NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 D 4.4758 8.3644 120.5315 53.8234 42.8837 174.8240 25 H 4.6165 8.0539 119.3053 52.7328 30.5768 171.2283 26 H 4.6057 9.1686 125.2293 57.5940 30.2244 176.0349 27 Y 3.2204 7.0478 118.5928 60.5915 37.2848 178.2436 28 A 4.3169 7.6998 120.2720 55.0892 18.4694 178.6271 29 M 4.3302 8.1122 115.4240 56.7836 32.6316 177.8157 30 W 4.3434 8.8684 119.5285 57.6497 29.3681 177.6869 31 D 4.5015 8.2274 119.7065 56.7169 38.6115 178.5200 32 A 4.0270 7.9693 121.3474 54.5374 18.6245 179.0512 33 A 3.8879 7.9712 118.8596 55.4878 18.3450 179.1580 34 Y 3.9462 7.9798 117.7801 60.9929 38.7924 178.3898 35 V 3.5246 7.7564 117.3477 65.0898 31.7029 176.8944 36 L 4.4059 7.7533 116.5960 53.8809 41.8155 176.8844 37 G 3.6957 7.5651 106.7471 46.5022 0.0000 174.3647 38 A 4.4633 8.1401 120.9874 51.4311 19.6484 178.4925 39 L 4.1119 7.5704 116.5444 53.7894 42.6339 177.7016 40 S 4.2937 8.3832 116.9960 58.0079 65.0307 175.1131 41 A 3.9943 8.6895 124.1593 55.6587 17.8791 180.0309 42 A 3.9970 7.9624 118.2525 55.4446 18.6427 179.3427 43 D 4.6122 8.2035 117.4519 57.6608 40.8368 178.9505 44 R 4.1914 8.5380 119.5732 59.5348 30.0633 178.4546 45 R 3.9164 7.9956 117.8646 59.5239 30.1605 177.9770 46 E 3.9487 8.6519 119.4779 59.4321 29.5696 178.6169 47 F 3.8296 9.0065 120.9536 61.2003 39.5531 177.0125 48 E 3.6712 8.5941 118.3326 58.9298 28.9343 179.2511 49 A 3.8495 7.6326 120.2861 55.3799 18.9011 178.6749 50 H 3.9376 7.6546 116.7148 59.3990 29.6325 177.3666 51 L 3.5489 7.5488 120.7557 57.5163 41.1005 179.2489 52 A 4.0859 7.5436 119.5472 54.0279 18.2018 178.3858 53 G 3.9094 7.4133 103.8385 45.1457 0.0000 173.8639 54 C 4.4416 7.6759 120.6404 55.6147 33.0039 172.1245 55 P 4.2748 0.0000 0.0000 65.0095 30.8657 178.2731 56 E 3.9458 8.0288 117.5245 59.7783 29.7129 178.7588 57 C 4.2227 8.0242 117.7638 62.1905 28.1959 175.9395 58 R 3.9569 8.0784 119.8725 59.4538 29.7159 179.3900 59 G 3.5933 8.2158 105.0077 47.4447 0.0000 175.6392 60 A 4.2242 8.0639 122.6312 55.3867 18.9315 179.8062 61 V 3.8670 8.2620 111.2826 64.8717 31.7390 178.8906 62 T 3.9307 8.1988 115.6027 66.8688 68.1003 176.4068 63 E 4.1144 8.2060 119.1526 59.0229 29.7564 178.6700 64 L 4.4245 7.8106 117.3096 55.7982 41.6252 178.5788 65 C 4.2922 7.8462 114.3728 61.1488 29.0438 175.7090 66 G 3.7599 8.0949 106.6400 46.2174 0.0000 175.4157 67 V 3.6786 7.9376 121.1937 65.5592 31.8077 175.9797 68 P 4.2939 0.0000 0.0000 65.6370 30.8638 178.3093 69 A 4.0066 7.2491 115.5791 55.1912 18.5542 179.3469 70 L 4.1387 7.5819 116.3493 57.7052 41.9877 179.5439 71 L 4.1371 8.4552 119.3857 57.1067 41.3085 178.7702 72 S 4.4823 7.7591 112.3498 59.4924 63.3604 175.3424 73 Q 4.2745 7.7387 120.9262 56.2688 28.7787 175.3974 74 L 4.9345 6.8795 118.3772 52.1972 45.8765 176.1024 75 D 4.8527 8.5627 121.4333 51.9119 42.6466 177.8588 76 R 3.9830 8.4172 116.7076 59.0438 29.1375 178.3180 77 D 4.4098 8.0677 119.4708 56.9545 40.9430 178.1390 78 E 3.9883 8.2608 118.6710 59.3858 29.5050 179.6342 79 V 3.6964 7.6900 118.1690 65.6796 31.3982 177.9526 80 A 3.9921 7.8453 119.5857 55.0164 18.2578 179.0583 81 A 4.0848 7.7531 118.4468 55.4610 18.5205 179.6339 82 I 3.8512 7.2018 115.9357 63.9676 38.5766 178.4135 83 S 4.5188 7.6683 116.1476 55.7849 59.1500 174.2092 84 E 4.6395 7.6516 123.9730 57.2173 30.3194 176.9409 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 24 D 8.36 4.48 0.00 2.68 2.81 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 0.00 0.00 0.00 25 H 8.05 4.62 0.00 3.09 3.22 0.00 5.91 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 H 9.17 4.61 0.00 3.38 3.42 0.00 5.55 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 7.05 3.22 0.00 2.60 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 7.70 4.32 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 29 M 8.11 4.33 0.00 2.12 2.45 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.79 0.00 30 W 8.87 4.34 0.00 2.72 2.59 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 31 D 8.23 4.50 0.00 3.02 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 32 A 7.97 4.03 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 33 A 7.97 3.89 1.21 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 0.00 0.00 34 Y 7.98 3.95 0.00 2.92 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 35 V 7.76 3.52 2.32 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 0.90 0.00 0.00 1.08 0.00 0.00 36 L 7.75 4.41 0.00 1.68 1.64 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 37 G 7.57 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 0.00 0.00 0.00 38 A 8.14 4.46 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.57 4.11 0.00 1.67 1.65 0.62 1.06 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 40 S 8.38 4.29 0.00 4.04 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 41 A 8.69 3.99 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.96 4.00 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 43 D 8.20 4.61 0.00 2.91 2.69 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 44 R 8.54 4.19 0.00 2.05 2.25 0.00 3.21 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.05 0.00 45 R 8.00 3.92 0.00 2.29 2.06 0.00 3.20 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 46 E 8.65 3.95 0.00 2.28 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 0.00 2.35 2.43 0.00 47 F 9.01 3.83 0.00 3.37 3.22 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 48 E 8.59 3.67 0.00 2.20 1.93 0.00 0.00 0.00 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 2.55 0.00 49 A 7.63 3.85 1.26 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 50 H 7.65 3.94 0.00 2.41 2.64 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.55 3.55 0.00 1.46 1.37 0.26 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.54 4.09 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 53 G 7.41 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 54 C 7.68 4.44 0.00 2.55 2.41 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 55 P 0.00 4.27 0.00 2.27 2.26 0.00 3.67 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.98 0.00 56 E 8.03 3.95 0.00 2.24 2.27 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 2.39 2.38 0.00 57 C 8.02 4.22 0.00 3.03 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 58 R 8.08 3.96 0.00 1.80 1.95 0.00 3.07 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 59 G 8.22 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 60 A 8.06 4.22 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 61 V 8.26 3.87 2.33 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 1.19 0.00 0.00 1.05 0.00 0.00 62 T 8.20 3.93 4.43 0.00 0.00 0.00 0.00 0.00 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 63 E 8.21 4.11 0.00 2.16 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 2.37 2.66 0.00 64 L 7.81 4.42 0.00 1.79 1.74 1.03 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 65 C 7.85 4.29 0.00 3.26 3.25 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 0.00 66 G 8.09 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 67 V 7.94 3.68 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 1.05 0.00 0.00 0.98 0.00 0.00 68 P 0.00 4.29 0.00 2.18 2.08 0.00 3.88 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 69 A 7.25 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 70 L 7.58 4.14 0.00 1.89 1.72 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 71 L 8.46 4.14 0.00 1.97 1.71 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.76 4.48 0.00 4.04 4.08 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 0.00 0.00 0.00 0.00 73 Q 7.74 4.27 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.64 0.00 74 L 6.88 4.93 0.00 1.65 1.60 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 75 D 8.56 4.85 0.00 2.88 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.42 3.98 0.00 2.05 2.23 0.00 2.94 0.00 0.00 3.33 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 77 D 8.07 4.41 0.00 2.92 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.26 3.99 0.00 2.19 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 2.33 2.43 0.00 79 V 7.69 3.70 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 1.00 0.00 0.00 0.99 0.00 0.00 80 A 7.85 3.99 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 81 A 7.75 4.08 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 I 7.20 3.85 2.03 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 1.52 0.66 0.91 0.00 0.00 83 S 7.67 4.52 0.00 4.00 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 84 E 7.65 4.64 0.00 2.05 1.79 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 2.05 2.11 0.00