NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0029 8.3549 109.7372 45.1097 0.0000 172.2760 2 S 4.4602 7.7022 117.3648 55.7123 67.2549 172.0115 3 S 4.6854 8.4580 117.8082 55.7983 67.0388 173.3013 4 G 3.6860 8.5117 109.4161 45.7806 0.0000 173.0802 5 S 4.6011 8.1925 119.4150 56.3206 65.5310 173.3491 6 S 4.3776 8.6340 121.9175 57.8340 63.1792 173.8256 7 G 3.7132 8.2082 116.0899 47.0848 0.0000 171.9254 8 P 4.2990 0.0000 0.0000 61.9341 32.4582 175.9388 9 R 4.1573 8.1416 117.4441 57.7432 31.7954 177.8261 10 L 3.9697 7.5674 113.9023 53.8885 39.1071 174.7106 11 W 4.4668 6.9366 113.7203 55.4953 29.4036 175.2544 12 E 4.3582 8.7851 119.3164 58.8969 28.8881 177.4157 13 G 4.0179 9.3027 113.5257 45.3449 0.0000 172.0449 14 Q 4.6472 7.8608 121.1425 53.6982 30.8776 174.3246 15 D 4.6657 8.8899 127.0400 55.0328 41.4729 175.8734 16 V 4.5772 8.8676 116.5754 59.4198 36.9021 174.4554 17 L 5.2527 8.8061 120.4131 53.3992 44.4556 175.9708 18 A 4.9137 9.3234 127.5242 50.5289 20.3140 176.7630 19 R 4.6697 8.2865 123.1348 56.1955 31.2180 175.3017 20 W 4.3922 8.6575 132.5187 54.7873 33.4853 176.3264 21 T 3.7137 7.7466 111.4186 64.8253 67.9528 174.9564 22 D 4.4431 8.3518 120.7048 57.7372 41.5604 175.4047 23 G 3.6492 8.1472 110.3642 45.8033 0.0000 174.0737 24 L 4.3645 8.0300 119.9496 54.7436 43.2140 176.0987 25 L 5.0683 8.4086 120.0089 54.0356 43.2252 175.9579 26 Y 4.6962 9.2019 120.5024 55.6745 41.5626 174.8551 27 L 4.4748 8.6155 124.8609 55.3468 42.7426 176.3238 28 G 4.7299 9.5701 113.2437 44.6695 0.0000 170.9420 29 T 4.9117 8.3373 117.9918 61.1179 71.6011 173.0990 30 I 3.6172 8.2804 127.4216 62.3552 37.1198 176.7603 31 K 4.1359 9.3422 127.9058 58.2488 32.8509 177.4850 32 K 4.8526 7.8735 119.0468 54.6505 36.4571 175.5643 33 V 4.8720 8.3491 122.8109 60.4240 33.9095 174.1280 34 D 4.9872 9.2001 126.8025 52.5750 42.4330 178.0426 35 S 4.0704 8.9287 118.5335 60.9273 63.9384 175.9311 36 A 3.8393 8.1017 122.8608 55.1667 17.8785 178.3194 37 R 4.0741 7.7429 110.3747 55.3526 30.7250 176.3089 38 E 2.0000 7.3645 117.7085 56.9788 27.3257 172.8200 39 V 4.6160 7.4948 111.0220 60.1494 37.5405 176.2083 40 C 5.0582 9.2468 118.7591 58.6226 32.6423 173.8023 41 L 5.0932 8.9998 127.4086 54.8432 42.4916 175.6929 42 V 5.1993 8.2582 126.3528 60.5537 34.3169 174.0008 43 Q 4.7923 8.4210 126.0833 54.4075 31.9757 174.1124 44 F 5.5224 8.3283 122.4515 55.5088 41.9782 176.6281 45 E 4.0050 9.2761 119.8282 59.2167 29.9053 177.3156 46 D 4.7803 8.1249 118.9571 56.2886 41.3596 175.7734 47 D 4.4259 7.6830 112.8282 54.9117 39.5670 174.6617 48 S 4.6353 7.9834 116.6212 57.8591 63.6808 173.2634 49 Q 4.8123 8.5801 124.5703 54.1292 30.4049 174.9274 50 F 4.8379 8.5415 125.4241 56.4998 44.2076 172.9220 51 L 4.5005 6.9783 120.4825 53.6435 42.1737 176.7111 52 V 4.3710 8.3164 125.3690 60.7783 33.5648 175.4785 53 L 4.2924 8.7564 127.7678 54.9415 42.4467 178.6173 54 W 4.5293 8.4830 119.7578 59.7817 29.2650 178.6671 55 K 4.2417 8.2574 116.5096 59.9674 32.6672 177.7225 56 D 4.5891 8.2794 119.2258 57.1224 41.8091 177.3328 57 I 4.1488 7.4710 117.4256 61.2229 37.9182 175.8373 58 S 4.9464 9.2208 121.1711 55.4932 65.3380 171.3116 59 P 4.5746 0.0000 0.0000 62.6982 31.9917 175.4708 60 A 4.4713 8.4325 126.5798 49.9888 19.7037 176.0304 61 A 4.1630 8.3890 125.9905 52.8724 19.2660 177.0043 62 L 4.2248 8.4942 123.4626 57.4996 42.2798 178.4592 63 S 4.1335 7.7308 111.5983 61.3305 63.0825 174.3702 64 G 3.6931 7.7792 107.0880 43.7555 0.0000 172.2895 65 P 4.3401 0.0000 0.0000 61.9917 29.2085 173.5791 66 S 4.0387 8.3290 118.9645 59.6269 62.1149 173.5179 67 S 4.7277 9.1040 123.5898 57.2248 64.8315 174.9552 68 G 3.6661 8.8710 110.9220 45.5242 0.0000 173.7847 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 1 G 8.35 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 0.00 0.00 0.00 2 S 7.70 4.46 0.00 3.90 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.46 4.69 0.00 3.92 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.51 3.69 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 0.00 0.00 0.00 5 S 8.19 4.60 0.00 3.79 3.69 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 6 S 8.63 4.38 0.00 4.00 3.88 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 0.00 0.00 0.00 7 G 8.21 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.30 0.00 1.87 1.90 0.00 3.66 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.87 0.00 9 R 8.14 4.16 0.00 1.14 1.77 0.00 3.86 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 10 L 7.57 3.97 0.00 1.21 1.42 0.68 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 11 W 6.94 4.47 0.00 3.45 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.79 4.36 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.40 0.00 13 G 9.30 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 14 Q 7.86 4.65 0.00 1.35 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 5.87 0.00 0.00 0.00 0.00 0.00 2.01 1.94 0.00 15 D 8.89 4.67 0.00 2.60 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.87 4.58 2.20 0.00 0.00 0.00 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 0.99 0.00 0.00 17 L 8.81 5.25 0.00 1.61 1.63 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 18 A 9.32 4.91 1.54 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 0.00 0.00 19 R 8.29 4.67 0.00 2.06 1.89 0.00 3.31 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.99 0.00 20 W 8.66 4.39 0.00 2.08 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 7.75 3.71 4.19 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 0.00 0.00 0.91 0.00 0.00 22 D 8.35 4.44 0.00 2.85 2.91 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 23 G 8.15 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.03 4.36 0.00 1.79 1.67 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.41 5.07 0.00 1.58 1.68 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 9.20 4.70 0.00 3.03 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.62 4.47 0.00 1.68 1.66 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 28 G 9.57 4.73 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 0.00 0.00 0.00 29 T 8.34 4.91 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 30 I 8.28 3.62 2.10 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.74 1.03 0.00 0.00 31 K 9.34 4.14 0.00 1.67 1.86 0.00 1.65 0.00 0.00 1.77 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.62 1.49 7.81 32 K 7.87 4.85 0.00 1.77 1.58 0.00 1.65 0.00 0.00 1.87 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.44 7.81 33 V 8.35 4.87 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.15 0.00 0.00 34 D 9.20 4.99 0.00 2.59 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 35 S 8.93 4.07 0.00 4.11 4.25 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 36 A 8.10 3.84 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 37 R 7.74 4.07 0.00 1.66 1.81 0.00 3.28 0.00 0.00 3.13 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 38 E 7.36 2.00 0.00 1.53 1.12 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 1.47 1.83 0.00 39 V 7.49 4.62 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 0.54 0.00 0.00 0.88 0.00 0.00 40 C 9.25 5.06 0.00 2.90 2.92 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 41 L 9.00 5.09 0.00 1.73 1.66 0.82 0.92 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 42 V 8.26 5.20 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 1.35 0.00 0.00 1.06 0.00 0.00 43 Q 8.42 4.79 0.00 2.08 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.56 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 44 F 8.33 5.52 0.00 3.13 2.90 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 0.00 0.00 0.00 45 E 9.28 4.01 0.00 2.00 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 0.00 2.38 2.40 0.00 46 D 8.12 4.78 0.00 2.80 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.68 4.43 0.00 2.77 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.98 4.64 0.00 4.27 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 8.58 4.81 0.00 1.91 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.80 0.00 0.00 0.00 0.00 0.00 2.23 2.48 0.00 50 F 8.54 4.84 0.00 3.04 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 51 L 6.98 4.50 0.00 1.06 1.42 0.69 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.32 4.37 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 1.10 0.00 0.00 53 L 8.76 4.29 0.00 1.88 1.66 0.95 0.91 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 54 W 8.48 4.53 0.00 3.31 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 55 K 8.26 4.24 0.00 1.91 2.01 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.51 7.81 56 D 8.28 4.59 0.00 2.77 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.47 4.15 2.05 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.67 0.91 0.00 0.00 58 S 9.22 4.95 0.00 3.87 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.57 0.00 2.07 1.98 0.00 3.78 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 1.97 1.94 0.00 60 A 8.43 4.47 1.27 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 0.00 0.00 0.00 61 A 8.39 4.16 1.24 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 0.00 0.00 62 L 8.49 4.22 0.00 1.65 1.73 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 63 S 7.73 4.13 0.00 3.83 3.86 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 64 G 7.78 3.69 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 0.00 0.00 0.00 65 P 0.00 4.34 0.00 2.19 2.11 0.00 3.79 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 66 S 8.33 4.04 0.00 3.85 3.88 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 0.00 0.00 0.00 67 S 9.10 4.73 0.00 3.88 3.75 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 68 G 8.87 3.67 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 0.00