NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.1662 0.0000 0.0000 63.0941 32.6586 174.0838 3 K 3.4891 8.8010 125.0875 55.6880 29.1311 173.4358 4 M 3.9979 9.3231 124.7633 55.6748 33.3116 176.2347 5 K 4.3618 8.4916 123.2253 54.9313 33.1836 176.8396 6 T 3.9851 8.4699 114.7722 62.0775 69.0531 174.5081 7 H 4.2902 8.6796 124.7308 55.6428 29.4041 175.4255 8 K 3.9019 8.4498 128.4138 59.2320 31.8345 178.9755 9 G 3.6907 7.9477 104.1785 47.0538 0.0000 174.5522 10 A 4.4168 8.2427 122.6604 53.9178 19.5231 179.1750 11 K 3.7972 7.8163 117.6852 59.4240 32.1374 178.4919 12 K 4.2844 7.6855 115.7842 57.6350 31.9526 177.5059 13 R 4.5950 7.6912 112.6066 55.3722 31.3423 175.1393 14 V 4.4708 7.6401 119.0039 61.8646 34.8415 173.1339 15 K 4.6660 8.5665 129.3089 54.5539 34.8538 174.6003 16 I 4.7266 8.3057 127.1387 60.1442 37.7487 175.5803 17 T 4.1210 9.2361 119.5747 61.1295 69.4083 175.3322 18 A 4.1762 8.4534 125.2616 55.1770 18.3003 179.2199 19 S 4.2357 7.3661 108.7242 58.7017 63.4674 175.0312 20 G 4.6140 7.2967 116.9536 44.3868 0.0000 172.6408 21 K 4.6124 7.7054 120.6506 55.6544 33.9347 175.7725 22 V 4.7002 9.8468 122.7747 61.2412 34.2552 174.6341 23 V 5.2084 8.8342 125.5133 60.2792 35.0839 173.9176 24 A 4.6291 7.6083 126.2334 50.4916 22.7980 175.3697 25 M 4.1988 8.2513 118.5348 54.9607 32.9569 176.8202 26 K 4.9326 7.8685 118.8444 56.9206 32.7121 177.6312 27 T 4.1234 8.9190 114.7124 61.6701 69.8082 173.2483 28 G 3.8489 8.5670 113.7562 45.8155 0.0000 172.8619 29 K 4.3984 8.0795 122.8286 56.7451 36.8860 175.9676 30 R 4.3720 8.2706 116.2980 58.3083 31.1042 176.1094 31 H 4.6887 8.1055 115.6122 57.6357 31.1223 176.2675 32 L 4.0504 8.1258 117.8495 58.4088 40.1458 177.1222 33 N 4.4556 7.3459 116.3177 54.1591 39.3967 172.4798 34 W 4.6667 7.7732 122.1673 56.8968 33.7275 174.3776 35 Q 4.3534 6.1623 116.1510 55.1725 29.4633 172.3422 36 K 4.3662 7.4217 120.2948 54.1109 34.6782 177.0992 37 S 4.1514 8.3994 115.1875 58.4780 63.1972 175.7825 38 G 3.7520 8.7559 109.4888 47.6530 0.0000 175.8462 39 K 3.9805 7.9351 121.3560 59.8396 32.3167 177.9320 40 E 4.0697 7.9822 118.3818 59.9016 29.2347 179.4027 41 I 3.6668 7.7198 112.2097 64.2891 37.6239 177.6268 42 R 4.0749 7.6772 120.0488 59.2459 29.8023 178.3667 43 Q 4.0501 8.7328 117.6183 58.7541 28.7814 178.3891 44 K 4.3849 8.3375 117.9405 57.8299 32.3541 179.0109 45 G 3.7113 8.0242 106.5639 46.0880 0.0000 174.2186 46 R 4.4610 7.2934 116.5766 54.7492 31.2224 176.6153 47 K 4.5833 8.1845 119.1007 56.7755 34.4191 175.1413 48 F 4.8112 7.5832 114.1924 56.9871 41.4673 173.4865 49 V 4.6982 8.4774 119.3651 61.4157 33.0772 174.6250 50 L 5.2117 7.9912 121.9756 53.3542 46.0133 175.0368 51 A 4.6402 8.6317 122.8235 53.0343 18.8325 178.6089 52 K 4.0984 9.4769 122.3444 59.4754 32.6523 176.0524 53 P 4.3463 0.0000 0.0000 64.7620 31.1216 177.7341 54 E 3.9370 7.8270 117.9913 59.7318 29.2040 178.9393 55 A 4.0361 8.0561 119.5528 55.0214 18.5572 179.1540 56 E 4.0630 8.0533 116.5752 59.9130 29.3593 179.7235 57 R 4.0776 8.2042 117.0785 58.3694 30.0816 179.2092 58 I 3.6897 7.5140 120.0903 64.1684 36.8613 178.1748 59 K 4.1738 7.5679 114.1397 57.2238 31.6119 176.8113 60 L 4.5782 7.8951 118.1618 56.7128 43.9104 179.0844 61 L 4.5643 7.5940 115.5937 55.1934 41.2693 179.5184 62 L 4.0091 8.1222 120.7102 57.7382 41.6145 177.4582 63 P 4.3652 0.0000 0.0000 65.4229 31.6067 175.8763 64 Y 4.1493 7.7150 122.7673 57.7535 38.6081 175.0423 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 P 0.00 4.17 0.00 2.06 2.05 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 3 K 8.80 3.49 0.00 1.98 1.87 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.53 7.81 4 M 9.32 4.00 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 5 K 8.49 4.36 0.00 1.74 1.74 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.42 7.81 6 T 8.47 3.99 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 1.28 0.00 0.00 7 H 8.68 4.29 0.00 3.21 3.23 0.00 5.68 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.45 3.90 0.00 1.72 1.79 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.64 1.41 7.81 9 G 7.95 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 10 A 8.24 4.42 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 11 K 7.82 3.80 0.00 1.52 1.61 0.00 1.50 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.09 0.52 7.81 12 K 7.69 4.28 0.00 1.78 1.82 0.00 1.67 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.61 7.81 13 R 7.69 4.60 0.00 1.86 1.92 0.00 3.06 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 14 V 7.64 4.47 2.21 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 0.71 0.00 0.00 0.89 0.00 0.00 15 K 8.57 4.67 0.00 1.80 1.59 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.40 7.81 16 I 8.31 4.73 1.90 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 1.42 1.20 0.96 0.00 0.00 17 T 9.24 4.12 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 1.22 0.00 0.00 18 A 8.45 4.18 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 19 S 7.37 4.24 0.00 3.97 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 20 G 7.30 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.71 4.61 0.00 1.73 1.82 0.00 1.64 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.39 7.81 22 V 9.85 4.70 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 0.94 0.00 0.00 1.00 0.00 0.00 23 V 8.83 5.21 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 0.75 0.00 0.00 0.92 0.00 0.00 24 A 7.61 4.63 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.25 4.20 0.00 1.88 1.96 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.43 0.00 26 K 7.87 4.93 0.00 1.91 1.88 0.00 1.79 0.00 0.00 1.88 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 2.00 1.91 7.81 27 T 8.92 4.12 4.30 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 0.00 0.00 0.00 1.35 0.00 0.00 28 G 8.57 3.85 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 0.00 0.00 0.00 29 K 8.08 4.40 0.00 1.71 1.78 0.00 1.78 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.42 7.81 30 R 8.27 4.37 0.00 1.86 1.99 0.00 3.41 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 31 H 8.11 4.69 0.00 3.16 3.28 0.00 5.69 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.13 4.05 0.00 1.87 1.90 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 33 N 7.35 4.46 0.00 2.77 2.82 0.00 0.00 7.04 7.83 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 34 W 7.77 4.67 0.00 3.54 3.09 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 6.16 4.35 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.95 0.00 0.00 0.00 0.00 0.00 1.52 1.75 0.00 36 K 7.42 4.37 0.00 1.72 1.69 0.00 1.89 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.46 1.39 7.81 37 S 8.40 4.15 0.00 3.97 3.98 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 0.00 0.00 0.00 0.00 38 G 8.76 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 0.00 0.00 0.00 39 K 7.94 3.98 0.00 1.83 1.80 0.00 1.75 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.53 7.81 40 E 7.98 4.07 0.00 2.18 1.99 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 2.34 2.49 0.00 41 I 7.72 3.67 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.53 0.88 0.00 0.00 42 R 7.68 4.07 0.00 1.99 2.13 0.00 3.10 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 43 Q 8.73 4.05 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.73 0.00 0.00 0.00 0.00 0.00 2.61 2.55 0.00 44 K 8.34 4.38 0.00 1.73 1.90 0.00 1.94 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.69 1.62 7.81 45 G 8.02 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 46 R 7.29 4.46 0.00 2.03 2.08 0.00 3.00 0.00 0.00 3.36 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.71 0.00 47 K 8.18 4.58 0.00 1.57 1.71 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.37 7.81 48 F 7.58 4.81 0.00 3.02 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 49 V 8.48 4.70 2.16 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 1.17 0.00 0.00 0.99 0.00 0.00 50 L 7.99 5.21 0.00 1.80 1.62 1.01 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.63 4.64 1.05 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 0.00 0.00 0.00 0.00 0.00 52 K 9.48 4.10 0.00 1.86 1.87 0.00 1.57 0.00 0.00 1.87 0.00 0.00 3.12 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.56 7.81 53 P 0.00 4.35 0.00 2.27 2.32 0.00 3.62 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 54 E 7.83 3.94 0.00 2.42 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 2.36 2.38 0.00 55 A 8.06 4.04 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 56 E 8.05 4.06 0.00 2.18 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 2.40 2.41 0.00 57 R 8.20 4.08 0.00 1.85 1.97 0.00 3.12 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 58 I 7.51 3.69 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 1.82 1.18 0.93 0.00 0.00 59 K 7.57 4.17 0.00 1.83 1.84 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.70 7.81 60 L 7.90 4.58 0.00 1.78 1.65 0.81 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 61 L 7.59 4.56 0.00 1.77 1.72 0.88 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 62 L 8.12 4.01 0.00 1.65 1.77 0.94 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 4.37 0.00 2.12 2.16 0.00 3.82 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 64 Y 7.71 4.15 0.00 2.84 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00