NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9580 8.3549 108.0389 44.4727 0.0000 173.3071 2 Q 4.6999 7.2825 115.7873 52.8704 31.8579 174.5936 3 R 4.4909 9.1126 124.9245 56.6522 32.0174 175.0841 4 A 5.1184 8.7174 122.7750 50.7847 23.5483 175.1908 5 V 4.7529 8.4752 118.7277 59.5321 34.5035 175.0226 6 A 4.5895 8.8880 126.7072 52.2560 18.6633 178.0893 7 L 4.2740 9.1334 123.3065 56.1406 42.4798 176.5950 8 Y 4.6617 7.5935 114.4164 55.6105 41.9568 174.9786 9 D 4.8211 8.7537 121.0640 54.7171 42.1483 175.8212 10 F 5.1329 9.4248 124.1080 56.7253 42.7162 172.9817 11 E 4.2589 8.6468 127.8606 53.7434 30.0423 173.8800 12 P 4.1188 0.0000 0.0000 62.6720 31.9598 176.4262 13 E 4.5766 9.2354 119.4548 56.3014 31.2327 176.1302 14 N 5.0878 7.8009 115.5346 51.0895 42.5052 175.1227 15 D 4.4302 8.7677 120.9374 56.8879 41.1888 177.0434 16 N 4.7233 8.0821 115.2718 52.7169 37.8062 173.9654 17 E 5.1129 7.8510 118.4828 55.3256 31.6844 175.0404 18 L 4.7215 8.5570 124.6698 53.1127 43.4941 176.2515 19 R 4.3113 8.8537 127.1378 56.8389 30.8633 175.4130 20 L 5.0586 9.0381 124.7758 52.9217 45.6439 175.0782 21 A 5.1591 9.0382 124.3538 49.6272 21.6604 175.8904 22 E 3.9192 9.1959 122.8128 58.3360 29.9019 177.6063 23 G 3.9729 9.1272 115.3926 44.9766 0.0000 173.3987 24 D 4.4863 8.0830 120.5202 54.7861 41.9348 175.7812 25 I 4.5165 8.1851 123.3322 60.9048 38.3866 175.5017 26 V 4.4934 8.5354 118.5473 59.7285 36.8656 174.0631 27 F 5.0795 8.9116 120.6364 55.9440 41.4944 174.9279 28 I 4.6076 8.7780 125.7763 60.7006 37.8002 176.7518 29 S 3.9665 8.8233 124.2658 60.9567 63.2503 174.3012 30 Y 4.9407 7.5288 114.7597 56.2594 42.6574 173.9056 31 K 4.4669 8.8137 122.2372 56.7502 33.3978 176.2235 32 H 4.6697 9.0125 126.6572 54.9806 30.1468 174.7004 33 G 3.8726 8.3118 113.5527 44.3188 0.0000 169.4224 34 Q 4.0694 8.5001 119.6684 57.3302 29.4306 177.0986 35 G 3.8476 9.2571 113.2388 45.0111 0.0000 172.3029 36 W 5.3927 7.7456 118.3396 54.7663 33.4844 174.3414 37 L 5.2763 9.0388 121.7197 52.9926 45.7415 175.7462 38 V 4.4305 8.8419 122.1898 62.1072 32.7891 174.7201 39 A 5.3611 9.1427 129.5423 50.0885 22.7028 174.0051 40 E 5.2573 9.0575 121.2383 54.1114 32.4522 175.5584 41 N 4.9799 9.0416 124.2195 52.3791 38.6040 175.7035 42 E 4.2995 8.9010 120.0177 59.2134 29.8827 178.0836 43 S 4.2030 7.5138 109.9760 59.4030 63.3277 175.3970 44 G 3.9531 8.6485 108.5513 45.3849 0.0000 173.6706 45 S 4.7372 7.8035 112.0291 57.6376 63.7491 174.0318 46 K 4.7803 7.8708 120.2665 55.5565 36.4434 175.2133 47 T 5.0695 8.3570 120.0589 62.2715 72.5440 173.2190 48 G 4.1216 8.7661 111.6992 45.4832 0.0000 172.1720 49 L 4.9878 8.6467 120.4713 54.8402 42.7304 177.2946 50 V 4.6457 8.9751 115.3376 58.6524 36.5971 173.4361 51 P 3.3357 0.0000 0.0000 61.7231 31.9258 177.2613 52 E 3.7726 8.3412 124.3731 59.4372 29.5611 178.2909 53 E 4.2148 7.6961 114.8391 57.5199 29.9350 176.9947 54 F 4.8730 8.0992 117.7654 57.6826 39.7599 175.4934 55 V 4.9128 7.1607 112.6911 59.3381 34.7525 174.9857 56 S 4.5815 8.4493 117.2762 56.4614 65.1532 172.9071 57 Y 4.8184 8.5304 125.0003 58.1054 38.4203 174.8091 58 I 4.7804 8.4649 115.9420 58.8823 41.5582 175.4664 59 Q 4.1795 8.5696 120.0128 56.3336 28.6825 176.3444 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 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 0.00 0.00 0.00 2 Q 7.28 4.70 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.92 0.00 0.00 0.00 0.00 0.00 2.23 2.40 0.00 3 R 9.11 4.49 0.00 1.94 1.79 0.00 3.41 0.00 0.00 3.47 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.93 0.00 4 A 8.72 5.12 1.03 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 0.00 0.00 0.00 0.00 0.00 5 V 8.48 4.75 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 0.70 0.00 0.00 0.87 0.00 0.00 6 A 8.89 4.59 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 7 L 9.13 4.27 0.00 1.50 1.29 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 8 Y 7.59 4.66 0.00 1.80 2.28 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.75 4.82 0.00 2.63 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 10 F 9.42 5.13 0.00 3.36 3.06 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 11 E 8.65 4.26 0.00 1.94 1.77 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 2.16 2.28 0.00 12 P 0.00 4.12 0.00 1.97 1.88 0.00 3.50 0.00 0.00 3.54 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 13 E 9.24 4.58 0.00 1.89 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 2.41 0.00 14 N 7.80 5.09 0.00 2.68 2.58 0.00 0.00 7.14 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 15 D 8.77 4.43 0.00 2.65 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 16 N 8.08 4.72 0.00 2.82 3.00 0.00 0.00 6.21 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 7.85 5.11 0.00 2.12 2.27 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 0.00 2.32 2.18 0.00 18 L 8.56 4.72 0.00 1.73 1.71 0.99 0.94 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 19 R 8.85 4.31 0.00 1.86 1.86 0.00 3.24 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 20 L 9.04 5.06 0.00 1.87 1.63 1.06 0.96 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 21 A 9.04 5.16 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 22 E 9.20 3.92 0.00 1.83 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 2.24 2.29 0.00 23 G 9.13 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 24 D 8.08 4.49 0.00 2.67 2.61 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 25 I 8.19 4.52 1.76 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.69 0.50 0.00 0.00 26 V 8.54 4.49 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 0.78 0.00 0.00 0.86 0.00 0.00 27 F 8.91 5.08 0.00 2.97 3.06 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 28 I 8.78 4.61 2.12 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 1.42 1.00 1.09 0.00 0.00 29 S 8.82 3.97 0.00 3.61 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Y 7.53 4.94 0.00 3.00 2.84 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 31 K 8.81 4.47 0.00 1.87 1.79 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.81 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.62 1.61 7.81 32 H 9.01 4.67 0.00 3.19 3.30 0.00 6.16 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 33 G 8.31 3.87 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 0.00 0.00 0.00 34 Q 8.50 4.07 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.64 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 35 G 9.26 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 36 W 7.75 5.39 0.00 3.61 3.06 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 37 L 9.04 5.28 0.00 1.58 1.59 0.90 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 38 V 8.84 4.43 2.27 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 1.04 0.00 0.00 1.06 0.00 0.00 39 A 9.14 5.36 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 40 E 9.06 5.26 0.00 2.12 1.97 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 2.34 2.44 0.00 41 N 9.04 4.98 0.00 2.87 3.02 0.00 0.00 6.43 7.27 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 42 E 8.90 4.30 0.00 2.11 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 0.00 2.45 2.38 0.00 43 S 7.51 4.20 0.00 4.12 4.02 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 44 G 8.65 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 0.00 0.00 0.00 45 S 7.80 4.74 0.00 3.95 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 46 K 7.87 4.78 0.00 1.72 1.72 0.00 1.65 0.00 0.00 1.85 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.49 7.81 47 T 8.36 5.07 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 48 G 8.77 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 49 L 8.65 4.99 0.00 1.58 1.71 0.55 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 50 V 8.98 4.65 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 0.88 0.00 0.00 0.95 0.00 0.00 51 P 0.00 3.34 0.00 0.58 0.51 0.00 2.67 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 52 E 8.34 3.77 0.00 1.88 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 0.00 2.25 2.28 0.00 53 E 7.70 4.21 0.00 1.88 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 2.17 2.18 0.00 54 F 8.10 4.87 0.00 2.97 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 55 V 7.16 4.91 1.86 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 0.59 0.00 0.00 0.58 0.00 0.00 56 S 8.45 4.58 0.00 3.80 3.59 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 57 Y 8.53 4.82 0.00 2.94 2.83 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 0.00 0.00 0.00 58 I 8.46 4.78 1.88 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 1.22 0.66 0.94 0.00 0.00 59 Q 8.57 4.18 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00