NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9098 8.3544 109.7363 43.7332 0.0000 172.7678 2 S 4.3260 7.2175 109.2919 56.2373 65.5542 173.5511 3 S 4.7123 8.5049 120.7078 57.1731 67.4993 173.4051 4 G 4.1371 7.9053 103.5058 45.3402 0.0000 173.4788 5 S 4.5328 7.9333 112.1931 56.3512 64.6489 172.8609 6 S 4.4360 8.5648 122.8764 56.3584 62.0207 173.2115 7 G 3.7081 8.5658 118.4359 45.1094 0.0000 170.1064 8 L 3.8399 8.3550 126.9550 55.1847 42.0399 176.4080 9 K 4.7056 8.4038 124.0601 54.9882 35.6902 174.5858 10 C 4.8365 8.3331 113.3746 56.4206 32.2738 173.0447 11 S 4.7023 8.3585 116.0414 57.2098 63.8099 174.0704 12 T 4.5953 8.4378 121.5341 61.5421 70.9756 173.6858 13 V 4.5656 8.2401 124.6462 59.7990 34.3666 175.0870 14 V 4.4619 7.7099 112.4865 59.2866 35.4944 174.9874 15 C 4.2986 8.1630 120.2311 60.0572 31.5085 175.0105 16 V 3.9345 8.5313 118.8734 62.0119 31.1325 175.7989 17 I 4.3812 7.8401 119.1346 62.6949 39.0270 176.3071 18 C 4.5209 7.9802 111.3163 57.0773 31.6369 172.8596 19 L 3.7160 7.8571 118.6242 55.7355 38.2267 173.3883 20 E 4.6583 7.3615 116.9045 53.7995 33.9122 174.8161 21 K 3.8771 8.7123 121.0377 55.6436 31.6434 174.7080 22 P 4.2879 0.0000 0.0000 62.4116 31.6599 176.9507 23 K 3.6667 8.3163 123.3505 58.4981 32.5107 175.8757 24 Y 4.7327 6.9651 114.3486 56.3977 42.8675 174.2258 25 R 5.7433 8.1427 117.5416 53.3031 34.8094 174.9505 26 C 4.3878 8.8002 121.4069 58.4364 32.5077 172.3380 27 P 4.5388 0.0000 0.0000 63.5373 30.2751 175.6157 28 A 4.6164 7.5303 118.5442 53.3144 21.5456 177.4080 29 C 4.3442 8.0057 110.0677 57.5482 31.2764 173.4827 30 R 3.9682 7.8849 118.3098 57.3341 27.1590 176.2130 31 V 4.5099 7.2833 110.8043 59.0315 34.8873 175.2925 32 P 4.7943 0.0000 0.0000 63.0302 32.4899 174.7925 33 Y 4.9425 8.6662 123.0740 55.5203 40.8134 174.9031 34 C 4.2356 9.5239 120.9820 59.4356 30.1376 174.9547 35 S 5.2037 7.7508 114.5011 55.2273 66.3955 175.1716 36 V 3.4894 8.5127 119.1735 66.7587 30.9526 177.2412 37 V 3.4826 8.0490 116.5012 67.1435 31.2612 177.3486 38 C 4.1846 8.2016 115.3941 63.0866 28.1609 176.0777 39 F 4.3091 7.8729 121.3828 61.0817 38.7226 177.0924 40 R 3.5700 8.2139 118.5527 59.0984 29.6670 178.8631 41 K 4.0052 7.5460 116.8933 60.1495 32.3577 178.3718 42 H 4.3105 7.8183 118.0663 58.3970 29.8712 177.1794 43 K 3.5494 7.9433 121.3277 59.3001 31.9182 177.9530 44 E 3.9156 7.2273 117.6356 59.0138 29.4742 178.8164 45 Q 4.4485 7.9088 114.7130 55.3313 29.4672 174.9086 46 C 3.7477 7.6806 119.1369 60.0214 31.0352 172.9927 47 N 4.7169 8.4441 127.2630 50.8562 38.6051 172.3622 48 P 4.5028 0.0000 0.0000 61.7896 32.5618 175.7992 49 E 4.0834 8.5356 118.0307 56.3344 28.4510 177.2014 50 T 3.9781 8.2498 114.3954 61.2052 69.3773 174.3455 51 S 4.0053 8.3700 118.1135 59.8800 62.9193 174.3548 52 G 3.8856 8.6079 112.4501 43.5837 0.0000 170.6994 53 P 4.4280 0.0000 0.0000 62.7767 31.7518 175.1756 54 S 4.5244 8.8143 115.8912 59.0442 64.8488 174.2530 55 S 4.6780 7.8424 113.7221 55.3440 65.8321 173.8505 56 G 3.7639 8.5341 110.2614 46.7225 0.0000 172.8203 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 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 2 S 7.22 4.33 0.00 3.86 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 3 S 8.50 4.71 0.00 3.94 3.76 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 4 G 7.91 4.14 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 0.00 0.00 0.00 5 S 7.93 4.53 0.00 3.81 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 6 S 8.56 4.44 0.00 3.86 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 7 G 8.57 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 L 8.36 3.84 0.00 1.61 1.65 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.40 4.71 0.00 1.84 1.83 0.00 1.59 0.00 0.00 1.92 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.32 7.81 10 C 8.33 4.84 0.00 3.05 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 11 S 8.36 4.70 0.00 3.87 3.83 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 0.00 0.00 0.00 12 T 8.44 4.60 4.23 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 0.00 0.00 0.00 1.19 0.00 0.00 13 V 8.24 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 0.84 0.00 0.00 0.93 0.00 0.00 14 V 7.71 4.46 1.97 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 0.68 0.00 0.00 0.94 0.00 0.00 15 C 8.16 4.30 0.00 3.12 3.03 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 0.00 0.00 0.00 16 V 8.53 3.93 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 0.87 0.00 0.00 0.97 0.00 0.00 17 I 7.84 4.38 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.17 0.95 0.00 0.00 18 C 7.98 4.52 0.00 3.07 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 19 L 7.86 3.72 0.00 1.87 1.84 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 20 E 7.36 4.66 0.00 1.98 1.78 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 0.00 2.29 2.31 0.00 21 K 8.71 3.88 0.00 1.70 1.79 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.45 7.81 22 P 0.00 4.29 0.00 2.04 2.02 0.00 3.70 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.94 0.00 23 K 8.32 3.67 0.00 1.15 0.74 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.18 1.27 7.81 24 Y 6.97 4.73 0.00 1.95 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.14 5.74 0.00 1.63 1.81 0.00 3.26 0.00 0.00 3.79 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.36 0.00 26 C 8.80 4.39 0.00 3.25 3.03 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 0.00 0.00 0.00 27 P 0.00 4.54 0.00 2.23 2.14 0.00 3.72 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.92 0.00 28 A 7.53 4.62 1.33 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 29 C 8.01 4.34 0.00 3.15 3.13 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 0.00 0.00 0.00 0.00 30 R 7.88 3.97 0.00 2.03 2.09 0.00 3.33 0.00 0.00 3.42 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 31 V 7.28 4.51 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 0.75 0.00 0.00 0.88 0.00 0.00 32 P 0.00 4.79 0.00 2.14 2.19 0.00 3.69 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 2.18 1.98 0.00 33 Y 8.67 4.94 0.00 3.15 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 34 C 9.52 4.24 0.00 3.18 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 5.20 0.00 4.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.51 3.49 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 1.23 0.00 0.00 0.90 0.00 0.00 37 V 8.05 3.48 2.14 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 0.99 0.00 0.00 0.97 0.00 0.00 38 C 8.20 4.18 0.00 3.17 3.12 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 0.00 0.00 0.00 39 F 7.87 4.31 0.00 2.13 2.77 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 40 R 8.21 3.57 0.00 1.97 1.84 0.00 3.16 0.00 0.00 3.16 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.84 0.00 41 K 7.55 4.01 0.00 1.75 1.87 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.44 7.81 42 H 7.82 4.31 0.00 3.37 3.31 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 7.94 3.55 0.00 0.79 1.37 0.00 1.49 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.19 1.36 7.81 44 E 7.23 3.92 0.00 2.03 1.96 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 2.26 2.48 0.00 45 Q 7.91 4.45 0.00 1.91 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.94 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 46 C 7.68 3.75 0.00 2.32 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 47 N 8.44 4.72 0.00 2.68 2.73 0.00 0.00 7.27 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 48 P 0.00 4.50 0.00 2.24 2.12 0.00 3.83 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 2.00 2.01 0.00 49 E 8.54 4.08 0.00 2.00 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 2.33 2.32 0.00 50 T 8.25 3.98 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 1.25 0.00 0.00 51 S 8.37 4.01 0.00 3.85 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 52 G 8.61 3.89 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 0.00 0.00 0.00 53 P 0.00 4.43 0.00 2.19 2.09 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 54 S 8.81 4.52 0.00 3.94 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.84 4.68 0.00 3.94 3.82 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.53 3.76 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 0.00 0.00 0.00