NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3042 8.2649 123.5836 51.7041 18.8760 176.9001 3 P 4.3666 0.0000 0.0000 61.4398 33.6545 173.8629 4 T 4.5511 8.1898 112.8728 60.7890 71.7821 174.8438 5 L 3.9687 8.2436 123.1349 58.3171 42.2113 178.4722 6 T 3.9058 8.0603 109.0912 64.8506 68.2737 175.9090 7 A 4.0140 7.9645 122.9266 55.1715 18.5970 179.2144 8 R 3.9356 7.8977 116.4796 59.8105 30.1891 179.1399 9 L 4.1214 8.3903 118.6803 58.0181 41.6139 179.1655 10 Y 4.3345 8.2685 119.3264 60.8954 38.6235 177.8692 11 S 4.0590 8.3361 114.9581 61.9465 63.1368 176.6829 12 L 4.1865 7.9410 119.8090 56.9276 41.4542 178.1055 13 L 4.5247 7.6432 114.7760 54.4870 44.3997 177.4256 14 F 4.6767 7.9845 115.5511 59.0012 39.9830 176.8348 15 R 3.6535 7.1416 120.5142 58.9791 29.9814 176.3797 16 R 4.5229 7.5486 116.1076 55.0986 31.6845 177.7261 17 T 4.3875 8.3780 118.1674 66.4508 68.4293 176.8002 18 S 4.1819 8.1162 117.9448 61.5038 62.8264 176.2146 19 T 3.7640 7.7494 111.4659 64.9793 68.5406 175.6179 20 F 4.0933 8.6102 124.2938 61.0485 39.2659 177.1856 21 A 3.7985 8.2268 119.9146 54.8769 18.2392 179.1991 22 L 3.8272 8.2512 119.3590 58.6252 42.1355 179.1145 23 T 3.7568 8.5245 114.1347 65.1493 67.1627 176.1054 24 I 3.6776 7.3399 114.7288 63.7818 37.5750 178.4503 25 V 3.5528 7.7536 120.2278 65.7824 31.3490 178.2059 26 V 3.8812 8.0485 117.9985 65.5227 31.2609 178.2347 27 G 3.6720 8.2208 105.6938 47.4621 0.0000 175.7180 28 A 4.1370 8.3984 123.5282 54.7718 18.5777 179.3938 29 L 3.8304 7.8756 118.6193 58.1844 42.1031 179.2167 30 F 4.2855 7.9382 116.9448 60.1010 39.1818 177.6187 31 F 4.1593 8.6110 120.4948 61.3348 39.0535 176.7073 32 E 3.9344 8.6371 119.0250 59.3886 29.5883 178.8220 33 R 3.8313 7.6229 117.1798 59.4600 30.1660 178.3394 34 A 4.0593 8.5560 120.9297 54.6166 18.2948 179.5457 35 F 3.8085 8.4174 119.7002 61.3688 39.3955 176.9503 36 D 4.2280 8.2635 118.8018 57.9023 40.6908 178.6198 37 Q 4.0278 7.9582 117.9173 59.1877 28.2843 179.2605 38 G 3.6564 8.2181 106.2302 47.8527 0.0000 175.1121 39 A 3.9661 7.9333 122.7445 54.3379 18.4744 179.4424 40 D 4.1735 8.2969 117.7751 57.6612 40.9563 178.6098 41 A 3.9148 7.9022 121.1162 55.4677 17.7532 179.8213 42 I 3.6628 7.3497 117.0820 64.6005 36.9384 177.9886 43 Y 4.1356 7.7053 119.5152 60.5892 38.8533 177.7566 44 E 3.8401 8.5143 119.7933 59.8457 29.4452 178.7463 45 H 3.9044 7.9312 114.8389 59.0525 28.8422 176.9819 46 I 3.9508 7.2238 117.3711 60.6241 38.1776 176.6019 47 N 4.2730 8.2845 115.6617 52.9121 37.5747 175.6760 48 E 4.0446 9.7722 121.7705 57.3657 27.1182 174.7610 49 G 4.2590 7.6352 105.6542 45.1532 0.0000 174.4257 50 K 4.4107 8.0961 120.4592 55.9979 33.2667 176.8822 51 L 4.5032 8.5856 118.9729 57.0202 42.5941 178.0175 52 W 4.0924 8.6542 119.4399 58.9582 28.5618 177.5484 53 K 3.9286 8.4369 122.9501 60.5143 32.1255 178.4861 54 H 4.4101 8.2083 114.9640 59.3563 28.9062 176.9606 55 I 3.6837 8.6465 121.6050 64.2086 36.5716 179.9838 56 K 4.7221 7.0496 117.5443 59.6720 32.7580 177.2101 57 H 4.5795 8.6802 112.3058 56.9020 29.0579 175.9946 58 K 4.7069 7.8410 120.4998 55.2506 32.9934 176.9959 59 Y 4.3480 8.1553 115.5302 58.6985 38.4694 177.3006 60 E 3.2094 7.6901 120.6529 57.0990 30.0138 176.3449 61 N 3.9099 7.6081 118.6877 54.1623 39.6098 174.5275 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 4.30 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 P 0.00 4.37 0.00 2.16 2.06 0.00 3.66 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 4 T 8.19 4.55 4.25 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 1.26 0.00 0.00 5 L 8.24 3.97 0.00 1.77 1.65 0.94 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 6 T 8.06 3.91 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 1.22 0.00 0.00 7 A 7.96 4.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 7.90 3.94 0.00 2.19 2.07 0.00 3.17 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.88 0.00 9 L 8.39 4.12 0.00 2.08 2.30 1.09 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 10 Y 8.27 4.33 0.00 3.24 3.21 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 11 S 8.34 4.06 0.00 4.07 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 12 L 7.94 4.19 0.00 1.74 1.69 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.64 4.52 0.00 1.27 1.12 0.75 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 14 F 7.98 4.68 0.00 2.95 3.07 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 15 R 7.14 3.65 0.00 1.37 1.78 0.00 3.18 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 16 R 7.55 4.52 0.00 1.89 1.80 0.00 3.15 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 17 T 8.38 4.39 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 1.35 0.00 0.00 18 S 8.12 4.18 0.00 3.86 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 T 7.75 3.76 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 1.17 0.00 0.00 20 F 8.61 4.09 0.00 3.27 3.31 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 0.00 21 A 8.23 3.80 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.25 3.83 0.00 1.76 1.78 0.91 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.52 3.76 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 0.91 0.00 0.00 24 I 7.34 3.68 1.69 0.00 0.00 0.71 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 0.90 0.45 0.00 0.00 25 V 7.75 3.55 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 0.97 0.00 0.00 0.97 0.00 0.00 26 V 8.05 3.88 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 1.14 0.00 0.00 1.00 0.00 0.00 27 G 8.22 3.67 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 0.00 0.00 0.00 28 A 8.40 4.14 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.88 3.83 0.00 1.81 1.76 0.80 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 30 F 7.94 4.29 0.00 3.37 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 31 F 8.61 4.16 0.00 3.29 3.16 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 32 E 8.64 3.93 0.00 2.20 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 2.34 2.39 0.00 33 R 7.62 3.83 0.00 1.98 2.11 0.00 3.18 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 34 A 8.56 4.06 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 35 F 8.42 3.81 0.00 1.89 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.26 4.23 0.00 2.83 2.68 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 37 Q 7.96 4.03 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 38 G 8.22 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.93 3.97 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.30 4.17 0.00 2.75 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.90 3.91 1.31 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 0.00 0.00 0.00 42 I 7.35 3.66 1.99 0.00 0.00 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 1.61 1.34 0.91 0.00 0.00 43 Y 7.71 4.14 0.00 2.89 3.16 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 44 E 8.51 3.84 0.00 1.79 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.49 0.00 45 H 7.93 3.90 0.00 3.10 3.34 0.00 5.84 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.22 3.95 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 1.38 0.68 0.87 0.00 0.00 47 N 8.28 4.27 0.00 2.49 2.21 0.00 0.00 7.24 7.34 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 48 E 9.77 4.04 0.00 2.00 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 2.03 2.24 0.00 49 G 7.64 4.26 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 0.00 50 K 8.10 4.41 0.00 2.19 2.14 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.52 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.35 7.81 51 L 8.59 4.50 0.00 1.67 1.69 0.85 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.65 4.09 0.00 3.38 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 53 K 8.44 3.93 0.00 1.73 1.84 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.57 7.81 54 H 8.21 4.41 0.00 3.31 3.42 0.00 5.91 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 55 I 8.65 3.68 2.02 0.00 0.00 0.69 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 1.34 0.90 0.00 0.00 56 K 7.05 4.72 0.00 1.92 1.84 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.55 1.62 7.81 57 H 8.68 4.58 0.00 3.23 3.38 0.00 5.84 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 58 K 7.84 4.71 0.00 1.77 1.70 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.42 7.81 59 Y 8.16 4.35 0.00 3.07 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 60 E 7.69 3.21 0.00 1.85 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 2.27 2.22 0.00 61 N 7.61 3.91 0.00 2.58 2.58 0.00 0.00 6.74 7.56 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