NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.4515 0.0000 0.0000 62.6443 33.3369 174.6503 3 F 5.2860 8.9463 126.1256 56.2548 41.1234 172.3172 4 I 4.1453 9.0501 128.8286 59.6576 39.4226 174.1121 5 E 4.7251 8.3298 127.3207 54.4014 31.9027 174.4266 6 C 4.7602 9.2158 124.7974 58.2338 31.0961 172.4918 7 H 5.5675 8.9053 121.4020 54.1683 30.0780 173.6588 8 I 4.8520 8.5858 116.1971 58.6327 41.5029 174.7204 9 A 5.1405 8.3984 123.8986 51.5024 19.1794 177.4528 10 T 4.2460 8.2293 116.0994 63.6853 69.1160 173.9751 11 G 3.6551 8.8194 111.9294 45.8287 0.0000 174.7686 12 L 4.3097 7.6373 120.1394 53.9643 42.6798 177.4161 13 S 4.4089 8.3329 116.8858 57.8614 65.3341 175.5941 14 V 3.5681 8.4029 123.3567 65.3298 30.9330 178.4255 15 A 3.9861 7.9283 120.8762 54.8003 18.3108 179.4468 16 R 3.8998 8.1504 117.2891 59.3871 30.1233 178.9319 17 K 4.0692 8.3269 118.8069 59.1097 31.9244 179.4474 18 Q 3.9552 8.0245 118.4076 59.0672 28.6574 178.2870 19 Q 3.9612 8.0550 120.5441 59.1606 28.9736 178.3178 20 L 3.9298 7.8898 121.1191 58.3814 42.2521 179.1197 21 I 3.7459 7.8802 119.7118 64.2039 36.9668 178.4682 22 R 3.8849 8.3052 120.0956 59.6416 29.9950 178.4267 23 D 4.4365 8.5454 118.9416 57.1260 40.7491 179.1776 24 V 3.6954 7.8708 113.3503 64.0588 31.4809 178.5007 25 I 3.6442 7.6622 119.4799 64.7548 36.9329 177.3296 26 D 4.3387 8.1049 118.7429 57.8435 41.0826 178.7693 27 V 3.6187 8.1553 119.3483 65.1234 31.1587 178.6096 28 T 3.9837 8.0410 118.9288 67.1547 68.4000 177.2538 29 N 4.6705 8.5044 125.3994 57.6079 37.4149 179.9026 30 K 4.2843 8.2852 125.8601 59.2142 31.8786 180.7698 31 S 4.6139 7.8999 113.4284 60.2430 63.5898 175.7861 32 I 4.2075 8.0367 121.7894 60.6077 37.9184 177.0017 33 G 3.9726 8.1031 107.0069 44.8202 0.0000 173.9130 34 S 4.1372 7.7921 116.6046 58.4589 63.5140 173.2196 35 D 4.6183 8.6574 125.0003 53.2593 41.6284 175.0588 36 P 4.3107 0.0000 0.0000 65.5167 31.1003 177.7484 37 K 4.2423 8.0859 117.2862 57.6562 32.1352 177.3511 38 I 4.4560 8.0949 111.4811 60.2627 38.0036 174.7969 39 I 4.6759 7.3248 122.1241 60.2754 38.5622 174.9186 40 N 5.2308 9.5429 123.9784 51.4785 42.3074 173.6594 41 V 5.0099 8.4965 121.2246 61.1009 35.3234 174.2397 42 L 4.7468 8.9513 128.4553 53.3171 44.9827 174.5033 43 L 4.9519 8.6540 128.9811 53.4322 43.7558 175.7828 44 V 4.4093 8.8717 125.8908 60.1064 34.2691 174.4262 45 E 5.1279 8.7856 124.7560 55.6362 31.3915 175.0278 46 H 5.0910 9.2585 118.7887 53.7468 33.9559 172.7796 47 A 4.4230 8.5104 122.7041 51.7837 19.3826 178.3846 48 E 3.8963 9.1489 121.7626 59.6576 29.6975 179.6113 49 A 4.1140 8.0820 119.4842 55.1484 18.3621 177.6872 50 N 4.7143 8.2629 111.1154 53.7573 38.9233 174.8070 51 M 4.6651 8.0953 118.7416 53.4638 34.6501 175.7171 52 S 4.4315 8.3583 116.4316 57.1526 64.0175 172.8957 53 I 4.3268 8.2480 129.1509 60.7019 38.5400 176.3345 54 S 3.3896 9.3389 121.0492 59.8158 59.9599 172.3871 55 G 3.9111 8.3265 104.5348 46.5094 0.0000 174.7928 56 R 4.1548 7.5821 123.2110 56.0650 30.1514 176.4112 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 P 0.00 4.45 0.00 2.16 2.28 0.00 3.62 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 3 F 8.95 5.29 0.00 2.99 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 4 I 9.05 4.15 1.80 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 1.07 0.32 0.82 0.00 0.00 5 E 8.33 4.73 0.00 1.35 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.15 0.00 6 C 9.22 4.76 0.00 2.77 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 H 8.91 5.57 0.00 3.02 3.24 0.00 5.64 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 8 I 8.59 4.85 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 1.25 0.91 0.00 0.00 9 A 8.40 5.14 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 10 T 8.23 4.25 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 1.21 0.00 0.00 11 G 8.82 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 12 L 7.64 4.31 0.00 1.65 1.60 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.33 4.41 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 14 V 8.40 3.57 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 0.79 0.00 0.00 0.96 0.00 0.00 15 A 7.93 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 R 8.15 3.90 0.00 1.94 2.08 0.00 3.14 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 17 K 8.33 4.07 0.00 1.97 1.83 0.00 1.71 0.00 0.00 1.80 0.00 0.00 3.13 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.58 7.81 18 Q 8.02 3.96 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.76 0.00 0.00 0.00 0.00 0.00 2.72 2.51 0.00 19 Q 8.05 3.96 0.00 2.17 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 20 L 7.89 3.93 0.00 1.88 1.82 0.91 0.92 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 21 I 7.88 3.75 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 1.03 0.92 0.00 0.00 22 R 8.31 3.88 0.00 2.07 2.00 0.00 3.09 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 1.67 0.00 23 D 8.55 4.44 0.00 2.86 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 24 V 7.87 3.70 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 0.87 0.00 0.00 1.00 0.00 0.00 25 I 7.66 3.64 2.02 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 1.74 0.99 0.92 0.00 0.00 26 D 8.10 4.34 0.00 2.72 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 27 V 8.16 3.62 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 0.79 0.00 0.00 0.93 0.00 0.00 28 T 8.04 3.98 4.46 0.00 0.00 0.00 0.00 0.00 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 29 N 8.50 4.67 0.00 2.71 2.82 0.00 0.00 6.72 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 8.29 4.28 0.00 1.83 1.75 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.31 7.81 31 S 7.90 4.61 0.00 4.05 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 32 I 8.04 4.21 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 1.46 0.61 0.92 0.00 0.00 33 G 8.10 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.79 4.14 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 35 D 8.66 4.62 0.00 2.75 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.31 0.00 2.26 2.33 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.02 0.00 37 K 8.09 4.24 0.00 1.97 1.90 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.70 7.81 38 I 8.09 4.46 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 1.59 0.69 0.92 0.00 0.00 39 I 7.32 4.68 2.02 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 40 N 9.54 5.23 0.00 2.76 2.76 0.00 0.00 6.03 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.50 5.01 2.12 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 0.77 0.00 0.00 0.96 0.00 0.00 42 L 8.95 4.75 0.00 1.96 1.48 1.07 0.60 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 43 L 8.65 4.95 0.00 1.68 1.53 0.91 0.92 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 44 V 8.87 4.41 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.84 0.00 0.00 45 E 8.79 5.13 0.00 1.83 1.89 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 2.24 2.30 0.00 46 H 9.26 5.09 0.00 2.99 3.14 0.00 5.61 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 47 A 8.51 4.42 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 48 E 9.15 3.90 0.00 2.01 2.05 0.00 0.00 0.00 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 49 A 8.08 4.11 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 50 N 8.26 4.71 0.00 2.85 2.86 0.00 0.00 6.82 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 M 8.10 4.67 0.00 1.90 2.02 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.35 0.00 52 S 8.36 4.43 0.00 3.75 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 8.25 4.33 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 0.85 0.90 0.00 0.00 54 S 9.34 3.39 0.00 4.01 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 55 G 8.33 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 56 R 7.58 4.15 0.00 1.84 1.84 0.00 3.19 0.00 0.00 3.44 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00