NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.5488 0.0000 0.0000 62.7530 33.6889 174.2534 2 F 5.2270 8.6890 121.3787 56.0327 42.0242 172.2994 3 I 4.2616 8.3357 126.6137 59.2588 40.8730 173.2633 4 N 5.0295 8.4243 125.3845 51.6347 41.1229 173.3365 5 I 4.4936 8.9930 127.1408 59.4607 40.1197 174.5067 6 K 5.1662 8.7899 126.9212 54.5269 34.0955 175.5338 7 L 4.7804 8.9883 124.5174 54.2451 44.7350 174.9841 8 V 4.8008 7.7986 119.3669 59.9404 32.4065 173.8931 9 P 4.5887 0.0000 0.0000 63.7970 32.2188 176.2730 10 E 4.4870 9.2213 118.6377 56.7870 34.3790 176.0740 11 N 4.0162 9.7075 117.0557 53.1652 34.5292 175.3177 12 G 4.0518 7.9613 108.3867 45.8625 0.0000 172.9096 13 G 3.9698 7.9806 109.5713 43.4136 0.0000 170.8492 14 P 4.9151 0.0000 0.0000 61.8567 32.6578 176.6011 15 T 4.3390 8.9311 112.1769 61.0356 71.3265 175.7402 16 N 4.3849 8.6709 120.3734 56.8446 38.3707 178.2747 17 E 3.9977 8.0651 119.5567 61.2127 29.8901 182.4797 18 Q 4.1839 8.0103 119.1208 58.7057 28.6985 179.0088 19 K 3.9544 8.3593 119.8836 59.4241 31.9526 179.2225 20 Q 3.9501 8.3862 120.3403 59.2438 28.9339 178.2573 21 Q 3.9864 8.2844 119.3371 58.7176 28.6888 178.7462 22 L 3.9860 8.0869 120.3775 57.7713 41.5524 179.5367 23 I 3.7599 8.0597 122.3270 65.1123 37.0879 179.0900 24 E 4.1274 8.5801 119.6141 60.7737 29.5263 181.1637 25 G 3.7571 8.3762 106.9582 47.9406 0.0000 176.1239 26 V 3.6466 7.8718 121.4523 65.3384 31.4968 178.3688 27 S 4.0521 7.8505 114.9886 61.8452 62.7061 176.2890 28 D 4.4041 8.1541 121.4397 57.2548 40.3938 178.8802 29 L 3.9330 7.8889 120.9138 58.4559 42.1026 178.9063 30 M 4.0326 8.0410 118.6952 58.2413 31.7990 179.0540 31 V 3.6198 7.9012 120.7634 66.5550 31.5718 178.8914 32 K 3.9691 8.0595 122.3527 59.7333 31.6129 180.5300 33 V 4.0857 7.8816 118.4382 64.3940 31.8174 176.5983 34 L 4.5132 7.8605 114.9789 53.4559 42.7861 175.6110 35 N 4.2747 8.1007 116.1419 54.3721 37.7579 174.2873 36 K 4.2612 7.9209 114.1854 55.2713 32.9468 176.2270 37 N 4.5636 8.4494 119.2444 52.7493 39.6753 175.6766 38 K 3.9375 8.8811 127.0264 59.4429 32.6331 178.3065 39 A 4.0084 8.1563 120.6416 54.8562 18.2780 177.9257 40 S 4.6534 7.5694 106.7004 58.1884 63.2715 173.6745 41 I 4.3066 7.5782 122.7480 61.1819 37.6752 175.3373 42 V 4.4709 8.5220 127.2763 61.0902 33.8015 174.5084 43 V 4.8062 8.3812 126.4986 61.1367 34.6783 174.3978 44 I 4.6184 8.5897 127.6210 59.5864 40.7018 174.1763 45 I 4.8492 8.5014 127.6737 59.7617 38.9527 174.5704 46 D 4.9610 9.5401 127.9796 52.5935 43.2693 175.1800 47 E 4.9079 8.8166 123.0933 55.0333 30.8626 175.4078 48 V 4.4303 8.7982 125.5816 60.7458 34.2114 174.7455 49 D 4.5125 8.6911 127.2080 53.8965 41.8095 176.9831 50 S 4.3740 8.8382 120.7134 61.6020 62.7559 175.0797 51 N 4.6193 9.3393 116.7777 54.2728 38.4569 175.1046 52 N 4.8609 8.5651 114.8674 52.7717 39.8502 173.4394 53 Y 4.4729 8.0464 120.8690 55.5178 40.3979 174.1708 54 G 4.3683 8.4526 116.1143 43.4960 0.0000 171.8871 55 L 4.5469 8.8910 125.5035 54.1471 44.0945 176.7133 56 G 3.8440 9.3840 113.8235 46.3231 0.0000 173.7319 57 G 4.0150 9.0017 106.0583 44.8084 0.0000 173.5955 58 E 4.7937 7.7998 117.4064 54.0158 33.4554 175.5364 59 S 4.8643 8.4702 115.7918 57.9344 64.1997 175.5814 60 V 3.6586 8.7361 121.6519 66.0432 30.8899 178.0335 61 H 4.0210 7.5469 117.5402 59.4319 29.9828 176.6689 62 H 4.3890 8.0046 118.0049 58.8673 28.3965 177.5384 63 L 3.9739 7.9596 118.7036 58.2400 41.6364 179.6026 64 R 4.0715 8.1777 118.6334 58.9151 31.1802 178.8743 65 Q 4.5746 7.6692 124.8833 56.4089 25.5448 178.9625 66 K 4.3301 7.8130 134.9781 54.3053 35.5214 178.4466 67 N 4.7195 8.9618 115.5572 54.4659 37.4107 172.0803 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 P 0.00 4.55 0.00 2.16 2.30 0.00 3.63 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 2 F 8.69 5.23 0.00 3.03 2.96 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 3 I 8.34 4.26 1.70 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.38 0.79 0.00 0.00 4 N 8.42 5.03 0.00 2.37 2.58 0.00 0.00 7.00 7.94 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 5 I 8.99 4.49 1.84 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 1.18 0.78 0.90 0.00 0.00 6 K 8.79 5.17 0.00 1.69 1.83 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.42 7.81 7 L 8.99 4.78 0.00 1.64 1.70 0.90 0.53 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 8 V 7.80 4.80 1.87 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 1.07 0.00 0.00 0.51 0.00 0.00 9 P 0.00 4.59 0.00 1.96 2.06 0.00 3.78 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 10 E 9.22 4.49 0.00 1.85 1.74 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 2.15 2.12 0.00 11 N 9.71 4.02 0.00 2.81 2.75 0.00 0.00 6.76 7.51 0.00 0.00 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 G 7.96 4.05 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 0.00 13 G 7.98 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.92 0.00 2.17 2.03 0.00 3.75 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 1.94 1.93 0.00 15 T 8.93 4.34 4.24 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 1.24 0.00 0.00 16 N 8.67 4.38 0.00 2.83 2.91 0.00 0.00 6.93 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 17 E 8.07 4.00 0.00 1.97 1.95 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 2.31 1.97 0.00 18 Q 8.01 4.18 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 19 K 8.36 3.95 0.00 2.00 1.85 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.44 7.81 20 Q 8.39 3.95 0.00 2.20 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 21 Q 8.28 3.99 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 22 L 8.09 3.99 0.00 1.86 1.69 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 23 I 8.06 3.76 1.99 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.42 0.90 0.00 0.00 24 E 8.58 4.13 0.00 1.96 1.95 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 2.24 2.19 0.00 25 G 8.38 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 26 V 7.87 3.65 2.05 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 0.99 0.00 0.00 0.90 0.00 0.00 27 S 7.85 4.05 0.00 3.99 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 28 D 8.15 4.40 0.00 2.92 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 29 L 7.89 3.93 0.00 1.88 1.79 0.92 0.93 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 30 M 8.04 4.03 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.95 0.00 31 V 7.90 3.62 2.24 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 0.99 0.00 0.00 1.05 0.00 0.00 32 K 8.06 3.97 0.00 1.88 1.71 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.39 1.32 7.81 33 V 7.88 4.09 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 1.00 0.00 0.00 0.98 0.00 0.00 34 L 7.86 4.51 0.00 1.80 1.66 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 35 N 8.10 4.27 0.00 2.84 2.86 0.00 0.00 7.17 6.25 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 36 K 7.92 4.26 0.00 1.79 1.74 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.37 7.81 37 N 8.45 4.56 0.00 2.80 2.70 0.00 0.00 6.51 6.69 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 38 K 8.88 3.94 0.00 1.83 1.79 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.45 7.81 39 A 8.16 4.01 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 40 S 7.57 4.65 0.00 4.05 3.97 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 0.00 0.00 0.00 0.00 41 I 7.58 4.31 1.97 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.84 0.91 0.00 0.00 42 V 8.52 4.47 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.01 0.00 0.00 43 V 8.38 4.81 2.05 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 0.81 0.00 0.00 0.88 0.00 0.00 44 I 8.59 4.62 1.88 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 1.31 0.69 0.96 0.00 0.00 45 I 8.50 4.85 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.54 0.91 0.00 0.00 46 D 9.54 4.96 0.00 2.57 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 47 E 8.82 4.91 0.00 1.86 1.90 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 2.24 2.29 0.00 48 V 8.80 4.43 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 1.06 0.00 0.00 1.04 0.00 0.00 49 D 8.69 4.51 0.00 2.74 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.84 4.37 0.00 4.10 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 51 N 9.34 4.62 0.00 2.83 2.90 0.00 0.00 6.84 6.47 0.00 0.00 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 N 8.57 4.86 0.00 2.79 2.84 0.00 0.00 6.69 7.50 0.00 0.00 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 Y 8.05 4.47 0.00 3.05 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 54 G 8.45 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.89 4.55 0.00 1.77 1.58 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 56 G 9.38 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 9.00 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 58 E 7.80 4.79 0.00 2.06 1.83 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 2.19 2.21 0.00 59 S 8.47 4.86 0.00 4.20 4.06 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 60 V 8.74 3.66 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 0.98 0.00 0.00 0.98 0.00 0.00 61 H 7.55 4.02 0.00 3.05 3.22 0.00 5.81 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 H 8.00 4.39 0.00 3.38 3.34 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.96 3.97 0.00 1.75 1.75 1.05 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 64 R 8.18 4.07 0.00 1.86 1.94 0.00 3.08 0.00 0.00 3.20 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 65 Q 7.67 4.57 0.00 2.17 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.61 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 66 K 7.81 4.33 0.00 1.71 1.25 0.00 1.88 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.26 1.00 7.81 67 N 8.96 4.72 0.00 2.91 2.73 0.00 0.00 6.35 7.56 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