NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.3873 8.1749 111.0786 61.7627 70.7654 172.2721 3 I 4.3300 8.3185 122.6231 58.7303 39.3462 173.3277 4 Q 5.1711 9.4956 128.6598 54.3462 32.0062 173.9513 5 L 4.9949 8.9655 124.6559 53.2898 46.7714 175.2210 6 T 4.8846 8.3770 116.4235 62.0640 71.6885 173.6263 7 V 4.6109 8.7300 126.5507 60.1236 31.5922 174.0601 8 P 4.3664 0.0000 0.0000 64.4365 31.6929 177.2845 9 T 4.4372 7.7160 107.0645 61.3232 68.9742 174.7445 10 I 3.8662 7.5811 123.6216 61.8358 36.2897 175.6204 11 A 4.3839 8.3563 129.0190 53.4325 19.8781 176.2741 12 C 4.6337 7.3461 109.5575 56.5480 33.2705 174.1451 13 E 3.9179 8.6006 119.9385 59.3417 29.0547 178.2367 14 A 4.0951 8.0293 120.4480 55.3388 18.3509 179.3008 15 C 4.1031 8.0326 114.5618 62.7922 28.2623 175.8134 16 A 3.9347 7.9128 122.4058 55.2369 17.8703 179.3436 17 E 3.8391 8.7051 117.9620 59.2409 29.6184 178.9196 18 A 3.9620 8.0549 120.9351 55.1585 18.4997 179.7574 19 V 3.5302 7.9655 116.9003 66.3447 31.4692 178.3447 20 T 3.8612 8.1124 115.5934 66.7262 68.3214 176.7788 21 K 3.9649 8.3742 120.3320 59.3141 31.7892 179.2755 22 A 3.9943 8.1535 120.7644 55.0269 18.5886 179.6383 23 V 3.6761 7.8818 116.6994 66.3812 31.6380 178.4362 24 Q 4.3514 8.4373 117.7745 58.7363 28.2408 178.3726 25 N 4.5135 8.2354 116.8527 55.5006 38.5590 176.2518 26 E 4.6643 7.9751 118.8103 56.3681 30.7347 175.3894 27 D 4.4760 7.6437 117.1188 52.0813 42.4529 175.1896 28 A 4.1698 8.4808 129.5984 54.2065 18.5601 178.1100 29 Q 4.2184 8.1268 112.8352 56.5648 29.2343 176.2315 30 A 4.5891 7.8610 121.1315 52.1584 19.1562 177.1561 31 T 4.7455 8.9647 110.5173 59.9092 72.4667 173.1112 32 V 4.9047 8.2697 121.9276 61.3611 34.9316 173.9934 33 Q 4.7066 9.1542 128.3152 54.2253 32.1547 174.0327 34 V 4.8678 8.3495 124.8249 61.1379 34.7803 173.6915 35 D 4.8563 8.8199 127.6180 52.8030 42.2733 176.9475 36 L 4.2817 8.8004 125.3524 56.4817 42.3505 177.6227 37 T 4.3664 8.0535 114.6749 65.1366 69.6592 176.1700 38 S 4.1722 8.5264 114.5201 59.0348 63.5277 175.1650 39 K 3.9840 8.2774 119.3605 56.7181 30.0473 175.0197 40 K 4.5645 7.7785 119.6532 56.2078 33.3431 176.0764 41 V 4.6559 9.1617 125.4687 61.5561 33.8043 174.2719 42 T 4.9343 9.0801 125.9231 61.9640 70.8816 173.4575 43 I 4.8327 8.9472 128.0473 59.7058 40.4224 174.8549 44 T 4.8853 8.6837 124.5060 62.5242 70.1859 173.5923 45 S 4.8894 8.1946 119.3946 57.7451 65.4036 175.1175 46 A 4.2416 9.1479 122.1263 53.1364 18.5769 178.0050 47 L 4.3954 7.7039 116.4820 54.0598 42.5891 177.7985 48 G 3.9762 8.9645 109.6512 43.5123 0.0000 174.6415 49 E 3.9424 8.5342 119.5149 59.1403 29.5397 178.4029 50 E 3.9464 8.1228 118.1229 59.6287 29.5738 179.1144 51 Q 4.0233 8.0478 117.3942 59.0870 28.7456 178.9552 52 L 3.9955 8.1561 120.0187 57.6984 41.6157 179.6303 53 R 3.9182 8.3560 118.4759 59.7242 30.0452 179.3098 54 T 3.8726 8.0645 115.1841 66.4338 68.1930 176.7343 55 A 4.0097 8.0270 122.0128 55.3312 18.8583 179.5145 56 I 3.8140 8.0987 118.2694 64.3492 37.1570 178.5407 57 A 4.5469 8.2082 123.0135 54.5477 17.9247 179.7061 58 S 4.1988 8.1014 112.6825 60.9795 62.9714 175.7372 59 A 4.2963 7.5903 121.3080 52.5476 18.0770 178.0342 60 G 3.8515 8.0841 105.7736 45.5493 0.0000 173.2076 61 H 4.9183 7.7010 115.9571 53.1226 31.7321 173.5098 62 E 4.3664 8.6051 120.6214 56.1546 30.3013 176.1097 63 V 4.5133 7.8794 118.8364 60.7199 33.9127 175.2678 64 E 4.1539 8.9802 125.9739 56.8539 29.1820 176.7220 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 T 8.17 4.39 4.38 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 1.21 0.00 0.00 3 I 8.32 4.33 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 1.11 0.73 0.91 0.00 0.00 4 Q 9.50 5.17 0.00 2.01 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.81 0.00 0.00 0.00 0.00 0.00 2.21 2.47 0.00 5 L 8.97 4.99 0.00 1.57 1.48 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 6 T 8.38 4.88 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 7 V 8.73 4.61 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 1.05 0.00 0.00 0.92 0.00 0.00 8 P 0.00 4.37 0.00 2.09 2.11 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 9 T 7.72 4.44 4.28 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 1.23 0.00 0.00 10 I 7.58 3.87 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.42 0.90 0.00 0.00 11 A 8.36 4.38 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 12 C 7.35 4.63 0.00 3.10 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 13 E 8.60 3.92 0.00 2.09 1.99 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 2.37 2.44 0.00 14 A 8.03 4.10 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 15 C 8.03 4.10 0.00 3.11 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 16 A 7.91 3.93 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 17 E 8.71 3.84 0.00 2.04 1.95 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 2.30 2.37 0.00 18 A 8.05 3.96 1.41 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 0.00 0.00 19 V 7.97 3.53 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 1.00 0.00 0.00 0.84 0.00 0.00 20 T 8.11 3.86 4.54 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 1.26 0.00 0.00 21 K 8.37 3.96 0.00 1.92 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.71 7.81 22 A 8.15 3.99 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 23 V 7.88 3.68 2.21 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 1.02 0.00 0.00 0.96 0.00 0.00 24 Q 8.44 4.35 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 25 N 8.24 4.51 0.00 2.88 2.88 0.00 0.00 6.94 7.23 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 26 E 7.98 4.66 0.00 2.07 1.99 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 2.28 2.44 0.00 27 D 7.64 4.48 0.00 2.68 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 8.48 4.17 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 29 Q 8.13 4.22 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 30 A 7.86 4.59 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 31 T 8.96 4.75 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 32 V 8.27 4.90 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 0.79 0.00 0.00 0.93 0.00 0.00 33 Q 9.15 4.71 0.00 2.08 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.54 0.00 0.00 0.00 0.00 0.00 2.23 2.40 0.00 34 V 8.35 4.87 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 0.82 0.00 0.00 0.91 0.00 0.00 35 D 8.82 4.86 0.00 2.83 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.80 4.28 0.00 1.67 1.70 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.05 4.37 4.35 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 1.21 0.00 0.00 38 S 8.53 4.17 0.00 3.96 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 39 K 8.28 3.98 0.00 2.00 2.08 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.54 7.81 40 K 7.78 4.56 0.00 1.70 1.73 0.00 1.61 0.00 0.00 1.72 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.38 7.81 41 V 9.16 4.66 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 1.03 0.00 0.00 0.91 0.00 0.00 42 T 9.08 4.93 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 43 I 8.95 4.83 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 1.22 0.93 0.91 0.00 0.00 44 T 8.68 4.89 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 45 S 8.19 4.89 0.00 4.03 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 46 A 9.15 4.24 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.70 4.40 0.00 1.67 1.60 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.96 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.53 3.94 0.00 2.04 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 2.38 2.40 0.00 50 E 8.12 3.95 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 51 Q 8.05 4.02 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.92 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 52 L 8.16 4.00 0.00 1.83 1.71 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.36 3.92 0.00 1.98 1.98 0.00 3.13 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 1.65 1.81 0.00 54 T 8.06 3.87 4.38 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 1.21 0.00 0.00 55 A 8.03 4.01 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.10 3.81 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 1.46 1.19 0.97 0.00 0.00 57 A 8.21 4.55 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.10 4.20 0.00 4.07 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 59 A 7.59 4.30 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.08 3.85 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 0.00 0.00 0.00 61 H 7.70 4.92 0.00 3.16 3.16 0.00 5.62 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.61 4.37 0.00 2.34 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 2.27 1.86 0.00 63 V 7.88 4.51 2.09 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 0.92 0.00 0.00 0.94 0.00 0.00 64 E 8.98 4.15 0.00 2.33 1.86 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 2.35 2.13 0.00