NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.5497 0.0000 0.0000 62.8088 33.7993 174.3700 2 M 4.8763 8.0912 119.7288 53.7746 34.0884 174.8510 3 F 5.0104 9.3235 120.3520 55.7704 44.4209 172.8017 4 E 5.1240 9.1739 122.6494 54.0882 32.2500 174.9583 5 A 4.4943 8.9020 128.8819 52.4250 18.8907 177.9162 6 A 4.1045 9.0789 124.8336 53.1980 19.6741 176.8949 7 Y 4.7514 7.5877 110.9999 55.8914 42.1960 175.0498 8 D 4.7166 8.9322 121.9177 54.9838 41.9592 176.3833 9 F 5.0285 9.6257 124.8402 55.7442 40.6201 173.1662 10 P 3.9776 0.0000 0.0000 63.2739 31.7129 176.8368 11 G 3.2382 6.5076 104.3513 46.9113 0.0000 174.0747 12 S 4.4617 7.7673 113.1811 58.6127 64.0758 176.4385 13 G 3.7691 8.2115 109.8109 48.2950 0.0000 173.6371 14 S 4.5877 7.5724 112.3220 56.2332 65.3886 173.3162 15 P 4.4454 0.0000 0.0000 64.6378 31.4110 177.2247 16 S 4.4223 7.9635 113.2092 59.2592 63.6810 173.5089 17 E 5.0272 7.9194 121.3209 55.7001 31.5199 175.2119 18 L 4.8839 8.6821 124.1073 52.6803 43.4353 174.4294 19 P 4.7178 0.0000 0.0000 62.8564 32.1265 176.1333 20 L 5.0000 9.2616 122.7854 53.0808 46.2955 175.7463 21 K 4.9521 8.9792 121.6420 54.4402 34.4709 176.2675 22 K 4.1358 8.8126 124.6550 58.5030 32.3568 177.0263 23 G 4.1525 8.8424 114.5250 44.7260 0.0000 173.1799 24 D 4.5367 8.2309 121.1422 54.0959 41.8203 175.5935 25 V 4.5775 8.3207 124.4459 61.8713 32.7107 174.8358 26 I 4.7426 8.6424 120.2833 59.3113 41.9758 173.5631 27 Y 4.9734 8.8043 120.2733 57.5813 39.3413 174.8646 28 I 5.0919 8.8666 124.2290 60.0351 39.0203 175.4339 29 T 4.5276 8.6339 116.9124 62.7567 70.7826 175.3764 30 R 4.8023 7.7718 119.3705 54.4854 34.9392 173.8707 31 E 5.0964 8.9068 121.9453 54.7071 32.0986 175.2653 32 E 4.9247 9.0764 124.0874 53.7518 32.3722 175.4331 33 P 4.4499 0.0000 0.0000 64.4908 31.4674 177.4544 34 S 4.1724 7.8791 113.3650 59.7504 63.5785 175.0881 35 G 3.7622 8.4845 110.2789 44.5710 0.0000 172.4946 36 W 5.1762 7.6811 118.4917 54.8975 32.0707 175.1310 37 S 5.3796 9.3310 118.9974 56.7521 66.2577 173.0553 38 L 4.0304 8.8082 126.0426 54.0348 42.8023 175.7202 39 G 4.5333 8.7932 113.8452 44.4024 0.0000 171.4029 40 K 5.1353 8.8041 120.9839 54.2607 35.9517 175.7688 41 L 4.4523 8.9121 127.2337 54.6347 42.2854 178.5171 42 L 4.1208 8.7270 121.9410 57.5363 41.7464 177.8250 43 D 4.5784 8.1873 115.9279 52.7336 39.7483 176.9645 44 G 3.9534 8.2888 107.8865 46.4446 0.0000 175.0800 45 S 4.3575 8.3623 115.0386 59.7504 63.7801 174.2693 46 K 4.5728 7.5375 120.7014 55.1851 34.7497 173.5086 47 E 5.0459 8.3937 121.3650 54.6191 33.1332 174.1748 48 G 3.8208 7.9477 107.4585 46.0407 0.0000 171.5365 49 W 5.2741 8.1858 120.0598 56.5181 30.2925 176.6835 50 V 4.6011 9.1849 116.4823 58.6343 36.0865 173.4171 51 P 3.8116 0.0000 0.0000 62.2654 31.8928 177.6484 52 T 3.6708 8.2745 120.6747 66.7074 68.5065 176.3257 53 A 4.1584 7.6763 121.9891 54.5721 18.6547 177.5750 54 Y 4.6008 8.1401 113.0670 59.2973 38.4788 174.5838 55 M 5.1948 7.8628 120.3571 53.4128 33.5917 175.6155 56 K 4.8416 8.9078 123.0899 54.0941 35.7897 173.9089 57 P 4.2897 0.0000 0.0000 63.6716 32.0186 175.6835 58 H 4.4549 8.0320 122.6719 56.2754 29.6499 173.0906 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 4.55 0.00 1.83 1.97 0.00 3.99 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 2 M 8.09 4.88 0.00 1.84 1.82 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.74 0.00 3 F 9.32 5.01 0.00 2.89 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 4 E 9.17 5.12 0.00 1.99 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 2.20 2.33 0.00 5 A 8.90 4.49 1.46 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 0.00 0.00 0.00 6 A 9.08 4.10 0.96 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 0.00 0.00 7 Y 7.59 4.75 0.00 2.21 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 8 D 8.93 4.72 0.00 2.67 2.71 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 0.00 0.00 0.00 0.00 9 F 9.63 5.03 0.00 3.35 3.11 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 0.00 0.00 0.00 0.00 10 P 0.00 3.98 0.00 1.95 2.04 0.00 3.83 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 11 G 6.51 3.24 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 0.00 12 S 7.77 4.46 0.00 3.83 3.88 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 13 G 8.21 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.57 4.59 0.00 3.94 3.88 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 15 P 0.00 4.45 0.00 2.20 2.21 0.00 3.74 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 16 S 7.96 4.42 0.00 4.20 4.20 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 17 E 7.92 5.03 0.00 2.17 2.26 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 2.24 2.20 0.00 18 L 8.68 4.88 0.00 1.59 1.72 0.96 0.93 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 19 P 0.00 4.72 0.00 2.00 2.09 0.00 3.72 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 20 L 9.26 5.00 0.00 1.80 1.64 1.05 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 21 K 8.98 4.95 0.00 1.86 1.74 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.54 7.81 22 K 8.81 4.14 0.00 1.70 1.74 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.43 7.81 23 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 24 D 8.23 4.54 0.00 2.74 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 25 V 8.32 4.58 1.91 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 0.49 0.00 0.00 0.63 0.00 0.00 26 I 8.64 4.74 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.73 0.94 0.00 0.00 27 Y 8.80 4.97 0.00 2.98 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.87 5.09 1.78 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.68 0.77 0.00 0.00 29 T 8.63 4.53 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 1.20 0.00 0.00 30 R 7.77 4.80 0.00 1.80 1.89 0.00 3.27 0.00 0.00 3.38 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 31 E 8.91 5.10 0.00 1.81 1.82 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 2.11 2.24 0.00 32 E 9.08 4.92 0.00 1.96 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.42 0.00 33 P 0.00 4.45 0.00 2.17 2.17 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 34 S 7.88 4.17 0.00 4.11 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 35 G 8.48 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 0.00 0.00 0.00 36 W 7.68 5.18 0.00 3.04 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 37 S 9.33 5.38 0.00 3.72 3.70 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 38 L 8.81 4.03 0.00 0.98 1.34 0.17 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 39 G 8.79 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.80 5.14 0.00 1.81 1.70 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.59 7.81 41 L 8.91 4.45 0.00 1.77 1.60 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.73 4.12 0.00 1.64 1.77 0.78 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.19 4.58 0.00 2.80 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 44 G 8.29 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 45 S 8.36 4.36 0.00 4.02 4.11 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 0.00 0.00 0.00 0.00 46 K 7.54 4.57 0.00 1.77 1.64 0.00 1.69 0.00 0.00 1.89 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.42 7.81 47 E 8.39 5.05 0.00 2.11 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 2.09 2.16 0.00 48 G 7.95 3.82 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 0.00 0.00 0.00 49 W 8.19 5.27 0.00 3.11 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 50 V 9.18 4.60 1.88 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 0.93 0.00 0.00 0.97 0.00 0.00 51 P 0.00 3.81 0.00 0.89 0.90 0.00 2.43 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.71 0.00 52 T 8.27 3.67 4.10 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 1.12 0.00 0.00 53 A 7.68 4.16 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 54 Y 8.14 4.60 0.00 3.09 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 55 M 7.86 5.19 0.00 1.92 1.87 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.77 0.00 56 K 8.91 4.84 0.00 1.85 1.95 0.00 1.33 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.57 1.42 7.81 57 P 0.00 4.29 0.00 1.94 1.98 0.00 3.69 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.23 0.00 58 H 8.03 4.45 0.00 2.97 3.05 0.00 5.98 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00