NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4822 0.0000 0.0000 62.3498 33.6365 174.9047 2 I 4.8546 8.2907 122.7936 59.1128 39.9699 173.0450 3 A 4.7960 9.4301 129.9781 49.9824 22.2658 174.4395 4 Q 4.8843 8.6559 122.3465 54.3737 31.6122 174.3527 5 I 4.4707 8.8442 127.9269 59.8715 39.8965 174.3067 6 H 5.2705 8.7929 124.2475 54.2813 29.8740 174.2556 7 I 4.6384 8.2365 116.4544 58.5712 41.2879 174.9011 8 L 4.6623 8.3240 123.0584 54.3473 42.2235 176.9831 9 E 4.5070 8.0492 120.7449 56.5941 29.9607 176.0949 10 G 3.6325 8.7676 108.7275 45.6277 0.0000 174.5862 11 R 4.3409 7.6440 119.2859 55.1993 31.6460 176.7691 12 S 4.5171 8.2356 116.0539 57.8069 65.5293 175.2062 13 D 4.3796 8.5031 121.6615 57.3810 40.4941 178.9148 14 E 3.9464 8.0922 118.6032 59.6033 29.5113 179.0537 15 Q 4.0148 7.7533 118.0492 59.2101 28.8294 179.4680 16 K 3.9758 7.9935 118.8807 59.2442 31.9350 179.1154 17 E 3.9814 8.2291 119.8416 59.3608 29.4582 179.0859 18 T 3.8977 8.0075 116.0144 66.2609 68.5654 176.4396 19 L 3.9232 8.1412 122.5788 58.4363 42.2088 179.1313 20 I 3.6919 7.7747 119.5407 64.2987 37.0082 178.5165 21 R 3.9000 7.7595 119.2228 59.3216 30.0213 178.2682 22 E 3.9492 8.4890 118.8242 59.5969 29.5296 179.6477 23 V 3.6295 7.9243 118.1488 66.0697 31.5393 178.2528 24 S 4.1692 7.9870 114.5634 61.4414 62.5327 176.5921 25 E 3.9168 8.3454 121.1663 59.2653 29.2192 178.9579 26 A 3.9624 7.9937 120.8038 55.3555 18.4559 179.8356 27 I 3.6307 7.8012 118.0456 64.5601 37.3423 178.5774 28 S 4.0702 7.9947 113.9963 61.3049 62.0495 176.1150 29 R 3.8447 8.6971 121.7293 59.6931 29.7025 178.4918 30 S 4.1503 7.9949 113.6194 61.1630 63.0035 175.9605 31 L 4.4340 7.6693 117.7628 53.2167 42.3650 175.6605 32 D 4.3345 7.7358 117.3788 55.2969 40.1132 172.8704 33 A 4.7791 7.5074 118.8454 48.9379 21.5243 175.7534 34 P 4.2886 0.0000 0.0000 62.6281 32.0420 176.9220 35 L 3.8875 8.9241 124.8981 58.5260 41.9068 178.7464 36 T 4.0898 7.8713 106.2093 63.2991 68.7595 174.6809 37 S 4.4436 8.0165 116.5118 58.9002 63.8856 174.4262 38 V 4.0999 7.5441 122.4987 62.7756 32.2034 175.3660 39 R 4.6996 8.9283 126.1992 54.3273 33.3272 174.5593 40 V 4.8832 8.5009 123.0904 61.0494 34.5500 174.4600 41 I 4.5515 8.8380 128.0408 59.6003 40.2053 174.2810 42 I 4.7581 8.3968 127.7571 60.0192 39.1265 175.2811 43 T 4.5067 8.7468 123.2408 61.7501 71.6868 173.1510 44 E 4.7715 8.7602 126.3498 56.0554 31.5429 175.4817 45 M 4.9320 8.7885 122.4869 53.2152 35.2403 175.7267 46 A 4.5635 8.5652 125.2946 51.7011 19.3519 178.6910 47 K 3.9075 8.5841 120.2650 59.1790 32.2400 178.4619 48 G 4.0598 7.9925 105.3603 45.6521 0.0000 173.4731 49 H 4.9435 8.4371 114.6697 54.9534 29.7653 173.5509 50 F 5.0498 8.1655 122.5552 56.2954 41.4095 173.6298 51 G 4.1620 8.3603 116.4420 43.5306 0.0000 172.1891 52 I 4.1195 8.0523 122.6481 60.0129 39.7577 176.0872 53 G 3.8903 9.5148 113.7389 46.5423 0.0000 174.0071 54 G 3.9222 8.7078 105.4808 44.9834 0.0000 173.7917 55 E 4.6791 7.6690 117.8269 53.6183 33.0196 175.2583 56 L 4.3082 8.4855 121.3759 55.2139 42.2583 178.5723 57 A 4.0206 8.6811 125.9293 55.0441 18.6871 179.2276 58 S 4.2709 8.3009 110.1767 60.5537 63.1534 174.4433 59 K 4.1661 7.5982 123.2014 56.5240 32.4440 175.7561 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 4.48 0.00 2.09 2.03 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 2 I 8.29 4.85 1.87 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 1.27 0.72 0.90 0.00 0.00 3 A 9.43 4.80 1.19 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 0.00 0.00 0.00 4 Q 8.66 4.88 0.00 2.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.64 0.00 0.00 0.00 0.00 0.00 2.10 2.24 0.00 5 I 8.84 4.47 1.83 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 1.21 0.64 0.88 0.00 0.00 6 H 8.79 5.27 0.00 2.91 3.09 0.00 5.84 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.24 4.64 1.82 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 1.18 1.16 0.86 0.00 0.00 8 L 8.32 4.66 0.00 1.53 1.63 1.01 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.05 4.51 0.00 1.97 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 0.00 2.31 2.11 0.00 10 G 8.77 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.64 4.34 0.00 1.78 1.85 0.00 3.25 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.85 0.00 12 S 8.24 4.52 0.00 4.01 3.99 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 0.00 0.00 0.00 13 D 8.50 4.38 0.00 2.78 2.75 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 14 E 8.09 3.95 0.00 2.05 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 2.40 2.46 0.00 15 Q 7.75 4.01 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 16 K 7.99 3.98 0.00 1.95 1.84 0.00 1.65 0.00 0.00 1.56 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.67 7.81 17 E 8.23 3.98 0.00 2.25 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 2.30 2.34 0.00 18 T 8.01 3.90 4.40 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 1.21 0.00 0.00 19 L 8.14 3.92 0.00 1.81 1.84 0.91 1.28 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 20 I 7.77 3.69 1.99 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 1.39 0.87 0.90 0.00 0.00 21 R 7.76 3.90 0.00 1.96 1.90 0.00 3.10 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 22 E 8.49 3.95 0.00 1.98 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 2.48 2.46 0.00 23 V 7.92 3.63 2.23 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 1.02 0.00 0.00 0.95 0.00 0.00 24 S 7.99 4.17 0.00 4.16 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 25 E 8.35 3.92 0.00 2.10 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 2.51 2.46 0.00 26 A 7.99 3.96 1.38 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 0.00 0.00 27 I 7.80 3.63 1.87 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 1.40 1.06 0.91 0.00 0.00 28 S 7.99 4.07 0.00 3.90 4.09 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 29 R 8.70 3.84 0.00 2.12 1.90 0.00 3.16 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 30 S 7.99 4.15 0.00 3.90 3.92 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 31 L 7.67 4.43 0.00 1.63 1.69 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.74 4.33 0.00 2.75 2.70 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 0.00 0.00 0.00 0.00 33 A 7.51 4.78 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 34 P 0.00 4.29 0.00 2.23 2.21 0.00 3.73 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 2.07 1.96 0.00 35 L 8.92 3.89 0.00 1.73 1.73 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.87 4.09 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 1.21 0.00 0.00 37 S 8.02 4.44 0.00 3.97 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 38 V 7.54 4.10 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 0.75 0.00 0.00 0.93 0.00 0.00 39 R 8.93 4.70 0.00 1.80 1.76 0.00 3.16 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 40 V 8.50 4.88 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 0.80 0.00 0.00 0.92 0.00 0.00 41 I 8.84 4.55 1.84 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 1.21 0.54 0.87 0.00 0.00 42 I 8.40 4.76 1.84 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 1.31 0.51 0.87 0.00 0.00 43 T 8.75 4.51 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 1.20 0.00 0.00 44 E 8.76 4.77 0.00 1.91 1.84 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 2.35 2.31 0.00 45 M 8.79 4.93 0.00 1.95 1.87 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 46 A 8.57 4.56 1.10 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 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.58 3.91 0.00 1.82 1.94 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.58 1.45 7.81 48 G 7.99 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 0.00 0.00 0.00 49 H 8.44 4.94 0.00 3.41 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.17 5.05 0.00 2.98 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 51 G 8.36 4.16 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 0.00 0.00 0.00 52 I 8.05 4.12 1.68 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 0.91 0.23 0.83 0.00 0.00 53 G 9.51 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 54 G 8.71 3.92 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 0.00 0.00 0.00 55 E 7.67 4.68 0.00 1.95 1.75 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 2.18 2.21 0.00 56 L 8.49 4.31 0.00 1.69 1.61 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.68 4.02 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.30 4.27 0.00 4.00 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 0.00 59 K 7.60 4.17 0.00 1.88 1.80 0.00 1.62 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.50 7.81