NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.3989 8.1844 120.5829 54.0530 43.0780 175.9199 8 K 3.7051 8.6242 126.2932 55.1771 32.9244 173.9990 9 S 4.8647 8.9904 121.8461 56.4040 67.1179 173.6927 10 F 5.0546 9.1286 118.7665 54.8872 39.1965 174.2502 11 P 4.3888 0.0000 0.0000 65.2097 31.8212 179.2458 12 E 4.0934 8.0935 115.4673 57.9990 30.0221 177.8055 13 V 3.5170 7.7591 119.9319 64.6734 31.9471 176.0086 14 V 4.0067 7.4431 120.2959 63.9030 31.5380 175.3432 15 G 4.1098 8.9986 116.2456 45.6479 0.0000 174.1495 16 K 4.4397 7.9006 119.2903 55.5959 33.3125 176.5963 17 T 4.6024 8.3388 112.3681 61.0713 71.0263 176.0735 18 V 3.3345 7.9644 120.7811 66.1289 31.2884 177.9081 19 D 4.1529 7.7615 118.1136 57.4175 40.8057 178.6093 20 Q 4.0133 8.0503 118.3568 58.7777 28.6615 178.6993 21 A 4.1044 8.3665 122.2507 55.1637 18.5768 179.5835 22 R 4.1757 8.1846 117.5305 59.7513 30.0500 178.4147 23 E 4.0088 8.1555 118.7425 59.2844 29.6531 178.0531 24 Y 4.1307 8.0976 119.5392 60.8223 38.8540 178.2226 25 F 4.3265 8.4474 118.7203 60.7875 38.8369 177.8622 26 T 3.9359 7.7431 113.9153 66.7007 68.3488 176.4276 27 L 3.9935 7.9131 119.6368 57.6311 41.8125 178.4314 28 H 4.3683 7.7402 113.4562 55.9249 31.0164 175.0450 29 Y 5.1468 8.4955 118.1516 54.6476 38.7410 174.1276 30 P 4.3181 0.0000 0.0000 65.8989 31.8322 178.3908 31 Q 3.9914 8.0479 116.0106 58.1532 28.5969 175.2524 32 Y 4.9008 7.3525 115.9418 56.9241 39.9725 175.5873 33 N 4.6086 9.3692 121.2402 52.2931 39.4986 173.8723 34 V 4.4532 7.8379 123.8604 61.0219 33.5101 174.3128 35 Y 4.5869 9.0277 125.6981 56.1142 40.9879 174.3917 36 F 5.1527 8.8641 122.6519 55.9859 40.7547 175.2574 37 L 4.9849 9.1373 123.1078 52.1487 44.8719 174.3109 38 P 3.7855 0.0000 0.0000 62.1788 31.9318 177.0669 39 E 4.1645 8.8856 122.3695 58.6335 29.8586 178.0984 40 G 3.9238 7.0249 108.8186 45.0031 0.0000 173.9502 41 S 4.6874 7.4895 113.0343 55.7710 66.9508 172.9021 42 P 4.6192 0.0000 0.0000 62.3850 32.2838 175.7708 43 V 4.5585 7.8485 112.5435 59.4849 35.7393 175.3191 44 T 4.0453 8.3385 112.0081 62.1760 69.0550 174.2066 45 L 4.6631 8.1995 122.8723 54.5325 42.4266 176.4477 46 D 4.6403 7.9551 118.7923 52.2143 41.3252 175.0035 47 L 4.3064 8.2312 118.5704 53.2039 42.9755 176.6304 48 R 4.5344 7.8524 123.9703 54.4195 30.8088 177.0166 49 Y 4.3064 9.0093 121.2502 59.5570 38.1927 176.5112 50 N 5.1725 8.3219 116.7237 52.2733 38.2666 173.3588 51 R 5.2594 8.0335 119.8584 54.9324 33.2579 174.7953 52 V 4.4431 9.0712 124.6508 61.2321 34.8327 173.8674 53 R 4.6657 7.7600 124.1459 54.2556 32.1723 175.7541 54 V 4.1802 8.6136 124.5238 61.1411 33.7689 174.0209 55 F 6.0384 9.0858 127.2160 55.7536 40.9792 174.7028 56 Y 5.2608 8.2331 120.0024 53.9411 42.4626 173.5465 57 N 5.1053 9.3774 119.1831 51.8215 39.1478 174.0343 58 P 4.1953 0.0000 0.0000 65.6256 31.7043 178.0261 59 G 3.7735 8.6622 108.3255 47.6214 0.0000 174.3852 60 T 4.3522 8.0389 107.6373 60.6766 70.7311 174.5772 61 N 4.4914 9.3116 119.4008 53.8642 36.4968 173.0500 62 V 4.7514 7.4227 117.9530 61.0595 34.1791 175.0187 63 V 4.3821 9.0782 128.4493 62.8744 32.0002 175.6012 64 N 5.0970 8.9725 122.3493 52.6920 38.8980 173.5800 65 H 4.9292 8.1367 115.3075 53.9223 32.5295 173.0169 66 V 4.0251 8.4597 123.6192 62.1740 31.8676 174.0277 67 P 4.8391 0.0000 0.0000 63.3375 32.8383 174.7036 68 H 5.4249 8.2739 115.1268 54.1354 32.3409 172.4400 69 V 3.9184 8.8898 120.2517 61.9521 32.1675 176.3208 70 G 3.3318 8.4005 115.4502 45.7124 0.0000 172.3563 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 7 L 8.18 4.40 0.00 1.49 1.66 0.95 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.62 3.71 0.00 1.89 1.63 0.00 1.87 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.33 0.95 7.81 9 S 8.99 4.86 0.00 4.03 3.73 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 10 F 9.13 5.05 0.00 3.17 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 11 P 0.00 4.39 0.00 2.23 2.33 0.00 3.75 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.95 0.00 12 E 8.09 4.09 0.00 1.99 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 0.00 1.98 2.14 0.00 13 V 7.76 3.52 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.54 0.00 0.00 14 V 7.44 4.01 2.23 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 0.87 0.00 0.00 1.03 0.00 0.00 15 G 9.00 4.11 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 0.00 0.00 0.00 16 K 7.90 4.44 0.00 1.85 1.79 0.00 1.47 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.26 7.81 17 T 8.34 4.60 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 18 V 7.96 3.33 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.23 0.00 0.00 19 D 7.76 4.15 0.00 2.62 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 20 Q 8.05 4.01 0.00 2.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 21 A 8.37 4.10 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 R 8.18 4.18 0.00 1.60 1.97 0.00 2.91 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 23 E 8.16 4.01 0.00 2.09 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 0.00 2.34 2.33 0.00 24 Y 8.10 4.13 0.00 3.21 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.45 4.33 0.00 3.27 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 26 T 7.74 3.94 4.44 0.00 0.00 0.00 0.00 0.00 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 27 L 7.91 3.99 0.00 1.42 1.31 0.90 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 28 H 7.74 4.37 0.00 2.46 2.60 0.00 5.61 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Y 8.50 5.15 0.00 3.33 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.32 0.00 2.15 2.19 0.00 3.79 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 1.95 1.92 0.00 31 Q 8.05 3.99 0.00 2.01 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.95 0.00 0.00 0.00 0.00 0.00 1.42 1.78 0.00 32 Y 7.35 4.90 0.00 2.89 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 N 9.37 4.61 0.00 3.03 2.90 0.00 0.00 6.57 7.53 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 34 V 7.84 4.45 1.77 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 -0.18 0.00 0.00 0.23 0.00 0.00 35 Y 9.03 4.59 0.00 2.66 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.86 5.15 0.00 2.95 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 37 L 9.14 4.98 0.00 1.10 1.46 0.54 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 38 P 0.00 3.79 0.00 1.94 1.68 0.00 3.59 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 39 E 8.89 4.16 0.00 1.88 2.22 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 2.29 2.27 0.00 40 G 7.02 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 0.00 0.00 0.00 41 S 7.49 4.69 0.00 3.99 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.62 0.00 2.17 2.02 0.00 3.73 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 1.97 1.97 0.00 43 V 7.85 4.56 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 0.90 0.00 0.00 1.06 0.00 0.00 44 T 8.34 4.05 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 1.17 0.00 0.00 45 L 8.20 4.66 0.00 1.61 1.68 0.90 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 46 D 7.96 4.64 0.00 2.78 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 47 L 8.23 4.31 0.00 1.59 1.16 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 48 R 7.85 4.53 0.00 1.81 2.04 0.00 3.09 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 49 Y 9.01 4.31 0.00 3.03 3.18 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 50 N 8.32 5.17 0.00 2.94 3.11 0.00 0.00 5.68 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 R 8.03 5.26 0.00 1.94 2.00 0.00 2.64 0.00 0.00 2.92 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.70 0.00 52 V 9.07 4.44 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 0.40 0.00 0.00 0.23 0.00 0.00 53 R 7.76 4.67 0.00 1.57 1.17 0.00 3.01 0.00 0.00 3.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.33 0.00 54 V 8.61 4.18 1.41 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 1.28 0.00 0.00 0.41 0.00 0.00 55 F 9.09 6.04 0.00 3.08 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 56 Y 8.23 5.26 0.00 3.16 3.16 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 57 N 9.38 5.11 0.00 2.83 2.84 0.00 0.00 7.39 7.26 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 58 P 0.00 4.20 0.00 2.26 2.18 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.90 0.00 59 G 8.66 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 0.00 0.00 0.00 60 T 8.04 4.35 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 1.24 0.00 0.00 61 N 9.31 4.49 0.00 3.00 2.95 0.00 0.00 6.34 6.11 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 62 V 7.42 4.75 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 1.03 0.00 0.00 0.95 0.00 0.00 63 V 9.08 4.38 2.41 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 1.13 0.00 0.00 1.18 0.00 0.00 64 N 8.97 5.10 0.00 2.75 2.98 0.00 0.00 6.30 7.78 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 65 H 8.14 4.93 0.00 3.26 3.23 0.00 5.70 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.46 4.03 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 0.87 0.00 0.00 0.98 0.00 0.00 67 P 0.00 4.84 0.00 2.39 2.36 0.00 3.78 0.00 0.00 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.24 0.00 68 H 8.27 5.42 0.00 3.33 3.43 0.00 5.65 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.89 3.92 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 0.84 0.00 0.00 0.79 0.00 0.00 70 G 8.40 3.33 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