NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.1796 7.9133 114.0004 61.2794 33.8203 173.4582 3 K 4.9598 8.4496 119.8978 54.3537 35.7466 171.0065 4 V 4.5543 8.3708 116.1331 59.4050 35.0686 174.4122 5 K 5.0760 8.7922 124.8453 55.6112 34.5639 175.3566 6 F 5.0790 9.0550 117.9268 55.8952 42.1839 172.5872 7 K 4.7227 8.4571 119.6833 54.8005 33.7308 174.6417 8 Y 4.3574 8.7069 122.0856 57.8232 43.2003 173.3832 9 K 3.7527 9.6010 131.3587 56.9482 30.6806 175.7184 10 G 4.1646 8.6182 110.2866 45.5999 0.0000 174.3588 11 E 4.1440 8.4310 118.2057 55.9340 29.5258 173.9785 12 E 3.8454 7.8709 125.2534 55.5102 31.1105 173.0490 13 K 4.4238 7.7045 122.5235 55.4279 36.0824 174.2572 14 E 5.3604 8.1746 122.5154 55.0232 33.8684 175.1334 15 V 4.4543 8.8517 121.9550 59.9508 35.3699 173.8573 16 D 4.8337 8.6757 123.4885 54.1887 41.7100 177.1514 17 T 3.7744 8.6372 116.7671 64.1041 68.8462 176.2641 18 S 4.2014 7.9493 117.2454 60.4369 62.8781 174.7154 19 K 4.4425 8.2592 119.9329 55.9744 31.9647 175.5546 20 I 4.6523 7.1347 121.0730 59.6194 36.5630 175.5586 21 K 4.3127 8.1931 127.6179 56.9191 31.4963 176.9903 22 K 4.8703 8.6155 119.0875 55.2669 35.8319 174.9451 23 V 5.0835 8.3840 121.8226 61.2402 34.6275 174.0822 24 W 4.9738 8.6272 122.5549 56.0104 32.0794 172.6734 25 R 4.8668 8.8418 120.9424 54.7268 31.3820 175.5781 26 V 4.3272 8.6741 127.0687 61.6680 33.0738 176.8266 27 G 4.0651 8.4621 120.4986 46.8303 0.0000 173.0568 28 K 4.7308 8.7425 121.9313 56.0222 33.1270 173.7391 29 M 5.0891 8.1234 118.0757 53.7394 36.3089 173.7812 30 V 4.6201 8.5649 124.4488 61.1813 34.0141 174.3267 31 S 4.6802 8.3158 122.5156 56.2439 65.3845 172.4942 32 F 5.2422 7.6486 120.0834 55.9135 41.6981 172.9181 33 T 5.1560 9.4770 110.0379 60.5907 71.9536 172.6926 34 Y 4.7717 8.2470 120.9431 58.2421 41.9118 173.5623 35 D 5.0668 10.6100 118.4821 54.8402 40.9960 172.5962 36 D 4.5644 8.1244 121.9050 54.3021 44.5284 177.2527 37 N 4.4835 8.5354 117.2301 53.7922 37.9015 174.2428 38 G 4.3757 7.5500 107.5325 43.7740 0.0000 171.7840 39 K 4.1220 8.4151 119.8378 56.5269 32.7813 175.8909 40 T 4.2818 8.1697 116.8698 62.9906 68.7048 175.7743 41 G 3.1398 8.0605 114.5734 45.7296 0.0000 172.1796 42 R 4.9021 7.8246 118.7925 54.3246 34.1439 174.6455 43 G 3.3453 7.9249 108.1659 45.5728 0.0000 171.4168 44 A 5.1237 7.5931 119.2096 51.8160 21.9930 175.9432 45 V 4.6277 8.0238 111.8167 59.4673 36.7612 174.9061 46 S 4.4586 8.6632 117.8916 59.0700 62.7854 174.6830 47 E 4.1241 8.6945 123.9799 58.8641 29.8792 178.5768 48 K 4.1140 8.2609 118.9358 60.2272 33.0841 178.7812 49 D 4.5025 7.9809 116.7980 53.7373 40.4451 176.0297 50 A 4.3983 7.5910 122.6894 50.3889 19.7162 176.6879 51 P 4.3552 0.0000 0.0000 62.2544 32.4052 177.3032 52 K 3.8522 8.8596 122.8900 59.8137 32.0120 178.0047 53 E 3.8723 8.1182 118.8176 59.2626 29.6012 178.3504 54 L 3.8670 7.8184 120.2290 58.2433 42.0321 178.9165 55 L 4.0728 7.8707 118.3137 57.9092 41.6560 179.1151 56 D 4.3579 8.1098 118.9383 57.5658 40.7382 178.6985 57 M 4.1270 8.0800 119.3497 57.9322 31.8384 178.6250 58 L 3.9548 8.3279 120.8814 58.2037 42.1405 178.8484 59 A 3.9801 8.0958 119.7002 55.0487 18.3676 179.3857 60 R 3.9603 7.8406 116.6059 59.6608 29.9280 178.6886 61 A 4.1296 8.0912 120.0513 54.5440 18.1670 178.6866 62 E 4.0134 8.2593 115.7334 57.6411 29.8565 177.3735 63 R 4.5329 7.4622 116.7525 55.4459 31.6960 176.2924 64 E 4.0446 7.4954 116.7555 55.9800 29.9326 177.0745 65 K 3.9837 8.5393 122.3292 57.0604 32.7525 177.1556 66 K 4.1963 8.6941 121.9942 57.3906 33.4329 175.4800 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 V 7.91 4.18 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 0.67 0.00 0.00 0.88 0.00 0.00 3 K 8.45 4.96 0.00 1.64 1.63 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.50 7.81 4 V 8.37 4.55 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 0.55 0.00 0.00 0.68 0.00 0.00 5 K 8.79 5.08 0.00 2.07 1.94 0.00 1.57 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.46 7.81 6 F 9.05 5.08 0.00 3.23 3.25 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 0.00 7 K 8.46 4.72 0.00 1.77 1.82 0.00 1.83 0.00 0.00 1.66 0.00 0.00 2.71 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.42 7.81 8 Y 8.71 4.36 0.00 3.13 2.98 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 9 K 9.60 3.75 0.00 1.97 1.46 0.00 1.93 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.43 7.81 10 G 8.62 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 11 E 8.43 4.14 0.00 1.97 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 2.32 2.25 0.00 12 E 7.87 3.85 0.00 2.02 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 0.00 2.16 2.18 0.00 13 K 7.70 4.42 0.00 1.29 0.74 0.00 1.37 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.03 1.00 7.81 14 E 8.17 5.36 0.00 1.75 1.72 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 2.15 2.21 0.00 15 V 8.85 4.45 1.76 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 0.47 0.00 0.00 0.72 0.00 0.00 16 D 8.68 4.83 0.00 2.75 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 17 T 8.64 3.77 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 1.06 0.00 0.00 18 S 7.95 4.20 0.00 3.87 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 19 K 8.26 4.44 0.00 1.94 1.88 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.41 7.81 20 I 7.13 4.65 1.92 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.36 0.85 0.00 0.00 21 K 8.19 4.31 0.00 1.74 1.81 0.00 1.68 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.51 1.45 7.81 22 K 8.62 4.87 0.00 2.06 2.03 0.00 1.33 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.56 1.64 7.81 23 V 8.38 5.08 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 0.91 0.00 0.00 0.95 0.00 0.00 24 W 8.63 4.97 0.00 3.40 3.26 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 0.00 25 R 8.84 4.87 0.00 1.88 1.94 0.00 3.22 0.00 0.00 3.39 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 26 V 8.67 4.33 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 1.02 0.00 0.00 1.13 0.00 0.00 27 G 8.46 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.74 4.73 0.00 1.69 1.78 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.40 7.81 29 M 8.12 5.09 0.00 2.27 1.83 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 2.40 2.34 0.00 30 V 8.56 4.62 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 0.90 0.00 0.00 0.91 0.00 0.00 31 S 8.32 4.68 0.00 3.19 2.63 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 32 F 7.65 5.24 0.00 3.07 2.90 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 0.00 0.00 0.00 33 T 9.48 5.16 4.33 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 1.42 0.00 0.00 34 Y 8.25 4.77 0.00 3.26 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 D 10.61 5.07 0.00 2.59 2.94 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 D 8.12 4.56 0.00 2.78 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.54 4.48 0.00 2.87 3.03 0.00 0.00 5.74 7.00 0.00 0.00 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 7.55 4.38 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 0.00 39 K 8.42 4.12 0.00 1.73 1.78 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.46 7.81 40 T 8.17 4.28 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 1.14 0.00 0.00 41 G 8.06 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 0.00 0.00 0.00 42 R 7.82 4.90 0.00 0.85 1.18 0.00 3.26 0.00 0.00 3.27 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.45 0.00 43 G 7.92 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 A 7.59 5.12 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 45 V 8.02 4.63 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 1.00 0.00 0.00 0.99 0.00 0.00 46 S 8.66 4.46 0.00 3.84 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 47 E 8.69 4.12 0.00 2.03 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 2.32 2.25 0.00 48 K 8.26 4.11 0.00 1.98 2.04 0.00 1.56 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.46 7.81 49 D 7.98 4.50 0.00 2.71 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.59 4.40 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 51 P 0.00 4.36 0.00 2.19 2.17 0.00 3.71 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 1.99 1.88 0.00 52 K 8.86 3.85 0.00 1.87 1.87 0.00 1.60 0.00 0.00 1.74 0.00 0.00 3.14 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.71 7.81 53 E 8.12 3.87 0.00 2.08 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 54 L 7.82 3.87 0.00 1.68 1.74 0.63 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 55 L 7.87 4.07 0.00 1.97 1.70 0.91 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.11 4.36 0.00 2.99 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 57 M 8.08 4.13 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.52 0.00 58 L 8.33 3.95 0.00 1.81 1.86 0.98 0.98 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 59 A 8.10 3.98 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.84 3.96 0.00 2.14 2.09 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 61 A 8.09 4.13 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.26 4.01 0.00 2.10 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 0.00 2.58 2.52 0.00 63 R 7.46 4.53 0.00 1.73 1.94 0.00 3.18 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.83 0.00 64 E 7.50 4.04 0.00 2.09 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 2.53 2.30 0.00 65 K 8.54 3.98 0.00 1.75 1.80 0.00 1.88 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.49 7.81 66 K 8.69 4.20 0.00 2.00 1.89 0.00 1.48 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.28 1.47 7.81