NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 N 4.6621 8.2833 119.1985 53.1703 40.3577 174.5023 7 I 3.4408 8.5499 127.1699 63.8816 37.0641 176.6590 8 Q 3.7803 8.7072 121.1099 59.3132 29.4108 177.4773 9 D 4.2112 7.9003 119.4431 57.1050 40.9040 178.5778 10 K 3.8338 8.1153 120.0262 59.1951 32.1498 178.8129 11 A 3.4077 7.8051 121.1479 54.9995 18.2583 179.6768 12 L 3.3825 7.4039 117.6185 57.4324 41.4211 179.3270 13 E 4.2294 7.6799 120.6783 58.8570 29.5289 178.7474 14 N 4.3051 7.9862 116.4497 56.2350 38.6303 177.3615 15 F 4.5516 7.9057 120.9693 59.8892 38.8568 177.7097 16 K 4.3486 8.5906 120.2178 59.0979 31.8880 178.7615 17 A 4.0451 8.0143 119.7324 54.9491 18.4521 178.5332 18 N 4.5960 8.3162 111.8316 52.5340 39.2480 175.0992 19 Q 3.5299 7.8149 118.4692 56.7792 27.2474 174.1257 20 T 4.0001 7.7076 113.7220 63.8192 69.7692 173.7118 21 E 4.4071 8.7023 127.6531 55.8994 30.3747 175.9867 22 V 4.5729 8.9578 126.1799 60.2056 35.6050 174.2913 23 T 4.7371 8.7682 119.3774 61.9919 70.8353 173.5505 24 V 4.3031 8.5944 127.4061 61.5538 33.2808 174.4392 25 F 4.9382 8.9940 127.1705 56.0552 41.3666 175.7089 26 F 4.9442 9.0768 121.9549 55.8571 40.9500 177.0432 27 L 4.0072 8.8198 120.3246 57.9792 41.3588 178.4536 28 N 4.5096 8.1181 113.0458 52.8331 37.5115 175.8310 29 G 4.1672 8.2973 108.4568 45.5489 0.0000 174.2229 30 F 4.8148 8.5671 118.9228 57.6253 39.5712 174.1264 31 Q 4.8204 8.1932 118.7850 54.9639 31.5553 173.9694 32 M 4.6750 8.5329 118.5769 54.1282 35.8898 173.2168 33 K 4.7893 8.3593 127.4769 55.1561 34.1802 175.9245 34 G 4.1774 8.1164 112.5762 46.3264 0.0000 171.4375 35 V 4.9592 7.7580 119.9695 59.8112 34.3404 175.2659 36 I 4.4735 8.3475 125.4374 61.3720 37.4216 176.2093 37 E 4.2943 9.1451 127.8878 58.4568 30.5546 176.6172 38 E 4.7464 7.9860 116.5136 55.9361 33.5222 173.0582 39 Y 5.1619 7.5429 116.8580 56.7189 40.5277 173.2621 40 D 4.7564 8.7879 118.9787 52.3521 41.8861 174.8429 41 K 3.9914 8.8569 118.5538 59.1301 32.4336 177.7808 42 Y 4.7844 9.0996 115.6435 58.1466 40.2705 175.4059 43 V 5.1577 7.9355 110.8856 59.6507 36.8156 174.8247 44 V 4.8133 8.9209 114.7773 59.7653 35.7536 174.8566 45 S 5.0680 9.3406 120.0925 56.7568 64.2105 172.2594 46 L 5.0868 9.1683 130.4661 53.2931 44.5521 174.3879 47 N 5.2524 9.3346 126.1364 52.6498 40.4590 173.6486 48 S 4.8011 9.1656 121.0476 57.3210 66.3249 173.8308 49 Q 3.5220 9.7715 125.3759 57.1749 26.1070 174.7820 50 G 3.9907 8.4969 102.4009 45.5327 0.0000 173.5781 51 K 4.6617 7.9032 118.0407 54.7436 35.7288 175.4157 52 Q 4.7705 8.3931 119.2844 56.0184 30.1471 175.1197 53 H 4.7914 9.0168 119.2550 54.0255 32.7565 172.1538 54 L 4.8937 8.7196 126.0657 53.9695 42.8026 175.2976 55 I 4.6218 8.9249 128.2139 59.5417 40.0555 175.1475 56 Y 4.6020 8.4588 124.3249 57.4279 38.7944 177.0780 57 K 4.0724 9.2399 124.6128 59.5451 32.3773 178.9933 58 H 4.3313 8.4201 112.9546 57.5672 28.6896 175.6334 59 A 4.6593 8.4248 122.5870 52.0027 19.5506 176.1275 60 I 4.4489 7.5002 117.6299 60.2121 38.5615 175.3510 61 S 4.5586 8.9489 120.1694 60.3213 63.2185 174.2598 62 T 4.7320 7.4714 114.1652 62.2758 73.1794 172.0257 63 Y 5.0690 8.6941 121.6994 56.7452 40.1583 175.0946 64 T 4.6169 9.2899 121.8344 61.7366 71.0821 175.3434 65 V 3.7143 8.3777 124.6460 63.0623 31.6361 175.4389 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 6 N 8.28 4.66 0.00 2.79 2.73 0.00 0.00 7.06 7.06 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 7 I 8.55 3.44 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 1.48 0.50 0.86 0.00 0.00 8 Q 8.71 3.78 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.91 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 9 D 7.90 4.21 0.00 2.72 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 10 K 8.12 3.83 0.00 1.79 1.90 0.00 1.46 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.36 7.81 11 A 7.81 3.41 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.40 3.38 0.00 0.74 0.13 0.60 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 13 E 7.68 4.23 0.00 2.23 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 0.00 2.32 2.29 0.00 14 N 7.99 4.31 0.00 2.70 2.75 0.00 0.00 7.04 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 15 F 7.91 4.55 0.00 3.01 2.91 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 16 K 8.59 4.35 0.00 2.08 2.13 0.00 1.81 0.00 0.00 1.86 0.00 0.00 2.98 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.52 1.56 7.81 17 A 8.01 4.05 1.35 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 18 N 8.32 4.60 0.00 2.85 2.91 0.00 0.00 7.15 7.22 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 19 Q 7.81 3.53 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 20 T 7.71 4.00 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 1.14 0.00 0.00 21 E 8.70 4.41 0.00 1.93 1.81 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 2.26 2.32 0.00 22 V 8.96 4.57 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 0.64 0.00 0.00 0.86 0.00 0.00 23 T 8.77 4.74 4.27 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 0.76 0.00 0.00 24 V 8.59 4.30 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 0.20 0.00 0.00 0.85 0.00 0.00 25 F 8.99 4.94 0.00 2.89 2.95 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 26 F 9.08 4.94 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 27 L 8.82 4.01 0.00 1.68 1.76 0.99 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 28 N 8.12 4.51 0.00 2.53 2.70 0.00 0.00 6.25 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 29 G 8.30 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.57 4.81 0.00 3.15 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 31 Q 8.19 4.82 0.00 1.10 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.67 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 32 M 8.53 4.67 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 33 K 8.36 4.79 0.00 1.71 1.61 0.00 1.84 0.00 0.00 1.67 0.00 0.00 2.74 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.36 7.81 34 G 8.12 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.76 4.96 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 0.90 0.00 0.00 0.95 0.00 0.00 36 I 8.35 4.47 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.66 1.12 0.00 0.00 37 E 9.15 4.29 0.00 1.89 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 2.34 2.32 0.00 38 E 7.99 4.75 0.00 2.00 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 2.30 2.31 0.00 39 Y 7.54 5.16 0.00 3.31 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 40 D 8.79 4.76 0.00 2.75 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.86 3.99 0.00 1.59 1.47 0.00 1.57 0.00 0.00 1.39 0.00 0.00 2.74 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.36 1.14 7.81 42 Y 9.10 4.78 0.00 3.08 3.12 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 43 V 7.94 5.16 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 0.54 0.00 0.00 1.00 0.00 0.00 44 V 8.92 4.81 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 0.93 0.00 0.00 1.09 0.00 0.00 45 S 9.34 5.07 0.00 3.88 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 46 L 9.17 5.09 0.00 1.78 1.54 0.91 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 47 N 9.33 5.25 0.00 2.88 2.70 0.00 0.00 6.16 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 S 9.17 4.80 0.00 3.87 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.77 3.52 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.85 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 50 G 8.50 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 0.00 0.00 0.00 51 K 7.90 4.66 0.00 1.83 1.83 0.00 1.30 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.49 1.24 7.81 52 Q 8.39 4.77 0.00 1.92 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 53 H 9.02 4.79 0.00 3.09 3.23 0.00 5.60 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.72 4.89 0.00 1.60 1.52 0.89 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.92 4.62 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.91 1.12 0.00 0.00 56 Y 8.46 4.60 0.00 2.93 2.50 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 0.00 0.00 0.00 0.00 57 K 9.24 4.07 0.00 2.00 1.96 0.00 1.91 0.00 0.00 1.88 0.00 0.00 3.04 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.61 1.60 7.81 58 H 8.42 4.33 0.00 3.24 3.52 0.00 5.53 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.42 4.66 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.50 4.45 1.84 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.76 0.29 0.00 0.00 61 S 8.95 4.56 0.00 3.84 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 62 T 7.47 4.73 4.23 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 0.00 0.00 0.00 1.21 0.00 0.00 63 Y 8.69 5.07 0.00 2.94 2.81 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 64 T 9.29 4.62 4.43 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 65 V 8.38 3.71 2.12 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 0.79 0.00 0.00 1.05 0.00 0.00