NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3758 0.0000 0.0000 62.2984 32.7996 176.7176 3 S 4.1723 8.2098 115.7866 57.6021 65.2651 174.0025 4 K 3.9109 8.6337 122.4537 59.6252 32.2658 180.4523 5 L 3.9476 7.9340 119.8631 58.0840 41.8394 178.8685 6 A 3.9892 7.6940 120.7933 55.0504 18.1548 179.3056 7 L 3.8966 7.7538 116.5220 58.2546 42.0931 179.6067 8 I 4.0001 7.7216 118.9583 64.2494 37.0507 178.4353 9 Q 4.0758 7.9876 117.7821 58.6421 28.7321 178.0468 10 E 4.2119 8.5488 119.0924 57.8319 29.5573 178.3397 11 L 3.9521 7.6293 119.9383 57.6103 41.8182 177.3290 12 P 4.2122 0.0000 0.0000 66.3878 30.8040 178.0710 13 D 4.3001 7.9688 117.6864 57.2071 40.9038 178.5788 14 R 3.9202 8.2967 118.9439 59.5284 30.1540 179.2276 15 I 3.6966 8.0464 119.6358 64.1918 37.0453 178.0417 16 Q 3.9785 7.9202 120.4034 59.6627 28.5803 178.9286 17 T 3.8578 7.8425 115.2723 66.6300 68.6230 176.2697 18 A 4.0959 8.0496 121.6468 54.8026 18.5160 179.0057 19 V 4.0069 7.6933 115.4426 64.3093 31.9390 177.5139 20 E 3.9339 8.1401 116.8703 59.5999 29.4055 179.0882 21 A 4.0890 7.9498 120.4907 54.8775 18.4822 179.0776 22 A 3.9349 7.9958 120.0384 55.7640 18.5609 178.9179 23 M 4.6698 7.8466 110.2531 55.4782 31.1393 177.0853 24 G 3.9963 7.6947 107.9766 46.0488 0.0000 174.4440 25 M 4.3238 7.6354 117.8756 54.6602 32.2493 175.8215 26 S 4.4519 8.2837 115.2590 57.0387 65.1633 173.5375 27 Y 4.9288 7.1014 118.5882 56.3300 37.8352 176.6977 28 Q 4.0107 8.1434 121.9467 59.7765 29.8036 176.3022 29 D 4.5232 8.0499 115.1346 54.2700 40.2460 176.5335 30 A 4.0933 7.4160 122.7169 51.7014 19.0761 176.2319 31 P 4.4570 0.0000 0.0000 62.2757 33.5573 177.4030 32 N 4.3107 8.8722 118.0850 56.9616 38.4630 177.3782 33 N 4.3710 8.0454 117.6073 55.7905 37.6576 177.2054 34 V 3.6870 7.6515 119.6450 64.9535 31.7604 177.8710 35 R 3.6657 8.3824 119.3591 59.2538 29.9149 178.6595 36 R 3.9174 7.8931 117.8139 59.2478 30.0562 178.7549 37 D 4.3071 7.8284 118.2123 57.4589 40.8439 178.9338 38 L 3.8703 7.8185 119.3994 57.6549 41.4089 179.3572 39 D 4.4648 7.9285 119.1086 57.2433 40.6826 178.2099 40 N 4.3337 8.1980 117.7465 56.3646 38.8453 176.7108 41 L 3.9127 7.8425 121.8858 58.3966 42.1705 178.2545 42 H 4.0879 8.3020 117.9687 59.4861 29.7594 177.0151 43 A 4.0694 8.2238 122.3968 55.1637 18.2923 179.2350 44 C 4.0718 8.2371 117.3869 62.5558 31.5891 175.8766 45 L 3.9638 8.2866 121.0151 57.7689 41.1646 178.7638 46 N 4.2080 8.4192 117.4377 56.8421 38.8346 176.8027 47 K 3.9462 8.2932 120.4854 59.1669 32.2414 178.7197 48 A 4.0256 7.8337 121.0437 54.5916 18.3259 179.4960 49 K 3.8509 8.3451 118.5183 59.8409 32.3208 179.1454 50 L 4.0440 8.2161 119.5191 57.9061 41.4720 179.8249 51 T 3.8354 7.9406 115.7922 66.5557 68.4075 176.8043 52 V 3.5322 7.7415 120.0824 66.1820 31.6716 177.6511 53 S 4.0804 8.0410 112.7415 61.6298 62.1031 176.3333 54 R 3.8625 8.1275 121.1688 59.4798 29.7881 177.8968 55 M 3.9791 8.5010 118.3924 58.9054 32.2309 178.3633 56 V 3.5852 8.1535 118.5417 66.3813 31.4499 178.0701 57 T 4.0108 7.6544 114.2438 66.6005 68.5496 176.5736 58 S 4.2795 8.1506 117.2030 61.4792 63.0085 176.6258 59 L 4.0388 8.1017 121.9330 57.7916 41.2276 178.9735 60 L 4.3805 8.1473 115.2046 55.3985 41.5382 177.2367 61 E 4.4467 7.8007 116.9912 55.9846 30.3674 176.6770 62 K 4.3793 7.8041 120.6290 54.1802 32.7750 174.8522 63 P 4.2785 0.0000 0.0000 65.9250 30.7642 178.4813 64 S 4.0526 7.9694 113.4090 61.4274 63.1392 176.2974 65 V 3.6248 7.7792 122.3244 65.3862 31.0742 177.7805 66 V 3.5701 7.7313 116.2362 66.0112 31.5502 177.4514 67 A 4.1407 8.0400 120.3696 55.2710 18.1163 178.9298 68 Y 4.0420 8.0649 117.9041 60.9855 38.8031 178.2128 69 L 3.7877 8.0283 118.3953 56.6886 41.7978 177.6858 70 E 4.4452 8.3949 114.0424 54.9688 31.3401 176.0939 71 G 3.4215 8.2996 113.4704 45.0564 0.0000 173.1830 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 P 0.00 4.38 0.00 2.19 2.11 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.96 0.00 3 S 8.21 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 4 K 8.63 3.91 0.00 1.89 1.87 0.00 1.45 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.43 7.81 5 L 7.93 3.95 0.00 1.67 1.65 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 6 A 7.69 3.99 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 7 L 7.75 3.90 0.00 1.78 1.78 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 8 I 7.72 4.00 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.04 0.92 0.00 0.00 9 Q 7.99 4.08 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.97 0.00 0.00 0.00 0.00 0.00 2.40 2.66 0.00 10 E 8.55 4.21 0.00 2.03 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 2.32 2.49 0.00 11 L 7.63 3.95 0.00 1.92 1.73 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 12 P 0.00 4.21 0.00 2.25 2.33 0.00 3.78 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.08 0.00 13 D 7.97 4.30 0.00 2.85 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.30 3.92 0.00 1.94 1.99 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.92 0.00 15 I 8.05 3.70 2.01 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 1.07 0.91 0.00 0.00 16 Q 7.92 3.98 0.00 2.32 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 17 T 7.84 3.86 4.45 0.00 0.00 0.00 0.00 0.00 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 18 A 8.05 4.10 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 19 V 7.69 4.01 2.17 0.00 0.00 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 0.93 0.00 0.00 20 E 8.14 3.93 0.00 2.16 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 0.00 2.55 2.36 0.00 21 A 7.95 4.09 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 22 A 8.00 3.93 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 23 M 7.85 4.67 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.68 0.00 24 G 7.69 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.64 4.32 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.91 0.00 26 S 8.28 4.45 0.00 3.86 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 27 Y 7.10 4.93 0.00 3.11 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 28 Q 8.14 4.01 0.00 2.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.08 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 29 D 8.05 4.52 0.00 2.84 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 30 A 7.42 4.09 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 31 P 0.00 4.46 0.00 2.30 1.98 0.00 3.63 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 2.11 2.18 0.00 32 N 8.87 4.31 0.00 2.73 2.90 0.00 0.00 6.67 6.92 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 33 N 8.05 4.37 0.00 2.90 3.06 0.00 0.00 5.89 7.68 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 34 V 7.65 3.69 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 0.93 0.00 0.00 0.90 0.00 0.00 35 R 8.38 3.67 0.00 2.00 2.06 0.00 3.25 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.86 0.00 36 R 7.89 3.92 0.00 2.05 1.94 0.00 3.17 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.93 0.00 37 D 7.83 4.31 0.00 2.60 2.65 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 38 L 7.82 3.87 0.00 0.60 0.81 0.45 0.80 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 39 D 7.93 4.46 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 40 N 8.20 4.33 0.00 2.92 2.90 0.00 0.00 6.81 6.17 0.00 0.00 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 L 7.84 3.91 0.00 1.85 1.87 0.95 0.96 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 42 H 8.30 4.09 0.00 3.36 3.54 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.22 4.07 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 44 C 8.24 4.07 0.00 3.09 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 45 L 8.29 3.96 0.00 1.79 1.67 0.93 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 46 N 8.42 4.21 0.00 2.77 2.98 0.00 0.00 6.91 6.29 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 47 K 8.29 3.95 0.00 1.93 1.92 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.46 7.81 48 A 7.83 4.03 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 49 K 8.35 3.85 0.00 1.95 2.01 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.48 7.81 50 L 8.22 4.04 0.00 1.71 1.70 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 51 T 7.94 3.84 4.42 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 1.21 0.00 0.00 52 V 7.74 3.53 2.08 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 1.06 0.00 0.00 0.98 0.00 0.00 53 S 8.04 4.08 0.00 4.03 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 54 R 8.13 3.86 0.00 2.20 1.90 0.00 3.16 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 1.63 1.63 0.00 55 M 8.50 3.98 0.00 2.04 2.25 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.71 0.00 56 V 8.15 3.59 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 0.99 0.00 0.00 1.02 0.00 0.00 57 T 7.65 4.01 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 1.23 0.00 0.00 58 S 8.15 4.28 0.00 4.08 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 59 L 8.10 4.04 0.00 1.85 1.74 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.15 4.38 0.00 1.58 1.71 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 61 E 7.80 4.45 0.00 1.95 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 2.25 2.51 0.00 62 K 7.80 4.38 0.00 1.95 1.78 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.69 7.81 63 P 0.00 4.28 0.00 2.26 2.35 0.00 3.73 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.06 0.00 64 S 7.97 4.05 0.00 4.08 4.17 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.78 3.62 2.36 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 1.17 0.00 0.00 0.95 0.00 0.00 66 V 7.73 3.57 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 0.91 0.00 0.00 1.04 0.00 0.00 67 A 8.04 4.14 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 68 Y 8.06 4.04 0.00 3.11 3.19 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 69 L 8.03 3.79 0.00 1.76 1.69 0.96 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.39 4.45 0.00 1.93 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 2.52 2.18 0.00 71 G 8.30 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 0.00 0.00 0.00 0.00