NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4859 0.0000 0.0000 62.6844 33.6371 174.6402 2 F 5.2635 8.8038 122.8204 56.3896 41.3228 172.6905 3 I 4.2361 9.7556 129.8876 59.5242 39.7311 174.0947 4 E 4.7823 8.3310 126.6415 54.6226 31.6411 175.0906 5 C 4.6167 8.9071 122.9064 58.3331 30.6965 172.7479 6 H 5.4238 8.8098 122.3071 54.3920 29.4066 174.4406 7 I 4.8574 8.7212 116.3529 58.5684 41.5918 174.5459 8 A 4.6777 8.5152 124.0885 51.8344 18.9109 177.5305 9 T 3.8522 8.4242 115.8106 62.7007 67.6667 172.8357 10 G 3.5035 8.9402 117.2024 45.6819 0.0000 174.7735 11 L 4.1606 7.5559 120.4293 54.1975 42.4122 177.5886 12 S 4.3708 8.3491 116.8660 58.0425 65.1254 175.5464 13 V 3.5328 8.3230 121.7720 66.3188 31.2811 178.1556 14 A 3.9980 7.9309 119.9442 55.0698 18.1783 179.4482 15 R 3.8803 7.9505 117.3923 59.2010 30.1499 178.7198 16 K 3.9075 8.2484 118.5990 59.7246 32.1198 179.2063 17 Q 4.0053 8.2015 118.1238 59.0254 28.5323 178.7115 18 Q 3.9610 8.2303 120.5829 58.9322 28.9761 177.9967 19 L 3.9254 8.2770 121.7706 58.2888 42.1738 179.0632 20 I 3.6785 7.8382 119.6607 64.2838 37.0292 178.2021 21 R 3.9007 8.0759 119.5251 59.7617 29.8216 178.2876 22 D 4.3514 8.3857 118.7558 57.2981 40.7802 178.9391 23 V 3.5723 8.1172 119.0833 65.9633 31.4690 178.1277 24 I 3.6720 7.8303 119.5045 64.4025 36.9643 177.8692 25 D 4.2995 8.1653 118.7405 57.6376 41.1269 178.7740 26 V 3.7169 8.0364 112.6564 64.1440 31.4711 178.9095 27 T 3.8257 7.8886 115.9848 66.5605 68.4023 176.0612 28 N 4.5003 8.1859 120.3623 56.2530 38.7482 177.0571 29 K 4.0430 8.0736 118.7998 59.0421 32.1573 178.9304 30 S 4.4693 7.9574 113.7894 59.6158 63.6874 174.9117 31 I 4.2935 7.9411 112.2961 59.6530 38.4843 176.3864 32 G 3.9349 8.1908 109.4998 45.2742 0.0000 174.0968 33 S 4.1154 7.8004 116.7100 58.2609 63.5303 173.2957 34 D 4.3469 8.7697 124.5543 53.9395 41.6070 175.1895 35 P 4.4757 0.0000 0.0000 65.7222 31.4802 178.3221 36 K 4.1811 8.8987 116.8005 58.1364 31.9801 177.5603 37 I 4.4291 8.0608 111.8850 60.2868 37.6860 174.6959 38 I 4.6595 7.5467 121.9658 60.2642 38.6683 174.8764 39 N 5.1787 9.2888 124.3744 51.4126 41.9988 173.7229 40 V 5.0116 8.5316 122.0401 61.0403 35.0562 174.0834 41 L 4.7794 9.0350 129.0935 53.2083 45.0163 174.5138 42 L 4.8210 8.6352 128.6258 53.7553 43.3978 175.3788 43 V 4.3815 8.9216 126.9099 61.1138 34.0068 173.8066 44 E 5.1719 8.7238 126.9759 55.0096 31.8365 175.0730 45 H 5.1036 9.1340 119.7683 53.4327 33.6278 173.0705 46 A 4.3640 8.6239 123.7840 52.2356 19.1907 178.4853 47 E 3.9052 9.1164 121.3906 59.6295 29.7200 179.6778 48 A 4.0399 7.9330 119.8311 54.8394 18.5351 177.6311 49 N 4.6856 8.0581 111.3586 53.8915 38.9264 174.8721 50 M 4.6936 7.8580 118.4127 53.2487 34.9550 174.8752 51 S 4.6788 8.5880 116.9726 56.4369 65.0248 172.7826 52 I 4.3593 8.2641 128.2350 60.9221 38.7418 175.9053 53 S 3.4325 9.6529 120.5979 59.7236 60.6700 173.3689 54 G 3.9008 7.5648 103.2693 45.9227 0.0000 174.0011 55 R 4.6789 7.6918 118.6994 55.1646 31.1819 176.2146 56 I 4.4911 8.1979 122.1534 61.1418 40.8144 175.1731 57 H 4.2079 9.8251 120.1613 56.8475 26.1812 175.9731 58 G 3.9879 8.5655 105.5211 45.4332 0.0000 173.8125 59 E 4.6288 8.0838 119.5114 53.8139 32.2820 175.6991 60 A 4.4110 8.4976 125.8209 52.1041 19.2580 177.1833 61 A 4.2040 8.1826 122.0314 52.4693 18.5782 177.7629 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 P 0.00 4.49 0.00 2.16 2.27 0.00 3.74 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 2 F 8.80 5.26 0.00 2.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.76 4.24 1.83 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 1.18 0.63 0.83 0.00 0.00 4 E 8.33 4.78 0.00 1.57 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.47 0.00 5 C 8.91 4.62 0.00 2.77 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 6 H 8.81 5.42 0.00 3.02 3.30 0.00 5.84 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.72 4.86 1.88 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 1.16 0.94 0.91 0.00 0.00 8 A 8.52 4.68 1.25 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 0.00 0.00 9 T 8.42 3.85 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 1.26 0.00 0.00 10 G 8.94 3.50 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 0.00 0.00 0.00 11 L 7.56 4.16 0.00 1.63 1.61 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.35 4.37 0.00 4.04 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 13 V 8.32 3.53 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 1.04 0.00 0.00 0.93 0.00 0.00 14 A 7.93 4.00 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 15 R 7.95 3.88 0.00 1.96 2.04 0.00 3.16 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 16 K 8.25 3.91 0.00 2.03 1.85 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.69 7.81 17 Q 8.20 4.01 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 18 Q 8.23 3.96 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 19 L 8.28 3.93 0.00 1.85 1.84 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.84 3.68 2.01 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 1.41 0.86 0.92 0.00 0.00 21 R 8.08 3.90 0.00 1.96 2.12 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 22 D 8.39 4.35 0.00 2.90 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 23 V 8.12 3.57 2.21 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 1.02 0.00 0.00 0.98 0.00 0.00 24 I 7.83 3.67 2.03 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 0.52 0.92 0.00 0.00 25 D 8.17 4.30 0.00 2.79 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 26 V 8.04 3.72 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 0.80 0.00 0.00 0.98 0.00 0.00 27 T 7.89 3.83 4.42 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 1.22 0.00 0.00 28 N 8.19 4.50 0.00 2.89 3.03 0.00 0.00 6.76 5.76 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 29 K 8.07 4.04 0.00 1.77 1.86 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.60 7.81 30 S 7.96 4.47 0.00 4.04 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 31 I 7.94 4.29 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 1.46 0.75 0.91 0.00 0.00 32 G 8.19 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 0.00 0.00 0.00 33 S 7.80 4.12 0.00 3.91 3.83 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 34 D 8.77 4.35 0.00 2.71 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.48 0.00 2.22 2.12 0.00 3.65 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.14 0.00 36 K 8.90 4.18 0.00 1.79 1.87 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.50 7.81 37 I 8.06 4.43 1.88 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 1.36 0.74 0.92 0.00 0.00 38 I 7.55 4.66 1.99 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 1.25 0.83 0.94 0.00 0.00 39 N 9.29 5.18 0.00 2.75 2.73 0.00 0.00 5.96 8.30 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 40 V 8.53 5.01 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 0.78 0.00 0.00 0.96 0.00 0.00 41 L 9.04 4.78 0.00 2.01 1.54 0.98 0.74 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 42 L 8.64 4.82 0.00 1.68 1.54 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.92 4.38 2.06 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 0.98 0.00 0.00 0.89 0.00 0.00 44 E 8.72 5.17 0.00 1.82 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.27 0.00 45 H 9.13 5.10 0.00 3.02 3.13 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 8.62 4.36 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 47 E 9.12 3.91 0.00 2.01 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 2.42 2.29 0.00 48 A 7.93 4.04 1.28 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 0.00 0.00 49 N 8.06 4.69 0.00 2.90 2.85 0.00 0.00 6.77 7.18 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 50 M 7.86 4.69 0.00 1.95 1.91 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.34 0.00 51 S 8.59 4.68 0.00 3.74 3.68 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 52 I 8.26 4.36 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.93 0.90 0.00 0.00 53 S 9.65 3.43 0.00 3.97 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 54 G 7.56 3.90 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 0.00 0.00 0.00 55 R 7.69 4.68 0.00 1.91 1.86 0.00 3.28 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 1.70 1.87 0.00 56 I 8.20 4.49 1.82 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 1.24 0.70 0.66 0.00 0.00 57 H 9.83 4.21 0.00 3.29 3.34 0.00 5.74 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 58 G 8.57 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 59 E 8.08 4.63 0.00 1.98 1.83 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 2.38 2.36 0.00 60 A 8.50 4.41 1.24 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 0.00 0.00 0.00 61 A 8.18 4.20 1.26 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 0.00 0.00