NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.1220 8.3544 109.7413 45.9327 0.0000 175.1404 2 I 4.3721 8.2486 124.7747 57.0118 40.8113 172.7823 3 C 3.8006 9.8638 127.4825 59.9035 33.1879 172.5185 4 P 4.3173 0.0000 0.0000 65.5854 30.8436 178.8254 5 R 4.1173 8.1043 115.9464 59.3722 30.3907 178.3718 6 F 4.5980 8.3863 119.7028 61.2401 39.5581 176.9283 7 A 3.9104 8.4898 120.9292 55.3085 17.9315 179.2320 8 H 4.3159 8.2569 113.8485 58.4554 28.7336 178.1942 9 V 3.4419 7.6229 120.5898 65.9263 31.4254 177.7395 10 I 3.5421 7.5078 119.0998 64.6294 36.8659 177.7906 11 E 3.9129 8.1531 119.7179 59.3453 29.3954 178.6397 12 N 4.4718 8.0829 116.4141 56.1196 38.4433 177.2325 13 L 3.5611 8.4387 121.3065 57.9335 42.2680 178.5735 14 L 4.2128 8.4205 117.8874 56.0522 41.8941 177.4886 15 L 4.6107 8.3893 116.1679 54.1862 43.7937 176.7606 16 G 4.0013 8.0135 107.9515 44.6553 0.0000 173.5401 17 T 4.4215 7.7587 109.3388 59.9455 71.3969 173.5960 18 P 4.3250 0.0000 0.0000 66.2989 31.4205 179.1326 19 S 4.1512 8.0939 113.2539 61.4618 62.8650 176.3644 20 S 4.1267 8.0487 117.0300 61.9049 62.6632 175.8908 21 Y 4.0874 7.8924 123.3212 60.1688 38.4624 177.9594 22 E 3.8531 8.9300 120.4721 59.2391 29.5269 178.7553 23 T 3.8536 7.9476 116.1491 66.8235 68.2923 176.6460 24 S 4.2390 7.8777 115.8021 61.3869 63.1010 176.5879 25 L 4.0931 7.4634 121.2546 57.8943 41.5735 179.5486 26 K 3.9474 8.2117 118.4399 59.6601 31.7090 178.9822 27 E 4.0061 7.9025 117.9505 58.7294 29.4047 178.3196 28 F 4.2152 8.2962 115.5145 56.0879 40.8233 175.1537 29 E 3.8838 7.9749 117.6464 56.5331 27.0501 173.1898 30 P 4.3568 0.0000 0.0000 62.4112 32.6499 177.2792 31 D 4.6205 8.4615 121.1783 53.3056 41.4766 177.2003 32 D 4.3989 8.5471 119.4093 57.6587 40.6766 179.1522 33 T 3.9994 7.9904 109.9447 64.9184 68.9544 176.4938 34 M 4.0141 7.9517 121.5761 58.0176 32.0060 178.6419 35 K 3.9496 8.0477 119.7033 59.7594 32.3533 178.6713 36 D 4.4879 8.7550 119.2290 57.1773 40.4995 178.6408 37 A 4.1100 8.3800 121.9473 54.6564 18.3344 179.6566 38 G 3.8582 7.9196 104.0376 48.6524 0.0000 175.7708 39 M 4.2979 8.5886 122.2147 57.9483 31.9112 178.6425 40 Q 3.9586 8.3725 119.9701 59.2243 29.1993 178.2214 41 M 3.9463 7.7042 119.2458 58.6280 32.3918 178.2153 42 K 3.6789 7.9694 119.7368 59.0262 31.9760 178.4489 43 K 3.8143 7.9213 118.5670 59.9173 32.2652 179.2721 44 V 3.7533 7.6507 118.3979 64.6251 31.3516 178.3345 45 L 3.9867 7.7642 119.4281 57.4977 41.2825 178.4619 46 D 4.5581 7.9810 117.0938 55.7045 40.8376 177.6803 47 S 4.3769 7.4507 114.2548 58.1978 63.8882 174.0541 48 L 4.3252 7.2774 123.8729 53.0826 42.6801 175.4114 49 P 4.2730 0.0000 0.0000 63.4400 32.5926 177.1639 50 Q 3.9263 8.6079 120.9531 59.9286 29.0707 178.9504 51 T 3.9160 7.8623 115.9736 66.3868 68.4739 176.6956 52 T 3.8373 7.9150 117.6418 66.7295 68.4724 176.2671 53 R 3.8675 7.7870 119.4046 59.4960 30.1139 178.7885 54 E 3.9581 7.8371 118.1472 59.7688 29.4390 179.4013 55 N 4.3701 8.3730 116.5268 56.2612 38.5397 177.6419 56 I 3.7046 8.3015 121.6676 64.4363 37.1672 178.1365 57 M 3.9846 8.3384 119.5631 58.5627 32.0171 178.4866 58 K 4.1330 8.2281 118.7622 59.3311 32.2799 179.1542 59 L 3.9587 8.0791 120.7021 58.2647 42.0905 178.9517 60 T 3.8308 8.1409 116.0141 66.7658 68.3043 175.9078 61 E 3.9190 7.9734 120.2068 59.6555 29.5917 179.5457 62 K 3.9164 8.4133 119.5377 59.4734 31.9874 178.5845 63 I 3.6831 7.3341 118.5216 64.8490 37.3176 178.6751 64 V 3.8130 7.7696 112.4787 63.9219 31.1503 178.5071 65 K 4.1093 7.6983 117.0705 57.3528 32.5759 177.5462 66 S 4.2918 7.3622 114.5188 57.2583 62.9323 173.0647 67 P 4.3428 0.0000 0.0000 65.8071 31.0684 177.6506 68 L 4.1105 8.0580 117.8262 57.1256 41.8208 176.8983 69 C 4.6333 8.6453 113.4237 60.8573 30.0374 173.5616 70 M 4.3330 7.7519 121.5880 55.6468 32.1874 174.6464 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 4.12 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 0.00 0.00 0.00 2 I 8.25 4.37 1.93 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.91 0.94 0.00 0.00 3 C 9.86 3.80 0.00 3.10 3.02 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 4 P 0.00 4.32 0.00 2.24 2.12 0.00 3.73 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.21 0.00 5 R 8.10 4.12 0.00 1.96 2.29 0.00 3.16 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 6 F 8.39 4.60 0.00 2.88 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 7 A 8.49 3.91 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.26 4.32 0.00 3.40 3.73 0.00 5.27 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 V 7.62 3.44 2.26 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 0.97 0.00 0.00 0.96 0.00 0.00 10 I 7.51 3.54 1.77 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.36 0.78 0.00 0.00 11 E 8.15 3.91 0.00 2.22 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 0.00 2.32 2.35 0.00 12 N 8.08 4.47 0.00 2.90 3.06 0.00 0.00 6.66 8.08 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 13 L 8.44 3.56 0.00 1.82 1.88 0.41 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.42 4.21 0.00 1.68 1.66 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.39 4.61 0.00 1.63 1.65 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.01 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 17 T 7.76 4.42 4.26 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 0.00 0.00 0.00 1.22 0.00 0.00 18 P 0.00 4.32 0.00 2.20 2.20 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 2.12 2.31 0.00 19 S 8.09 4.15 0.00 3.89 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 20 S 8.05 4.13 0.00 4.11 4.18 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 21 Y 7.89 4.09 0.00 3.19 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 22 E 8.93 3.85 0.00 2.23 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 0.00 2.30 2.35 0.00 23 T 7.95 3.85 4.54 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 1.23 0.00 0.00 24 S 7.88 4.24 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 25 L 7.46 4.09 0.00 1.56 1.58 0.67 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.21 3.95 0.00 1.91 1.88 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.47 1.76 7.81 27 E 7.90 4.01 0.00 2.09 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 2.32 2.57 0.00 28 F 8.30 4.22 0.00 3.26 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 29 E 7.97 3.88 0.00 2.15 1.98 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 2.26 2.23 0.00 30 P 0.00 4.36 0.00 2.18 2.06 0.00 3.82 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 31 D 8.46 4.62 0.00 2.90 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.55 4.40 0.00 2.75 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 33 T 7.99 4.00 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 34 M 7.95 4.01 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.54 0.00 35 K 8.05 3.95 0.00 1.89 2.11 0.00 1.52 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.54 7.81 36 D 8.76 4.49 0.00 3.02 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 37 A 8.38 4.11 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 38 G 7.92 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 0.00 0.00 0.00 39 M 8.59 4.30 0.00 2.07 2.39 0.00 0.00 0.00 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.94 0.00 40 Q 8.37 3.96 0.00 2.40 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 41 M 7.70 3.95 0.00 2.32 2.05 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.48 0.00 42 K 7.97 3.68 0.00 0.79 1.55 0.00 1.61 0.00 0.00 2.00 0.00 0.00 2.72 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.17 0.93 7.81 43 K 7.92 3.81 0.00 1.91 1.87 0.00 1.92 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.61 7.81 44 V 7.65 3.75 2.06 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 0.99 0.00 0.00 0.92 0.00 0.00 45 L 7.76 3.99 0.00 1.61 1.66 0.83 1.03 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 46 D 7.98 4.56 0.00 2.64 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.45 4.38 0.00 3.96 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 48 L 7.28 4.33 0.00 1.73 1.61 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.27 0.00 2.24 2.19 0.00 3.68 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 50 Q 8.61 3.93 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.94 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 51 T 7.86 3.92 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 1.20 0.00 0.00 52 T 7.92 3.84 4.42 0.00 0.00 0.00 0.00 0.00 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 53 R 7.79 3.87 0.00 2.10 2.11 0.00 3.19 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 54 E 7.84 3.96 0.00 2.08 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 2.32 2.51 0.00 55 N 8.37 4.37 0.00 2.92 2.85 0.00 0.00 7.04 8.27 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 56 I 8.30 3.70 1.99 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 1.39 0.86 0.88 0.00 0.00 57 M 8.34 3.98 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.60 0.00 58 K 8.23 4.13 0.00 1.95 1.83 0.00 1.71 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.43 7.81 59 L 8.08 3.96 0.00 1.75 1.91 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 60 T 8.14 3.83 4.32 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 1.16 0.00 0.00 61 E 7.97 3.92 0.00 2.09 2.02 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 2.33 2.42 0.00 62 K 8.41 3.92 0.00 2.00 1.93 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.48 7.81 63 I 7.33 3.68 2.06 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 1.53 0.76 0.93 0.00 0.00 64 V 7.77 3.81 2.09 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 0.93 0.00 0.00 1.01 0.00 0.00 65 K 7.70 4.11 0.00 1.90 1.87 0.00 1.61 0.00 0.00 1.64 0.00 0.00 3.25 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.49 7.81 66 S 7.36 4.29 0.00 4.15 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.34 0.00 2.22 2.18 0.00 3.83 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 1.99 2.00 0.00 68 L 8.06 4.11 0.00 1.66 1.79 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 69 C 8.65 4.63 0.00 3.04 2.95 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 70 M 7.75 4.33 0.00 1.92 2.11 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00