NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3169 8.1227 123.5820 52.1634 21.0545 178.5885 2 L 3.8890 7.7302 114.9481 57.2575 42.0796 178.0242 3 G 3.6193 8.7998 106.4492 47.9189 0.0000 175.2270 4 K 4.0684 7.9794 121.1887 58.7986 32.0323 179.1756 5 L 3.9784 7.6822 120.7206 58.3131 42.0689 179.0577 6 Q 3.9779 7.8020 117.6520 58.7896 28.5813 178.1583 7 D 4.3002 7.6382 119.1819 57.2960 41.2686 178.3951 8 V 3.5672 7.4174 117.7686 66.0438 31.4734 178.1293 9 V 3.5560 7.9425 117.9048 65.9313 31.4187 177.3373 10 N 4.2529 8.5150 117.1098 57.0122 38.8364 176.8433 11 Q 4.0172 8.1758 119.2974 59.1030 28.7844 178.5446 12 N 4.3989 8.4366 117.3138 55.9093 38.4978 177.4109 13 A 4.1015 8.4463 122.8545 55.1927 18.4468 179.7169 14 Q 3.8991 8.2206 116.2894 59.0779 28.7494 178.8544 15 A 3.9909 8.1037 121.7911 55.0513 18.3160 179.4646 16 L 3.8853 8.4005 119.3184 58.2626 42.3039 178.6800 17 N 4.2846 8.4624 117.3245 56.9421 38.8793 177.0445 18 T 3.8896 7.9452 117.1486 66.6891 68.5630 176.7711 19 L 4.0240 8.2873 121.3301 57.7110 41.5171 179.7553 20 V 3.6379 8.1421 118.6021 65.8742 31.4402 178.2956 21 K 3.9867 7.9844 117.8674 59.4885 31.9005 179.3972 22 Q 4.0086 8.2118 118.3061 58.9297 28.6324 178.7480 23 L 4.1812 8.3581 120.3948 57.9372 41.6520 179.7227 24 S 4.2179 8.3539 115.4525 61.5857 62.2744 177.0010 25 S 4.1098 8.0972 116.7813 61.7069 62.5117 176.3004 26 N 4.3813 8.2814 120.7246 55.7794 38.3392 177.2564 27 F 4.2224 8.9423 122.3726 60.6369 39.4331 177.4353 28 G 3.5988 8.1979 105.7380 47.6182 0.0000 175.5886 29 A 3.9113 7.6040 122.1163 54.9020 18.4157 179.8270 30 I 3.5012 7.3477 118.0488 64.5321 37.1341 178.9456 31 S 3.7927 7.7290 115.2846 61.1176 62.7631 176.5042 32 S 3.9770 7.8139 116.7646 61.3559 62.1567 176.5931 33 V 3.6214 7.4901 114.7072 64.3833 31.1693 178.6237 34 L 3.9645 8.0300 118.8755 57.6535 41.4444 178.9443 35 N 4.2616 8.3442 117.2493 56.7567 38.7721 176.7445 36 D 4.3093 7.8975 119.8832 57.3498 40.9481 178.7663 37 I 3.6878 7.8441 120.3032 64.6074 36.9769 178.6918 38 S 4.4038 8.2946 114.3577 60.4856 62.7102 175.8555 39 G 3.9371 7.7622 106.9789 44.0708 0.0000 174.2533 40 G 3.9116 7.6767 108.3351 46.4734 0.0000 174.5679 41 R 4.2708 8.2207 116.2594 54.9621 30.2945 178.1981 42 G 3.9433 8.4918 108.6353 45.1766 0.0000 173.1015 43 G 4.0159 8.1094 105.3571 44.2933 0.0000 172.4478 44 D 4.5497 8.5798 123.5547 53.0622 41.0162 175.5338 45 I 4.2102 8.1364 119.8534 60.5457 38.0471 175.5747 46 S 4.1772 8.1490 117.8424 60.8722 63.1757 175.2598 47 G 4.0158 8.9880 112.7170 46.1888 0.0000 175.3468 48 I 3.7685 7.8829 121.2100 64.1860 37.0510 177.6759 49 N 4.2651 8.2549 116.7889 56.5672 38.4297 177.0851 50 A 4.0425 7.9461 121.3417 55.2291 18.4719 179.7001 51 S 4.3898 7.9647 114.6817 61.0988 62.8037 177.1165 52 V 3.5951 8.0682 121.2012 65.9644 31.3165 178.1481 53 V 3.5909 7.8660 117.9829 66.1866 31.2573 177.7754 54 N 4.3590 8.2577 116.0634 56.4443 38.3229 177.5208 55 I 4.0822 7.9380 122.6574 63.9134 37.2617 178.4594 56 Q 4.0057 8.3150 119.0313 59.0195 28.4686 179.1685 57 K 4.0358 8.1263 119.4447 59.4548 31.9410 179.3442 58 E 3.9638 8.4518 119.0675 59.2864 29.3631 179.3708 59 I 3.7103 8.0764 120.2158 64.6366 37.2365 178.2141 60 D 4.3847 7.9485 119.0913 57.4840 40.6185 179.1668 61 R 3.9746 8.3589 118.8881 59.0743 29.9704 179.0361 62 L 3.9971 8.4232 119.4059 57.7940 41.6010 179.0169 63 N 4.2853 8.3158 116.9882 56.7197 38.7779 176.8331 64 E 3.9806 8.1071 120.1062 59.1600 29.5319 179.4232 65 V 3.7751 8.1361 119.4794 65.4442 31.6453 177.8869 66 A 3.9890 8.1605 120.6238 55.0792 18.1056 179.5438 67 K 3.9055 8.2115 118.0887 59.6567 32.4066 178.8494 68 N 4.3207 8.3728 116.9038 56.2445 38.2469 177.3851 69 L 3.9758 7.7638 119.1548 57.8340 42.1392 178.8055 70 N 4.4411 8.2380 116.8887 56.8312 38.8777 176.7690 71 E 4.0362 8.5366 120.4660 59.3088 29.2653 179.4615 72 S 4.1328 7.8145 113.2471 61.1664 63.0089 176.1003 73 L 4.2099 7.6682 121.1613 56.6786 41.5407 178.4972 74 I 4.1318 7.4622 118.6020 62.6175 37.8418 175.0606 75 D 4.2017 8.2679 122.6879 54.6982 41.3655 174.7247 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 A 8.12 4.32 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 2 L 7.73 3.89 0.00 1.85 1.67 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 3 G 8.80 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.98 4.07 0.00 1.78 1.87 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.44 7.81 5 L 7.68 3.98 0.00 1.79 1.71 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 6 Q 7.80 3.98 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 7 D 7.64 4.30 0.00 2.73 2.80 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 8 V 7.42 3.57 2.24 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 0.94 0.00 0.00 1.01 0.00 0.00 9 V 7.94 3.56 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 0.97 0.00 0.00 0.97 0.00 0.00 10 N 8.52 4.25 0.00 2.93 2.92 0.00 0.00 7.29 6.83 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 11 Q 8.18 4.02 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 12 N 8.44 4.40 0.00 2.86 2.85 0.00 0.00 6.91 7.16 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 13 A 8.45 4.10 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 14 Q 8.22 3.90 0.00 2.30 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 15 A 8.10 3.99 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 16 L 8.40 3.89 0.00 1.84 1.86 0.91 0.50 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 17 N 8.46 4.28 0.00 2.84 2.94 0.00 0.00 7.25 8.02 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 18 T 7.95 3.89 4.39 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 1.21 0.00 0.00 19 L 8.29 4.02 0.00 1.66 1.71 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.14 3.64 2.14 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 1.11 0.00 0.00 0.98 0.00 0.00 21 K 7.98 3.99 0.00 2.05 1.85 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.58 7.81 22 Q 8.21 4.01 0.00 2.26 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.61 0.00 23 L 8.36 4.18 0.00 1.94 1.73 0.86 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 24 S 8.35 4.22 0.00 4.06 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 25 S 8.10 4.11 0.00 4.08 4.14 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 26 N 8.28 4.38 0.00 2.93 2.97 0.00 0.00 6.74 7.53 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 27 F 8.94 4.22 0.00 3.23 3.15 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 28 G 8.20 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.60 3.91 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 30 I 7.35 3.50 1.45 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.51 0.72 0.00 0.00 31 S 7.73 3.79 0.00 3.80 3.38 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 32 S 7.81 3.98 0.00 3.96 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 33 V 7.49 3.62 2.04 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 0.76 0.00 0.00 0.93 0.00 0.00 34 L 8.03 3.96 0.00 1.61 1.69 0.91 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 35 N 8.34 4.26 0.00 2.77 2.98 0.00 0.00 7.20 8.42 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 36 D 7.90 4.31 0.00 2.93 2.91 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 37 I 7.84 3.69 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 1.51 0.63 0.90 0.00 0.00 38 S 8.29 4.40 0.00 3.82 3.92 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 39 G 7.76 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 0.00 0.00 0.00 40 G 7.68 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 41 R 8.22 4.27 0.00 1.94 1.95 0.00 3.27 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.71 0.00 42 G 8.49 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 0.00 0.00 0.00 43 G 8.11 4.02 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 0.00 0.00 0.00 44 D 8.58 4.55 0.00 2.63 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.14 4.21 1.86 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 1.41 0.62 0.90 0.00 0.00 46 S 8.15 4.18 0.00 3.87 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 47 G 8.99 4.02 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 0.00 0.00 0.00 48 I 7.88 3.77 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.81 0.90 0.00 0.00 49 N 8.25 4.27 0.00 2.73 2.88 0.00 0.00 7.03 7.22 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 50 A 7.95 4.04 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 51 S 7.96 4.39 0.00 4.05 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 52 V 8.07 3.60 2.25 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 1.09 0.00 0.00 1.00 0.00 0.00 53 V 7.87 3.59 2.24 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 0.98 0.00 0.00 1.00 0.00 0.00 54 N 8.26 4.36 0.00 2.99 3.07 0.00 0.00 7.06 6.70 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 55 I 7.94 4.08 1.93 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.83 0.93 0.00 0.00 56 Q 8.32 4.01 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.65 2.56 0.00 57 K 8.13 4.04 0.00 1.98 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.65 7.81 58 E 8.45 3.96 0.00 2.15 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 2.33 2.39 0.00 59 I 8.08 3.71 2.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.96 0.89 0.00 0.00 60 D 7.95 4.38 0.00 2.87 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 61 R 8.36 3.97 0.00 1.96 1.97 0.00 3.13 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 62 L 8.42 4.00 0.00 1.79 1.70 0.90 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 63 N 8.32 4.29 0.00 2.83 3.00 0.00 0.00 7.23 7.11 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 64 E 8.11 3.98 0.00 2.21 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 2.53 2.45 0.00 65 V 8.14 3.78 2.23 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 1.17 0.00 0.00 0.99 0.00 0.00 66 A 8.16 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 67 K 8.21 3.91 0.00 1.84 1.97 0.00 1.64 0.00 0.00 1.64 0.00 0.00 3.11 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.48 7.81 68 N 8.37 4.32 0.00 2.93 2.85 0.00 0.00 7.05 6.53 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 69 L 7.76 3.98 0.00 1.76 1.73 0.92 0.89 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 70 N 8.24 4.44 0.00 2.91 2.94 0.00 0.00 7.28 7.08 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 71 E 8.54 4.04 0.00 2.23 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 2.33 2.53 0.00 72 S 7.81 4.13 0.00 4.06 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 7.67 4.21 0.00 1.77 1.76 0.92 0.79 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 74 I 7.46 4.13 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 1.52 0.51 0.91 0.00 0.00 75 D 8.27 4.20 0.00 2.56 2.46 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