NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 P 4.2914 0.0000 0.0000 62.1416 32.6572 177.1449 20 S 4.0736 8.5189 113.6452 58.5702 62.5951 172.3887 21 N 4.8337 9.7101 120.7618 54.6530 45.7800 176.0481 22 A 4.2887 7.9333 119.9202 52.8390 18.8792 177.5177 23 T 3.8468 9.0809 118.2711 65.6385 68.6145 174.9897 24 F 5.2335 7.6688 117.1563 55.4446 42.4786 174.0804 25 G 4.3369 9.7158 110.9161 43.3571 0.0000 172.5486 26 M 4.3896 8.5078 119.3606 57.0446 32.2763 177.2216 27 G 4.0405 9.0475 112.3829 45.1167 0.0000 173.6899 28 D 4.4424 8.2221 120.4008 54.7252 42.2567 175.4938 29 R 4.7578 8.4396 122.5880 55.3026 31.8587 175.4347 30 V 4.9752 8.8412 119.1871 59.7174 36.8174 174.2173 31 R 5.1110 8.5694 116.8162 54.5521 33.2846 174.4782 32 K 4.5110 8.5724 119.7879 56.0549 32.1343 178.1315 33 K 4.0889 8.8044 124.5074 59.3500 32.2029 176.8739 34 S 4.4881 7.8806 110.6284 57.9479 66.2164 175.8497 35 G 3.6480 8.5698 107.8846 45.8151 0.0000 173.7161 36 A 4.0334 8.6722 126.0670 52.5442 18.9599 177.0098 37 A 4.5952 8.3236 123.1716 51.5051 20.5129 176.5910 38 W 4.6591 8.3671 125.5992 56.8625 34.3133 172.9820 39 Q 4.8889 7.0537 126.1851 54.3017 32.1509 174.3327 40 G 4.5298 7.9488 111.3144 45.9693 0.0000 170.6651 41 Q 5.1037 7.7373 117.5578 54.4605 31.5488 175.3102 42 I 4.4603 8.5304 122.9607 61.8504 37.9138 176.7099 43 V 4.5125 8.9324 118.8620 60.4338 33.6971 175.4021 44 G 4.2176 7.8652 106.5855 46.7494 0.0000 171.8083 45 W 5.7309 8.9463 127.9930 56.7674 33.8442 173.5391 46 Y 4.4519 6.8598 121.2306 56.1106 41.3459 173.1445 47 C 4.7591 8.0512 120.1091 58.4060 34.2590 172.7758 48 T 4.7100 8.5895 115.4152 59.8697 72.1522 174.6787 49 N 4.3385 8.8693 118.5264 56.3083 38.7406 176.7761 50 L 4.1303 7.9187 118.8807 57.5664 42.6528 176.7933 51 T 4.4905 8.0157 115.9912 60.5163 68.4987 172.4848 52 P 4.2337 0.0000 0.0000 63.6407 32.1033 177.1302 53 E 3.9352 7.5692 120.5986 54.8147 31.9668 173.6897 54 G 3.5904 6.9901 113.5882 44.0959 0.0000 169.5033 55 Y 5.5284 9.0367 117.1123 56.0302 42.6640 174.2597 56 A 5.1491 9.0311 123.9310 50.5277 21.8676 176.2009 57 V 4.9643 9.0272 121.5905 61.1733 35.1760 173.8304 58 E 5.1104 9.0852 129.7429 55.0915 30.7985 175.4456 59 S 4.2583 8.8717 122.8725 58.5008 62.5683 174.0863 60 E 4.0971 8.7548 123.5281 57.4287 30.0471 177.2818 61 A 4.2013 7.4301 122.0064 53.4998 19.6541 177.0057 62 H 4.8338 7.3816 112.6735 52.3660 29.2711 169.8313 63 P 4.4109 0.0000 0.0000 64.1801 31.8577 176.4452 64 G 4.0462 9.6456 111.6812 45.1396 0.0000 173.5613 65 S 4.6854 8.0959 116.8271 57.7091 64.0420 173.6227 66 V 5.2315 8.5778 124.5219 61.1726 34.0977 174.2804 67 Q 4.3336 8.8656 127.1379 53.9150 32.4490 173.6183 68 I 4.8852 7.4439 117.3492 59.5127 39.7567 174.2131 69 Y 5.0647 9.0068 121.3871 55.9888 42.9845 173.0227 70 P 4.6285 0.0000 0.0000 61.9679 32.6438 177.8713 71 V 3.9519 8.6316 121.3365 65.1859 31.1824 178.4971 72 A 4.0176 8.1977 121.5207 54.6907 18.4166 178.0675 73 A 4.2409 8.4647 117.7987 53.4960 18.9955 176.6979 74 L 5.4533 7.8279 115.5600 52.8820 44.6245 176.0327 75 E 4.9171 8.8010 118.7347 54.4930 33.1393 174.8150 76 R 4.3473 8.9401 123.3493 56.4007 31.2416 175.9230 77 I 4.2549 8.4555 120.3109 59.3428 38.3561 175.4587 78 N 4.5138 8.5313 124.0089 53.5067 38.5760 175.5210 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 19 P 0.00 4.29 0.00 1.99 1.79 0.00 3.53 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 1.69 1.74 0.00 20 S 8.52 4.07 0.00 4.02 3.94 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 0.00 0.00 0.00 0.00 21 N 9.71 4.83 0.00 2.41 2.73 0.00 0.00 7.00 7.84 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 22 A 7.93 4.29 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 23 T 9.08 3.85 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 24 F 7.67 5.23 0.00 2.30 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.72 4.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 M 8.51 4.39 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.58 0.00 27 G 9.05 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.22 4.44 0.00 2.51 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 8.44 4.76 0.00 1.84 1.74 0.00 3.08 0.00 0.00 3.29 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 30 V 8.84 4.98 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 0.00 0.00 0.85 0.00 0.00 31 R 8.57 5.11 0.00 1.89 1.92 0.00 2.74 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 0.00 32 K 8.57 4.51 0.00 1.59 1.67 0.00 0.61 0.00 0.00 1.55 0.00 0.00 2.44 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.24 0.76 7.81 33 K 8.80 4.09 0.00 1.74 1.87 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.49 1.39 7.81 34 S 7.88 4.49 0.00 3.93 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 35 G 8.57 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 36 A 8.67 4.03 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 37 A 8.32 4.60 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 38 W 8.37 4.66 0.00 3.45 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 39 Q 7.05 4.89 0.00 2.05 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.52 2.47 0.00 40 G 7.95 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 41 Q 7.74 5.10 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 7.05 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 42 I 8.53 4.46 2.03 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.74 1.11 0.00 0.00 43 V 8.93 4.51 2.16 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 0.76 0.00 0.00 1.10 0.00 0.00 44 G 7.87 4.22 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 0.00 45 W 8.95 5.73 0.00 3.54 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 46 Y 6.86 4.45 0.00 2.78 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 47 C 8.05 4.76 0.00 2.49 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 48 T 8.59 4.71 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 1.27 0.00 0.00 49 N 8.87 4.34 0.00 2.70 2.91 0.00 0.00 6.83 7.85 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 50 L 7.92 4.13 0.00 1.58 1.69 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 51 T 8.02 4.49 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 0.80 0.00 0.00 52 P 0.00 4.23 0.00 2.15 2.14 0.00 3.27 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.88 0.00 53 E 7.57 3.94 0.00 2.09 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 2.36 2.74 0.00 54 G 6.99 3.59 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 0.00 55 Y 9.04 5.53 0.00 3.14 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 56 A 9.03 5.15 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 57 V 9.03 4.96 2.55 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 1.30 0.00 0.00 1.22 0.00 0.00 58 E 9.09 5.11 0.00 2.22 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 0.00 2.31 2.46 0.00 59 S 8.87 4.26 0.00 2.72 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 60 E 8.75 4.10 0.00 2.03 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 2.31 2.12 0.00 61 A 7.43 4.20 0.97 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 62 H 7.38 4.83 0.00 3.05 3.16 0.00 5.64 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 4.41 0.00 2.04 2.01 0.00 3.65 0.00 0.00 3.64 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 64 G 9.65 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.10 4.69 0.00 4.12 4.12 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 66 V 8.58 5.23 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 0.81 0.00 0.00 1.07 0.00 0.00 67 Q 8.87 4.33 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.55 0.00 0.00 0.00 0.00 0.00 1.17 1.44 0.00 68 I 7.44 4.89 1.39 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.38 0.61 0.00 0.00 69 Y 9.01 5.06 0.00 3.01 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 70 P 0.00 4.63 0.00 2.23 1.95 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 2.18 2.13 0.00 71 V 8.63 3.95 2.38 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 0.77 0.00 0.00 0.94 0.00 0.00 72 A 8.20 4.02 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 73 A 8.46 4.24 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 74 L 7.83 5.45 0.00 1.95 1.64 0.83 0.96 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 75 E 8.80 4.92 0.00 2.03 2.03 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 2.18 2.23 0.00 76 R 8.94 4.35 0.00 1.98 1.94 0.00 3.23 0.00 0.00 3.36 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 77 I 8.46 4.25 1.84 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 1.24 0.75 0.93 0.00 0.00 78 N 8.53 4.51 0.00 2.74 2.77 0.00 0.00 7.01 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