NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2712 8.2649 123.5833 51.7109 19.8244 176.5762 3 R 4.1770 8.3064 120.4919 55.8061 30.9882 174.6422 4 K 4.6494 8.4854 117.7195 56.3204 34.1119 177.7186 5 A 4.3476 8.2835 119.5999 53.5384 18.8225 179.0340 6 L 5.7167 7.3681 114.9671 53.1299 42.8634 176.1285 7 I 4.6409 7.3925 116.8405 60.1556 40.4668 177.5170 8 E 3.9637 8.3572 119.2588 59.2093 29.5002 179.3095 9 K 3.8668 8.1040 119.2325 59.0562 32.4073 177.6089 10 A 4.0360 7.6146 120.6336 54.7645 18.3622 178.1576 11 K 4.1921 7.2980 116.0563 57.9058 30.4502 179.1400 12 R 3.2629 7.9473 127.2680 57.1718 29.7479 177.4959 13 T 4.0603 8.4398 108.7257 60.4517 68.4318 172.5772 14 P 4.4866 0.0000 0.0000 62.5802 33.1374 177.1936 15 K 4.0755 8.4070 120.2921 57.3375 31.9283 176.0346 16 F 4.1710 9.3405 109.8320 59.8266 37.1550 177.0541 17 K 4.1058 7.6589 113.8430 58.1731 31.0243 174.2711 18 V 4.5823 8.2632 121.0916 63.4337 38.9803 175.6467 19 R 3.8613 7.9750 116.4072 56.9816 30.2700 176.0885 20 A 4.1573 8.4125 119.8837 52.1149 21.5289 176.2471 21 Y 4.7508 7.1400 121.6796 58.2941 37.9048 178.9628 22 T 3.0123 8.5058 118.1937 61.3052 70.6092 173.9564 23 R 4.2231 7.1646 124.3900 56.2423 30.6632 175.6382 24 C 4.5801 8.2898 118.9389 57.8318 32.4479 173.1701 25 V 3.5968 7.9380 122.0627 63.7874 31.7186 176.5065 26 R 4.6552 7.1565 120.6436 52.8491 29.8075 173.8293 27 C 4.5774 8.1931 118.1695 58.4758 38.0134 172.3546 28 G 3.9469 8.2401 108.0387 45.8615 0.0000 172.7065 29 R 4.6772 7.8137 124.1033 54.7676 31.4550 174.9159 30 A 4.2047 8.3109 123.9846 55.0389 18.8563 178.9708 31 R 4.4679 7.9858 112.6988 56.5244 30.1080 177.1415 32 S 4.6846 8.0411 111.4135 58.1005 64.4184 175.2912 33 V 4.9257 8.1588 113.8236 61.0054 34.5251 174.6109 34 Y 4.4135 8.3675 117.5895 56.6037 40.8467 176.2834 35 R 4.1661 9.3627 124.0735 59.2929 30.7490 178.4227 36 F 3.8411 8.0743 121.3954 60.7445 39.7478 176.3962 37 F 4.5099 8.3473 117.5996 57.2242 40.9221 174.8777 38 G 3.6502 9.7552 108.7166 44.0577 0.0000 173.0050 39 L 4.2965 7.3856 111.4901 54.2499 45.3924 174.7839 40 C 4.6036 8.2241 119.6363 57.8601 30.1244 174.7544 41 R 4.0322 8.5203 115.7009 57.5381 28.4457 177.6025 42 I 3.9988 7.1164 121.0550 63.4840 37.5225 175.7398 43 C 4.8112 7.8281 117.8254 58.8731 30.6434 174.8193 44 L 4.6046 8.1058 121.9612 55.6899 42.8394 178.0581 45 R 3.8902 8.2870 118.4801 59.6318 29.9203 177.6681 46 E 3.8312 8.1557 116.8499 59.3833 29.5679 178.6725 47 L 4.5266 8.9856 122.5171 56.5963 41.5308 178.3925 48 A 3.9496 7.7723 119.9190 56.0339 18.2017 178.6443 49 H 4.3339 7.9905 115.2318 57.2344 29.0812 177.8389 50 K 4.0227 7.2879 121.4781 60.3061 33.2400 176.6555 51 G 4.0728 6.8416 105.7896 46.2195 0.0000 174.0398 52 Q 4.5193 7.8525 112.5561 55.3851 31.2544 175.0199 53 L 4.6471 7.8572 118.7855 53.0261 41.9156 171.5366 54 P 4.3919 0.0000 0.0000 63.1235 30.8077 175.6047 55 G 3.7905 8.4035 118.4646 47.4082 0.0000 173.7097 56 V 4.2418 7.4326 116.5863 60.6484 32.0160 174.9450 57 R 4.2522 7.9588 124.3755 55.1172 31.8575 175.3033 58 K 4.5043 8.3108 116.4763 54.9498 33.9367 175.7843 59 A 4.6981 7.9445 123.5705 50.9660 20.7641 176.8226 60 S 4.8787 8.1314 111.2639 57.6721 65.2997 176.0067 61 W 4.2826 8.8403 123.5177 57.3847 27.1948 174.0493 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 4.27 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 3 R 8.31 4.18 0.00 1.91 1.92 0.00 3.17 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 4 K 8.49 4.65 0.00 1.79 1.72 0.00 1.56 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.42 1.48 7.81 5 A 8.28 4.35 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 6 L 7.37 5.72 0.00 1.58 1.61 0.97 0.76 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 7 I 7.39 4.64 1.87 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 1.47 0.76 0.90 0.00 0.00 8 E 8.36 3.96 0.00 2.11 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 0.00 2.38 2.28 0.00 9 K 8.10 3.87 0.00 1.74 1.83 0.00 1.34 0.00 0.00 1.52 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.28 7.81 10 A 7.61 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 11 K 7.30 4.19 0.00 1.90 1.79 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.42 7.81 12 R 7.95 3.26 0.00 1.87 1.69 0.00 3.21 0.00 0.00 3.25 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 13 T 8.44 4.06 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 1.20 0.00 0.00 14 P 0.00 4.49 0.00 2.26 2.36 0.00 3.84 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.96 0.00 15 K 8.41 4.08 0.00 1.98 1.92 0.00 1.92 0.00 0.00 2.20 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.48 7.81 16 F 9.34 4.17 0.00 2.98 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 17 K 7.66 4.11 0.00 1.96 2.14 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.38 1.51 7.81 18 V 8.26 4.58 2.13 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 0.77 0.00 0.00 1.07 0.00 0.00 19 R 7.98 3.86 0.00 1.86 1.99 0.00 3.36 0.00 0.00 3.43 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.76 0.00 20 A 8.41 4.16 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.14 4.75 0.00 3.09 3.03 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 22 T 8.51 3.01 4.31 0.00 0.00 0.00 0.00 0.00 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 23 R 7.16 4.22 0.00 1.92 2.02 0.00 3.39 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.67 0.00 24 C 8.29 4.58 0.00 3.02 2.93 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 25 V 7.94 3.60 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 0.79 0.00 0.00 0.94 0.00 0.00 26 R 7.16 4.66 0.00 1.75 1.86 0.00 3.28 0.00 0.00 3.16 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 27 C 8.19 4.58 0.00 2.93 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 28 G 8.24 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 29 R 7.81 4.68 0.00 1.89 1.81 0.00 3.29 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 30 A 8.31 4.20 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.99 4.47 0.00 1.82 1.98 0.00 3.31 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 32 S 8.04 4.68 0.00 3.94 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 33 V 8.16 4.93 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.10 0.00 0.00 34 Y 8.37 4.41 0.00 3.01 3.41 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 35 R 9.36 4.17 0.00 1.92 1.99 0.00 3.36 0.00 0.00 3.30 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.61 0.00 36 F 8.07 3.84 0.00 2.86 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 8.35 4.51 0.00 3.06 3.14 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 0.00 0.00 0.00 0.00 38 G 9.76 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.39 4.30 0.00 1.67 1.59 0.94 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.22 4.60 0.00 3.22 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 41 R 8.52 4.03 0.00 1.93 2.10 0.00 3.06 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 42 I 7.12 4.00 1.89 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 1.37 0.92 0.92 0.00 0.00 43 C 7.83 4.81 0.00 3.08 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 44 L 8.11 4.60 0.00 1.62 1.85 0.79 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.29 3.89 0.00 2.17 2.03 0.00 3.23 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 46 E 8.16 3.83 0.00 2.23 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 0.00 2.36 2.46 0.00 47 L 8.99 4.53 0.00 1.62 1.88 0.97 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.77 3.95 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 49 H 7.99 4.33 0.00 3.38 3.43 0.00 5.58 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 50 K 7.29 4.02 0.00 1.93 1.90 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.44 7.81 51 G 6.84 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 7.85 4.52 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 53 L 7.86 4.65 0.00 1.80 1.80 0.97 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.39 0.00 2.22 2.21 0.00 3.94 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 55 G 8.40 3.79 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 0.00 0.00 0.00 56 V 7.43 4.24 2.10 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 0.81 0.00 0.00 1.09 0.00 0.00 57 R 7.96 4.25 0.00 1.81 1.86 0.00 3.28 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 58 K 8.31 4.50 0.00 1.80 1.73 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.43 7.81 59 A 7.94 4.70 1.22 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 0.00 0.00 60 S 8.13 4.88 0.00 3.88 3.80 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 0.00 0.00 0.00 61 W 8.84 4.28 0.00 3.38 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