NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.2977 8.4293 121.4599 55.9158 31.8293 176.2995 20 I 4.3033 6.6679 109.6963 57.9431 38.4136 171.5152 21 D 4.2767 7.3948 118.6726 54.2123 45.2185 177.3541 22 Y 4.2387 9.0872 125.9206 59.7645 38.1351 177.8566 23 K 3.8746 6.8785 119.3869 59.6541 33.2951 177.8585 24 D 4.6336 7.7574 120.6137 53.0267 39.3279 177.0439 25 I 3.6962 7.5849 113.1207 63.7535 38.2072 178.4293 26 A 4.0887 7.9532 123.8624 55.6188 18.2857 179.5139 27 T 3.9349 8.8108 114.3076 66.9025 68.5568 176.8308 28 L 4.2687 7.9740 120.2811 57.7366 41.5436 179.2086 29 K 4.1441 7.6574 117.0110 58.6993 32.0165 178.2103 30 N 4.4160 7.8284 116.3686 54.6004 39.1123 175.6138 31 Y 4.9201 8.1903 118.8608 56.0354 39.2724 175.6678 32 I 5.0335 7.1492 120.2675 60.1473 41.4903 176.3296 33 T 4.3113 8.2107 119.4109 61.6061 69.9264 174.1427 34 E 4.1639 8.8051 117.6621 59.8175 30.0848 178.3278 35 S 4.5841 7.9911 112.4154 58.9038 62.6043 175.9312 36 G 4.0328 7.9860 110.8818 45.4518 0.0000 174.9448 37 K 4.1304 7.6774 119.1633 56.5296 33.2077 176.3478 38 I 5.0663 7.9539 114.9079 60.6464 38.5541 175.7195 39 V 4.0740 8.2068 117.2396 60.2478 32.6116 174.4960 40 P 4.5528 0.0000 0.0000 62.7846 32.0962 177.6913 41 S 4.6788 9.1012 118.2498 60.4859 62.7681 176.9903 42 R 3.8983 7.8696 119.9746 59.5668 29.5008 178.5179 43 I 3.6611 7.8572 119.5993 63.5998 37.0848 177.4059 44 T 4.4450 7.5842 113.4476 62.6148 69.0687 175.4976 45 G 3.9154 7.9140 107.8029 46.5452 0.0000 173.5700 46 T 4.4286 7.4427 113.3104 60.3688 68.6477 175.2532 47 R 4.0472 8.3403 123.7137 55.9201 31.9607 177.9621 48 A 3.9875 8.4753 124.3396 55.0949 18.0166 179.9579 49 K 3.8042 7.9032 117.6848 60.0095 32.1394 178.4675 50 Y 4.2885 7.6822 116.3829 60.9454 37.8315 177.3312 51 Q 3.9050 8.4972 121.0045 59.7667 29.0680 178.5368 52 R 3.9000 8.0919 118.7936 59.3672 29.8780 178.5846 53 Q 3.9775 7.6730 119.4499 59.5239 29.3479 178.3651 54 L 3.9013 8.3978 121.6482 57.5782 42.0125 178.3461 55 A 3.9339 8.8138 121.4787 55.7272 18.3532 179.8302 56 R 3.7946 8.0940 115.8129 59.2037 29.9612 179.1068 57 A 3.9859 8.2667 121.0651 55.2569 18.3094 179.5715 58 I 3.6057 7.4665 118.2448 64.9310 37.0103 178.2428 59 K 3.6736 7.8332 118.9660 59.0864 31.6245 178.9782 60 R 3.3519 7.6610 117.1589 59.4860 29.3578 178.4831 61 A 4.1459 8.1255 121.3432 55.0688 18.2212 179.8206 62 R 4.1002 7.7207 116.8346 58.5034 30.0931 177.8767 63 Y 4.7644 7.4725 114.3213 58.2158 37.9232 175.6098 64 L 4.7074 7.8468 119.9244 53.7673 42.7068 176.5990 65 S 4.3349 8.2346 110.3774 59.3989 60.6414 172.6906 66 L 4.5590 7.4289 116.5572 54.5520 42.3505 176.6836 67 L 4.7183 7.3052 118.0011 52.4103 45.7215 172.9008 68 P 4.6696 0.0000 0.0000 62.3118 32.4068 176.0289 69 Y 4.0552 8.9310 120.6111 60.9507 38.0339 175.5449 70 T 5.4831 7.7029 105.9667 60.1825 71.6511 172.7984 71 D 4.4505 8.6189 119.6259 55.4275 39.1536 176.5441 72 R 4.1945 7.3784 120.9158 57.1127 30.7568 175.6832 73 H 4.5807 7.8469 120.6179 56.0427 29.6568 173.5636 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 19 E 8.43 4.30 0.00 1.86 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 0.00 1.95 2.24 0.00 20 I 6.67 4.30 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.55 0.80 0.00 0.00 21 D 7.39 4.28 0.00 2.61 2.38 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 22 Y 9.09 4.24 0.00 3.08 3.15 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 0.00 0.00 0.00 23 K 6.88 3.87 0.00 1.57 1.37 0.00 1.40 0.00 0.00 1.53 0.00 0.00 2.94 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.32 1.25 7.81 24 D 7.76 4.63 0.00 2.66 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 25 I 7.58 3.70 1.89 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 1.51 0.70 1.05 0.00 0.00 26 A 7.95 4.09 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 27 T 8.81 3.93 4.30 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 1.39 0.00 0.00 28 L 7.97 4.27 0.00 1.73 1.79 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.66 4.14 0.00 1.84 1.86 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.82 7.81 30 N 7.83 4.42 0.00 1.98 2.32 0.00 0.00 6.84 7.46 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 31 Y 8.19 4.92 0.00 3.00 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 32 I 7.15 5.03 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.63 0.99 0.00 0.00 33 T 8.21 4.31 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 1.23 0.00 0.00 34 E 8.81 4.16 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 35 S 7.99 4.58 0.00 3.86 3.91 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 0.00 0.00 0.00 36 G 7.99 4.03 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 0.00 37 K 7.68 4.13 0.00 1.97 1.99 0.00 1.53 0.00 0.00 1.89 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.45 7.81 38 I 7.95 5.07 1.91 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 1.38 0.65 0.92 0.00 0.00 39 V 8.21 4.07 2.14 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 0.74 0.00 0.00 1.09 0.00 0.00 40 P 0.00 4.55 0.00 2.09 2.00 0.00 3.63 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 41 S 9.10 4.68 0.00 4.06 4.22 0.00 0.00 0.00 0.00 0.00 0.00 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 7.87 3.90 0.00 2.07 2.23 0.00 3.00 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 43 I 7.86 3.66 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.55 0.93 0.00 0.00 44 T 7.58 4.44 4.36 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 1.44 0.00 0.00 45 G 7.91 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 46 T 7.44 4.43 4.36 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 1.33 0.00 0.00 47 R 8.34 4.05 0.00 1.62 1.60 0.00 3.02 0.00 0.00 2.65 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 48 A 8.48 3.99 1.29 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 0.00 0.00 0.00 49 K 7.90 3.80 0.00 1.70 1.54 0.00 1.58 0.00 0.00 1.49 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.48 7.81 50 Y 7.68 4.29 0.00 3.15 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.50 3.91 0.00 2.23 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 52 R 8.09 3.90 0.00 1.91 1.91 0.00 3.18 0.00 0.00 3.08 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 53 Q 7.67 3.98 0.00 1.91 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.98 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 54 L 8.40 3.90 0.00 1.57 1.62 -0.04 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.81 3.93 1.37 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 56 R 8.09 3.79 0.00 1.99 1.94 0.00 3.10 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.94 0.00 57 A 8.27 3.99 1.32 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 0.00 0.00 0.00 58 I 7.47 3.61 1.99 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 1.54 0.49 0.87 0.00 0.00 59 K 7.83 3.67 0.00 1.71 1.33 0.00 1.59 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.57 7.81 60 R 7.66 3.35 0.00 1.61 1.81 0.00 3.17 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 61 A 8.13 4.15 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.72 4.10 0.00 1.77 1.35 0.00 2.94 0.00 0.00 2.56 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.62 0.00 63 Y 7.47 4.76 0.00 2.90 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 64 L 7.85 4.71 0.00 1.88 1.65 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.23 4.33 0.00 4.01 3.93 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 66 L 7.43 4.56 0.00 1.88 1.75 1.13 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.31 4.72 0.00 1.64 1.47 0.98 1.03 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 68 P 0.00 4.67 0.00 2.47 2.09 0.00 3.79 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 2.00 2.01 0.00 69 Y 8.93 4.06 0.00 2.98 3.11 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 0.00 0.00 0.00 0.00 70 T 7.70 5.48 4.30 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 1.32 0.00 0.00 71 D 8.62 4.45 0.00 2.81 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 7.38 4.19 0.00 1.81 1.87 0.00 3.17 0.00 0.00 3.17 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 73 H 7.85 4.58 0.00 3.08 3.09 0.00 5.80 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00