NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.1825 7.9133 120.6716 63.0063 33.1604 173.9482 3 D 5.3277 8.7040 127.9315 52.8566 43.3643 173.8393 4 Y 5.1071 9.3663 119.5340 56.3096 42.2107 174.1149 5 I 4.7295 8.4536 122.6320 59.6115 40.3759 174.7557 6 V 4.1999 8.7613 129.8258 63.0365 31.8796 176.0223 7 E 4.3496 9.3548 127.0670 56.9008 31.3642 175.9721 8 Y 4.9223 7.8598 115.7355 55.9979 42.0844 174.8295 9 D 4.7561 9.2345 123.5300 55.3885 41.6998 175.3380 10 Y 4.6007 8.9219 123.3611 55.7465 42.3506 173.4946 11 D 4.9550 7.3611 124.9796 51.8424 43.0155 176.1268 12 A 3.9677 8.4094 127.4891 52.5584 18.7388 177.3216 13 V 4.0652 8.5305 121.5974 63.3865 32.7593 175.1259 14 H 5.0038 7.5964 114.7191 54.1845 32.7658 173.8324 15 D 4.3857 8.9309 121.6740 57.4711 40.8132 177.5566 16 D 4.6493 8.0749 116.0261 53.5287 40.0679 175.3981 17 E 5.2351 8.0591 119.6452 55.3737 31.6655 175.2491 18 L 4.6651 9.1583 122.0863 54.0113 43.2813 176.5312 19 T 4.6202 8.4893 120.4518 62.7495 69.4389 174.1630 20 I 4.8716 8.8220 119.6778 59.1509 41.5530 174.6110 21 R 5.1480 8.8508 121.1499 53.9675 34.3968 174.9817 22 V 3.6587 8.5775 121.9214 64.8236 31.8434 176.5350 23 G 4.0186 8.8672 115.3211 45.3526 0.0000 173.6631 24 E 4.2102 8.1062 119.7895 56.3682 30.8767 175.9205 25 I 4.7077 8.1956 123.7966 60.1097 38.7680 175.1116 26 I 4.3771 8.9210 129.2158 60.3581 38.5117 175.3594 27 R 4.7805 9.0781 126.9560 55.3203 31.8740 175.9056 28 N 4.1226 8.6721 119.4818 54.7582 37.6365 174.6312 29 V 4.2049 8.2182 118.1118 62.8806 32.8271 176.1655 30 K 4.7559 9.3586 127.2506 54.3814 35.2689 175.6993 31 K 4.4096 8.6278 122.8296 56.3645 32.8662 176.4035 32 L 4.6735 7.7752 122.2306 52.9656 43.6907 176.9228 33 Q 4.1052 8.7320 119.9608 59.0514 29.2310 177.8850 34 E 4.1074 7.9774 117.2998 56.1384 30.1034 175.6484 35 E 4.1062 8.7951 124.4553 57.1436 30.5442 176.7001 36 G 3.9119 9.0785 113.2353 45.2569 0.0000 172.0620 37 W 5.1628 7.6854 118.3727 54.5305 32.4457 174.7470 38 L 4.8923 8.6165 123.0939 52.6348 45.2345 175.1035 39 E 5.0904 8.6195 118.7291 54.9604 32.8845 175.1947 40 G 4.3259 9.0216 108.0698 45.9916 0.0000 170.7966 41 E 5.3383 9.1771 121.1610 54.2401 31.9889 174.5518 42 L 4.7568 8.9082 128.7009 53.6210 45.5076 175.7668 43 N 3.9736 9.7986 125.6152 54.8082 37.1881 174.4813 44 G 3.9647 8.2732 102.0741 45.7585 0.0000 173.0173 45 R 4.7373 7.7913 118.7777 54.2225 33.2186 174.9749 46 R 5.0689 8.4018 121.7854 55.0975 32.4844 175.6088 47 G 4.1020 8.7021 108.4325 46.3814 0.0000 171.5992 48 M 5.2555 8.6890 120.1516 54.6020 34.3974 174.8884 49 F 5.0570 8.1770 115.5573 55.7615 41.9237 171.6749 50 P 4.5242 0.0000 0.0000 61.6910 32.0753 177.3051 51 D 4.4174 8.5525 121.7113 56.2661 39.4164 178.1812 52 N 3.9569 8.0861 117.4126 55.9563 38.8595 174.6090 53 F 4.9607 8.4761 113.7576 57.3043 40.8109 175.4809 54 V 5.1815 7.9996 111.1637 59.4962 35.9998 174.7751 55 K 4.6740 9.1113 121.7765 54.6678 35.6062 174.9554 56 E 2.8755 8.5255 128.4807 55.9715 30.3485 175.8708 57 I 4.0934 8.0512 128.4018 60.2147 37.9805 176.0232 58 K 4.0839 8.4059 127.4786 56.4311 32.3697 175.4378 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 2 V 7.91 4.18 2.24 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 1.16 0.00 0.00 0.99 0.00 0.00 3 D 8.70 5.33 0.00 2.76 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 9.37 5.11 0.00 2.90 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.45 4.73 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.42 0.97 0.00 0.00 6 V 8.76 4.20 2.18 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 0.97 0.00 0.00 0.89 0.00 0.00 7 E 9.35 4.35 0.00 1.81 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 8 Y 7.86 4.92 0.00 3.02 2.99 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 9 D 9.23 4.76 0.00 2.68 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 10 Y 8.92 4.60 0.00 2.35 2.58 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 11 D 7.36 4.96 0.00 2.25 2.34 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.41 3.97 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.53 4.07 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 0.75 0.00 0.00 0.87 0.00 0.00 14 H 7.60 5.00 0.00 3.31 3.09 0.00 5.69 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 D 8.93 4.39 0.00 2.67 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.07 4.65 0.00 2.81 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 17 E 8.06 5.24 0.00 2.12 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 18 L 9.16 4.67 0.00 1.67 1.62 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.49 4.62 4.22 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 1.21 0.00 0.00 20 I 8.82 4.87 1.78 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.89 0.67 0.00 0.00 21 R 8.85 5.15 0.00 1.84 1.79 0.00 3.34 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.69 0.00 22 V 8.58 3.66 2.07 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 0.68 0.00 0.00 0.92 0.00 0.00 23 G 8.87 4.02 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 0.00 0.00 0.00 24 E 8.11 4.21 0.00 1.99 1.84 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 2.31 2.38 0.00 25 I 8.20 4.71 1.88 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 1.35 0.81 1.00 0.00 0.00 26 I 8.92 4.38 1.88 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.60 1.03 0.00 0.00 27 R 9.08 4.78 0.00 1.79 1.87 0.00 3.29 0.00 0.00 3.12 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 28 N 8.67 4.12 0.00 2.86 2.85 0.00 0.00 7.12 7.32 0.00 0.00 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 V 8.22 4.20 2.12 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 0.43 0.00 0.00 1.04 0.00 0.00 30 K 9.36 4.76 0.00 1.65 1.64 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.39 7.81 31 K 8.63 4.41 0.00 1.65 1.73 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.50 7.81 32 L 7.78 4.67 0.00 1.75 1.52 0.80 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 8.73 4.11 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 34 E 7.98 4.11 0.00 2.06 2.07 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 2.20 2.33 0.00 35 E 8.80 4.11 0.00 1.97 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 36 G 9.08 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 W 7.69 5.16 0.00 3.24 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.62 4.89 0.00 0.38 0.95 0.57 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.62 5.09 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 40 G 9.02 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.18 5.34 0.00 2.20 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.25 0.00 42 L 8.91 4.76 0.00 1.65 1.41 0.94 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 43 N 9.80 3.97 0.00 2.83 2.79 0.00 0.00 7.21 7.98 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 44 G 8.27 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 45 R 7.79 4.74 0.00 1.97 1.82 0.00 3.11 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 46 R 8.40 5.07 0.00 1.70 1.87 0.00 3.26 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 47 G 8.70 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 M 8.69 5.26 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 49 F 8.18 5.06 0.00 3.01 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.52 0.00 2.11 1.31 0.00 2.55 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.00 0.00 51 D 8.55 4.42 0.00 2.88 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 52 N 8.09 3.96 0.00 2.51 2.85 0.00 0.00 6.84 7.02 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 53 F 8.48 4.96 0.00 3.14 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.00 5.18 2.51 0.00 0.00 0.00 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 1.38 0.00 0.00 55 K 9.11 4.67 0.00 1.92 1.59 0.00 1.63 0.00 0.00 1.81 0.00 0.00 2.77 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.27 1.38 7.81 56 E 8.53 2.88 0.00 1.45 1.55 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 1.94 1.71 0.00 57 I 8.05 4.09 1.94 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 1.08 0.63 0.89 0.00 0.00 58 K 8.41 4.08 0.00 1.60 1.57 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.27 1.30 7.81