NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3425 8.2644 123.5846 52.7910 19.7671 176.9480 3 R 4.4306 8.2866 115.9539 56.1787 34.3636 173.0571 4 K 3.9809 8.9513 120.7508 57.8128 32.1933 178.0059 5 A 4.0176 9.1689 119.6243 55.1634 19.2190 179.5606 6 L 3.9071 7.8872 116.4088 58.1429 42.0661 179.1353 7 I 3.7804 8.8721 113.5459 64.5513 37.1065 177.8858 8 E 3.9212 8.0174 120.2157 58.3814 29.3623 178.9770 9 K 4.1259 8.3476 115.2241 57.8241 32.1679 177.0336 10 A 4.4046 7.8848 119.3038 53.0451 20.7922 178.4557 11 K 4.0231 7.5978 115.6747 57.9639 32.6664 178.1142 12 R 4.1817 7.3793 117.5285 55.9418 30.8643 176.7487 13 T 3.8207 9.0543 118.8770 66.7346 68.7601 174.5659 14 P 3.5320 0.0000 0.0000 62.2622 30.4750 175.9221 15 K 3.3167 9.4926 115.5444 58.2822 29.5658 172.8669 16 F 3.7618 7.9020 128.2397 56.9216 38.7443 175.2445 17 K 4.3577 8.5900 120.1619 59.0893 33.5658 179.2731 18 V 3.7213 8.0165 111.7984 64.2469 32.8388 178.5082 19 R 4.0920 7.7099 115.6886 55.5081 29.2026 181.3539 20 A 3.5577 8.3213 130.4962 54.1395 15.6039 175.7105 21 Y 5.0615 7.6120 128.5262 56.5746 41.6727 174.1826 22 T 3.5789 9.2151 113.8994 62.5845 67.2855 174.2568 23 R 4.0630 9.4787 129.1662 55.9305 29.1377 173.3980 24 C 3.7028 8.7237 124.7198 59.2987 32.0743 174.1879 25 V 3.8206 7.9042 126.7330 65.9587 33.1087 178.2079 26 R 4.1243 8.4603 116.9499 56.9906 28.6956 179.0111 27 C 3.9983 9.5134 118.7990 59.2290 30.4405 175.3774 28 G 3.9117 8.5296 107.9553 46.0378 0.0000 174.0379 29 R 4.0322 7.7228 120.5163 56.3461 30.5849 176.8094 30 A 4.8449 8.5415 124.3915 52.2107 21.3709 176.8200 31 R 4.4700 7.8789 113.3441 55.8592 32.3766 175.9159 32 S 3.6051 8.4386 115.2707 59.3615 59.5871 170.9296 33 V 5.4959 7.1921 111.4991 58.4779 34.9394 175.1957 34 Y 4.3916 8.8558 122.6272 56.9156 38.1752 176.0730 35 R 3.9594 9.1010 125.0290 59.5292 30.4339 178.4844 36 F 3.8688 8.4686 117.6339 60.6446 39.1367 175.6996 37 F 4.7495 7.8440 116.5482 56.2186 41.1429 174.9709 38 G 3.8200 9.3609 108.8141 45.6476 0.0000 171.8595 39 L 4.5524 7.4713 117.2857 53.7997 46.7079 175.1137 40 C 5.2477 8.3618 114.3542 56.5312 31.4503 174.7502 41 R 4.0662 8.5913 118.4142 59.9590 28.5244 178.7439 42 I 3.7098 7.6856 119.7145 64.1622 37.4686 177.5557 43 C 4.4083 7.9601 118.1402 62.2719 27.9312 175.4043 44 L 3.6816 7.9790 121.5972 58.8101 41.3509 179.2748 45 R 3.6496 7.5368 117.7619 58.7103 29.8688 178.1777 46 E 3.7907 8.0120 119.6343 58.9345 29.5439 178.6366 47 L 4.0022 8.0831 118.7957 57.5501 41.9034 178.9358 48 A 4.0014 7.7489 119.1491 55.1930 18.3089 178.6669 49 H 4.6231 7.6507 114.0039 57.8398 29.1617 177.0641 50 K 4.2935 8.5333 118.0317 56.5943 32.0436 178.2081 51 G 4.1598 8.0869 112.6025 46.1044 0.0000 176.0821 52 Q 3.8445 7.8400 117.3334 57.4091 29.1616 176.9379 53 L 4.5586 7.9303 118.8880 51.9549 42.3187 174.4280 54 P 4.0298 0.0000 0.0000 64.1443 31.4534 175.1453 55 G 4.0251 8.0811 115.4083 46.9200 0.0000 173.9916 56 V 3.3971 6.6456 126.8002 61.5238 30.4761 175.0025 57 R 4.6032 8.1099 127.2049 53.4448 32.7716 174.8571 58 K 3.8141 8.8282 123.7979 56.9324 33.3101 176.2337 59 A 4.4816 8.2044 125.0632 51.9954 17.7071 180.5225 60 S 4.5067 9.3749 112.8354 59.9213 61.8659 169.2083 61 W 3.8446 8.1714 118.9160 57.5332 27.2257 174.2994 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 A 8.26 4.34 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 3 R 8.29 4.43 0.00 1.84 1.88 0.00 3.24 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 4 K 8.95 3.98 0.00 1.87 1.48 0.00 1.70 0.00 0.00 1.83 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.48 7.81 5 A 9.17 4.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.89 3.91 0.00 1.68 1.88 1.06 0.87 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 7 I 8.87 3.78 1.87 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 1.92 0.65 0.97 0.00 0.00 8 E 8.02 3.92 0.00 2.08 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 2.40 2.31 0.00 9 K 8.35 4.13 0.00 1.72 1.99 0.00 1.80 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.52 7.81 10 A 7.88 4.40 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 11 K 7.60 4.02 0.00 1.71 1.84 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.70 7.81 12 R 7.38 4.18 0.00 1.80 1.85 0.00 3.21 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.85 0.00 13 T 9.05 3.82 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 14 P 0.00 3.53 0.00 2.11 2.18 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.13 0.00 15 K 9.49 3.32 0.00 1.86 2.05 0.00 1.95 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.14 1.38 7.81 16 F 7.90 3.76 0.00 3.23 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 17 K 8.59 4.36 0.00 1.97 2.09 0.00 1.58 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.51 7.81 18 V 8.02 3.72 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 0.73 0.00 0.00 0.96 0.00 0.00 19 R 7.71 4.09 0.00 1.86 1.07 0.00 3.68 0.00 0.00 3.34 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.71 0.00 20 A 8.32 3.56 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.61 5.06 0.00 3.11 2.89 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 22 T 9.22 3.58 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 1.25 0.00 0.00 23 R 9.48 4.06 0.00 1.88 2.12 0.00 3.52 0.00 0.00 3.38 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.65 0.00 24 C 8.72 3.70 0.00 2.97 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 25 V 7.90 3.82 2.26 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 0.83 0.00 0.00 1.00 0.00 0.00 26 R 8.46 4.12 0.00 1.86 1.60 0.00 3.30 0.00 0.00 3.28 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 27 C 9.51 4.00 0.00 3.12 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 28 G 8.53 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 0.00 0.00 0.00 29 R 7.72 4.03 0.00 1.93 1.85 0.00 3.11 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 30 A 8.54 4.84 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.88 4.47 0.00 1.82 1.86 0.00 3.36 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 32 S 8.44 3.61 0.00 4.05 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 33 V 7.19 5.50 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 0.69 0.00 0.00 0.95 0.00 0.00 34 Y 8.86 4.39 0.00 3.40 3.23 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 0.00 35 R 9.10 3.96 0.00 1.95 2.05 0.00 3.19 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 36 F 8.47 3.87 0.00 2.88 2.72 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 0.00 0.00 0.00 37 F 7.84 4.75 0.00 3.32 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 38 G 9.36 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.47 4.55 0.00 1.77 1.59 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.36 5.25 0.00 3.16 3.10 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 41 R 8.59 4.07 0.00 2.26 2.44 0.00 2.82 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 42 I 7.69 3.71 1.89 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 1.65 1.18 0.92 0.00 0.00 43 C 7.96 4.41 0.00 2.97 2.99 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 44 L 7.98 3.68 0.00 1.69 1.66 0.20 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.54 3.65 0.00 1.66 1.79 0.00 3.20 0.00 0.00 3.05 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.24 0.00 46 E 8.01 3.79 0.00 2.28 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 47 L 8.08 4.00 0.00 1.63 1.64 0.91 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.75 4.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.65 4.62 0.00 3.45 3.31 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.53 4.29 0.00 1.88 1.83 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.63 7.81 51 G 8.09 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 Q 7.84 3.84 0.00 2.03 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.71 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 53 L 7.93 4.56 0.00 1.52 1.56 0.72 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.03 0.00 2.13 2.10 0.00 3.91 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 55 G 8.08 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 56 V 6.65 3.40 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 0.74 0.00 0.00 1.12 0.00 0.00 57 R 8.11 4.60 0.00 1.91 1.77 0.00 3.33 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 58 K 8.83 3.81 0.00 1.76 1.77 0.00 1.87 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.40 7.81 59 A 8.20 4.48 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.37 4.51 0.00 4.02 4.28 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 61 W 8.17 3.84 0.00 3.40 3.18 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