NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3599 8.2649 123.5870 51.5899 19.3579 176.5774 3 R 3.9121 8.3251 122.4017 55.5473 31.0625 176.2898 4 K 3.8690 9.3102 124.8758 59.7438 32.8613 178.3237 5 A 4.1453 8.0716 118.8686 54.1488 18.6975 178.1560 6 L 4.5956 8.1615 116.7746 55.3579 42.6871 177.9495 7 I 4.1182 7.4739 117.7282 61.7954 37.1199 176.6014 8 E 4.0999 8.3136 119.2988 58.3251 29.8117 179.3060 9 K 3.8973 7.6372 120.3382 59.2116 32.4698 176.5941 10 A 4.0745 7.7984 119.4474 53.1309 18.6252 177.6821 11 K 4.2045 8.1101 119.9660 55.8887 29.8877 177.1747 12 R 3.9344 7.9515 121.1154 58.2391 30.6215 177.2678 13 T 4.3855 7.4648 108.5659 59.3027 67.7009 171.6355 14 P 4.6453 0.0000 0.0000 62.9305 32.0784 177.0571 15 K 3.8864 8.1972 123.2840 56.9524 30.4304 176.1314 16 F 4.8922 7.2780 115.4248 55.1358 42.2399 175.8278 17 K 3.9401 9.0344 126.4927 59.5253 32.2990 179.0463 18 V 3.6900 8.0623 111.1848 64.5764 31.5217 177.7807 19 R 4.0657 7.9382 116.7400 58.4967 30.0938 177.2115 20 A 4.1678 7.6115 121.9687 52.1737 18.6737 176.3799 21 Y 4.8785 7.9425 120.4934 54.8773 41.0046 175.3250 22 T 3.9989 8.5253 117.6448 62.6227 68.1560 172.9284 23 R 4.7791 7.9697 124.3988 54.7770 33.2595 174.1927 24 C 4.4680 9.5321 126.0406 59.5450 31.8123 175.1713 25 V 3.7160 8.7462 127.9645 64.1518 31.3258 177.2947 26 R 4.2431 7.9864 119.8500 57.6795 30.3608 176.0933 27 C 4.7016 7.8671 108.0550 56.8714 30.8956 174.7147 28 G 3.9275 8.4596 109.0876 45.0014 0.0000 173.9310 29 R 3.8264 7.9095 119.9101 57.1222 30.3862 176.5409 30 A 4.1147 8.7188 127.4791 53.9188 19.7559 177.6162 31 R 4.2975 7.8090 113.2024 56.2670 32.1797 176.0818 32 S 3.5893 8.4861 113.5578 59.7739 60.3522 172.5432 33 V 4.9329 7.3192 112.3862 59.6272 33.7527 176.1960 34 Y 4.2383 9.0328 123.6067 58.0061 38.8373 177.4834 35 R 3.9447 8.8304 123.2973 59.5467 30.4838 178.8301 36 F 3.8620 8.3973 118.0867 60.3554 39.3539 175.6172 37 F 4.8564 8.3406 116.3156 56.6131 41.3690 176.9660 38 G 4.1531 8.8354 107.8198 45.3661 0.0000 173.0179 39 L 4.8242 7.5205 118.8803 53.3373 43.4390 176.0888 40 C 5.0250 8.2825 116.2724 57.0833 31.3267 174.6894 41 R 4.0053 8.7144 117.6112 59.3067 28.4573 179.1332 42 I 3.8651 7.6382 120.1513 64.3903 37.5011 177.5817 43 C 4.3064 7.9480 118.3205 62.1492 27.8961 175.7241 44 L 3.5845 7.8901 121.7988 58.0410 41.3386 179.0845 45 R 3.6906 7.0931 116.4734 59.4853 30.1474 177.9956 46 E 4.0952 8.3039 118.4679 59.4763 29.3768 179.2260 47 L 4.0029 8.6110 118.7847 57.9417 41.9136 179.4669 48 A 3.9113 8.0469 120.6977 55.6149 17.9117 179.4937 49 H 4.3628 7.6719 113.5192 58.9141 28.9270 177.9067 50 K 4.1787 7.7098 118.9741 57.6313 32.0116 178.3069 51 G 3.9538 7.7993 106.3368 45.4763 0.0000 174.4769 52 Q 4.3509 7.8122 115.8501 56.0066 28.3248 175.8082 53 L 4.6353 7.4060 118.6558 51.9495 43.1876 174.5807 54 P 4.0964 0.0000 0.0000 64.1290 31.6232 178.8217 55 G 4.0117 8.9915 110.2579 46.3264 0.0000 173.7965 56 V 3.6315 7.7488 119.8691 62.9630 31.4625 174.8524 57 R 4.6464 8.2044 126.0929 53.8742 33.3098 174.2873 58 K 4.1792 8.4566 119.4164 55.4701 32.1481 177.4030 59 A 4.4060 8.5066 127.1465 52.1944 19.2845 176.2947 60 S 4.5289 8.3041 110.4234 57.6184 65.1310 176.3703 61 W 4.2356 8.2192 123.0995 57.3900 27.2119 174.0771 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 4.36 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 3 R 8.33 3.91 0.00 1.99 1.88 0.00 3.16 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 4 K 9.31 3.87 0.00 1.83 1.83 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.53 7.81 5 A 8.07 4.15 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 6 L 8.16 4.60 0.00 1.89 1.81 0.96 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.47 4.12 1.88 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 1.61 0.69 0.91 0.00 0.00 8 E 8.31 4.10 0.00 2.19 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 0.00 2.55 2.44 0.00 9 K 7.64 3.90 0.00 1.37 1.67 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.79 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.78 0.84 7.81 10 A 7.80 4.07 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 11 K 8.11 4.20 0.00 1.93 1.72 0.00 1.55 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.53 7.81 12 R 7.95 3.93 0.00 1.81 2.00 0.00 3.36 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 13 T 7.46 4.39 4.19 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 14 P 0.00 4.65 0.00 2.25 2.17 0.00 3.83 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 1.92 1.97 0.00 15 K 8.20 3.89 0.00 1.62 0.74 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.95 1.25 7.81 16 F 7.28 4.89 0.00 3.10 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 17 K 9.03 3.94 0.00 1.82 1.89 0.00 1.74 0.00 0.00 1.84 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.51 7.81 18 V 8.06 3.69 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 0.98 0.00 0.00 19 R 7.94 4.07 0.00 2.09 2.16 0.00 3.46 0.00 0.00 3.38 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.81 0.00 20 A 7.61 4.17 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 21 Y 7.94 4.88 0.00 3.04 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.53 4.00 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 1.29 0.00 0.00 23 R 7.97 4.78 0.00 1.73 1.70 0.00 3.30 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 24 C 9.53 4.47 0.00 3.00 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 25 V 8.75 3.72 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 0.79 0.00 0.00 0.95 0.00 0.00 26 R 7.99 4.24 0.00 1.78 2.00 0.00 3.23 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 27 C 7.87 4.70 0.00 3.07 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 28 G 8.46 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 29 R 7.91 3.83 0.00 1.94 1.91 0.00 3.25 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.85 0.00 30 A 8.72 4.11 1.36 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 0.00 0.00 0.00 31 R 7.81 4.30 0.00 1.83 1.88 0.00 3.37 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 32 S 8.49 3.59 0.00 4.02 3.89 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 33 V 7.32 4.93 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.00 0.00 0.00 34 Y 9.03 4.24 0.00 3.40 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 35 R 8.83 3.94 0.00 1.96 2.02 0.00 3.18 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.65 0.00 36 F 8.40 3.86 0.00 2.93 2.82 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 37 F 8.34 4.86 0.00 3.32 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 38 G 8.84 4.15 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 0.00 0.00 0.00 39 L 7.52 4.82 0.00 1.79 1.57 0.80 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.28 5.02 0.00 3.28 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 41 R 8.71 4.01 0.00 2.26 2.53 0.00 2.85 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.81 0.00 42 I 7.64 3.87 1.88 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 1.66 0.61 0.95 0.00 0.00 43 C 7.95 4.31 0.00 2.93 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 44 L 7.89 3.58 0.00 1.41 1.64 0.41 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.09 3.69 0.00 2.04 2.12 0.00 3.33 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 46 E 8.30 4.10 0.00 2.16 1.96 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 2.33 2.58 0.00 47 L 8.61 4.00 0.00 1.56 1.65 0.88 0.96 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 8.05 3.91 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 49 H 7.67 4.36 0.00 3.39 3.32 0.00 5.66 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.71 4.18 0.00 1.80 1.87 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.60 7.81 51 G 7.80 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 52 Q 7.81 4.35 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 53 L 7.41 4.64 0.00 1.50 1.64 0.39 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.10 0.00 2.25 2.07 0.00 3.85 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.16 0.00 55 G 8.99 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 3.63 2.22 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 0.72 0.00 0.00 1.21 0.00 0.00 57 R 8.20 4.65 0.00 1.77 1.78 0.00 3.30 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 58 K 8.46 4.18 0.00 1.81 1.78 0.00 1.84 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.40 7.81 59 A 8.51 4.41 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.30 4.53 0.00 3.80 3.76 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 0.00 0.00 0.00 61 W 8.22 4.24 0.00 3.39 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