NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3047 8.2644 123.5842 51.5197 19.9186 176.1593 3 E 3.8772 8.4848 121.9211 56.0377 30.9991 174.3325 4 I 4.4740 9.1033 129.1548 59.9856 37.8672 175.1965 5 K 4.1929 8.9329 127.5697 56.1742 33.9486 175.9348 6 H 4.7194 8.4927 121.8651 54.7928 32.0420 172.0181 7 Y 5.3150 8.5320 124.3262 56.3039 40.8935 174.8156 8 Q 4.9555 8.5192 123.2610 54.3313 32.5931 173.8949 9 F 5.2602 9.2384 124.3721 55.6718 43.2566 173.6945 10 N 5.1495 9.0664 122.2706 52.7386 39.6654 173.7325 11 V 4.8135 8.2096 126.2689 60.8704 34.4045 175.2433 12 V 3.8951 8.7369 128.6182 62.3864 31.6816 175.7423 13 M 4.8668 9.2054 131.7480 55.3674 33.0158 175.9530 14 T 4.5242 7.8726 105.6338 61.1876 69.8698 173.3119 15 C 4.9036 7.6612 114.5718 54.5436 44.9657 173.3946 16 S 4.3361 8.6064 118.4591 60.4393 62.8513 175.1325 17 G 4.0016 8.9929 113.1805 46.1882 0.0000 175.8751 18 C 4.3088 8.2825 118.3460 59.9888 40.8656 175.9647 19 S 4.1553 8.1212 115.6053 61.4620 62.4917 176.6384 20 G 3.5463 8.1099 108.5994 47.3317 0.0000 175.3400 21 A 3.9635 8.0709 123.0954 54.9334 18.1903 179.9706 22 V 3.4368 7.6031 116.2376 66.0837 31.6777 177.4935 23 N 4.2566 8.2613 117.0316 56.6941 38.4755 176.4317 24 K 3.8703 7.9489 119.4977 59.8644 32.1541 178.9014 25 V 3.7155 7.5068 112.4627 64.2891 31.3507 178.6356 26 L 4.0494 7.7140 119.2176 57.7379 41.4099 179.3867 27 T 3.9435 8.1041 109.8445 64.6387 68.3262 176.0159 28 K 4.2851 7.6534 118.4617 57.4849 32.5890 177.3411 29 L 4.6552 7.5457 118.8864 54.1742 42.2753 176.3399 30 E 4.3663 7.8236 118.9788 56.2999 29.8063 174.8259 31 P 4.7398 0.0000 0.0000 63.1251 31.7905 175.7319 32 D 4.7268 8.1386 117.2300 54.3598 40.9309 175.6116 33 V 4.6656 7.6140 119.7996 61.4455 32.5263 175.3467 34 S 4.5223 9.0102 124.7237 60.8393 63.7711 174.9032 35 K 4.7489 7.8169 118.7848 55.1535 35.3403 174.6106 36 I 5.3146 8.4349 119.1363 59.2188 41.0183 173.8881 37 D 4.9679 9.1696 123.0244 52.6139 44.4525 174.1082 38 I 4.9514 8.5520 125.8189 59.5607 40.0779 174.7152 39 S 4.6346 9.0590 122.8179 56.4936 63.6043 174.7345 40 L 4.1767 8.6212 128.4338 57.3102 41.8511 179.5245 41 E 4.0490 8.2355 117.2585 58.3986 29.4876 177.4515 42 K 4.4796 7.6424 114.2904 54.9369 34.2493 175.6688 43 Q 3.5244 7.6107 117.1391 57.4164 26.8735 172.9913 44 L 5.3290 7.9022 116.0234 52.9081 45.9197 177.0048 45 V 4.8764 8.9291 122.4816 61.3382 34.3704 173.7225 46 D 5.4248 9.3473 128.3610 52.6381 43.4505 175.5455 47 V 4.8012 8.9006 123.0880 61.3675 34.7643 173.5380 48 Y 5.0071 8.9543 126.4059 56.8388 39.7426 174.7679 49 T 5.0670 8.5021 118.0045 61.3438 71.1158 173.9820 50 T 4.5634 8.3341 115.1628 62.1202 69.5062 175.1321 51 L 4.4793 8.0420 122.5894 53.4723 42.9723 175.4902 52 P 4.6487 0.0000 0.0000 62.3573 33.3274 176.9081 53 Y 3.2242 8.7133 122.4415 60.8874 38.6256 178.5488 54 D 4.3385 8.2458 119.3081 56.4783 39.2954 178.2502 55 F 4.2464 8.1542 121.4553 61.0257 39.5612 177.0171 56 I 3.4179 7.6576 119.3307 64.2510 36.9180 178.0659 57 L 3.3407 7.5982 121.2425 58.0798 41.8217 178.9533 58 E 3.8643 8.0336 118.3862 59.2390 29.1568 179.4795 59 K 3.7662 7.5645 117.6789 59.3122 32.3030 179.2052 60 I 3.6636 7.4615 120.0334 64.2735 36.9456 178.6654 61 K 3.9170 8.1825 119.7069 59.2314 31.6613 179.0670 62 K 4.1635 7.8351 116.8650 58.0709 32.0242 178.7421 63 T 4.0201 7.5446 110.2365 62.7460 68.8859 175.6090 64 G 3.9156 7.9883 109.4916 45.1290 0.0000 173.7825 65 K 4.0840 7.2634 118.6126 55.7848 32.8119 176.2792 66 E 4.0786 8.6577 124.3534 56.0669 30.7042 175.5087 67 V 4.4217 8.2795 128.2037 61.8342 31.4715 175.5748 68 R 4.3229 9.0778 129.4888 59.1965 30.8203 176.9668 69 S 4.6718 7.9994 110.8394 58.0771 65.8803 174.6861 70 G 4.8615 8.4524 106.0150 45.3906 0.0000 172.2445 71 K 4.6785 8.7473 119.3635 54.6132 37.1848 175.2247 72 Q 5.0633 8.3783 121.3025 54.3891 30.3901 175.7606 73 L 4.3370 8.8035 123.8300 54.7477 41.7183 176.4735 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 A 8.26 4.30 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 3 E 8.48 3.88 0.00 2.17 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 2.39 2.42 0.00 4 I 9.10 4.47 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.71 0.97 0.00 0.00 5 K 8.93 4.19 0.00 1.40 1.34 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.59 7.81 6 H 8.49 4.72 0.00 3.05 3.16 0.00 5.83 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 8.53 5.32 0.00 2.93 2.45 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 0.00 8 Q 8.52 4.96 0.00 1.92 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.20 2.38 0.00 9 F 9.24 5.26 0.00 2.93 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 10 N 9.07 5.15 0.00 2.90 2.76 0.00 0.00 6.42 7.01 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 11 V 8.21 4.81 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 0.83 0.00 0.00 0.97 0.00 0.00 12 V 8.74 3.90 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 0.79 0.00 0.00 0.94 0.00 0.00 13 M 9.21 4.87 0.00 1.96 2.08 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.42 0.00 14 T 7.87 4.52 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 1.26 0.00 0.00 15 C 7.66 4.90 0.00 3.06 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 16 S 8.61 4.34 0.00 3.88 3.87 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.99 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 18 C 8.28 4.31 0.00 3.14 3.13 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 19 S 8.12 4.16 0.00 4.05 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 20 G 8.11 3.55 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.07 3.96 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 22 V 7.60 3.44 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 0.94 0.00 0.00 0.92 0.00 0.00 23 N 8.26 4.26 0.00 2.87 2.96 0.00 0.00 6.91 6.97 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 24 K 7.95 3.87 0.00 1.85 1.97 0.00 1.85 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.48 7.81 25 V 7.51 3.72 1.97 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 0.82 0.00 0.00 0.90 0.00 0.00 26 L 7.71 4.05 0.00 1.82 1.72 0.93 0.52 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 27 T 8.10 3.94 4.25 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 1.30 0.00 0.00 28 K 7.65 4.29 0.00 1.94 1.91 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.63 7.81 29 L 7.55 4.66 0.00 1.89 1.79 0.83 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 30 E 7.82 4.37 0.00 2.05 1.91 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 2.37 2.36 0.00 31 P 0.00 4.74 0.00 2.18 2.14 0.00 3.77 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.98 0.00 32 D 8.14 4.73 0.00 2.89 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 33 V 7.61 4.67 2.13 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 0.94 0.00 0.00 1.00 0.00 0.00 34 S 9.01 4.52 0.00 3.82 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 K 7.82 4.75 0.00 1.71 1.55 0.00 1.38 0.00 0.00 1.22 0.00 0.00 2.83 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.48 1.40 7.81 36 I 8.43 5.31 1.94 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 1.27 0.89 0.98 0.00 0.00 37 D 9.17 4.97 0.00 2.81 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.55 4.95 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.83 0.93 0.00 0.00 39 S 9.06 4.63 0.00 3.88 3.75 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 40 L 8.62 4.18 0.00 1.76 1.71 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 41 E 8.24 4.05 0.00 1.95 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 2.32 2.40 0.00 42 K 7.64 4.48 0.00 1.75 1.80 0.00 1.87 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.38 7.81 43 Q 7.61 3.52 0.00 2.47 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 44 L 7.90 5.33 0.00 1.62 1.56 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 45 V 8.93 4.88 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 1.17 0.00 0.00 0.98 0.00 0.00 46 D 9.35 5.42 0.00 2.68 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.90 4.80 2.34 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 1.15 0.00 0.00 1.15 0.00 0.00 48 Y 8.95 5.01 0.00 3.02 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 49 T 8.50 5.07 4.30 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 1.27 0.00 0.00 50 T 8.33 4.56 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 1.28 0.00 0.00 51 L 8.04 4.48 0.00 1.92 1.91 1.16 0.94 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 52 P 0.00 4.65 0.00 2.48 2.06 0.00 3.70 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 2.12 2.16 0.00 53 Y 8.71 3.22 0.00 2.43 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 54 D 8.25 4.34 0.00 2.96 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 55 F 8.15 4.25 0.00 3.07 3.31 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 56 I 7.66 3.42 1.88 0.00 0.00 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 1.86 1.31 0.92 0.00 0.00 57 L 7.60 3.34 0.00 1.17 1.52 0.84 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.03 3.86 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.66 0.00 59 K 7.56 3.77 0.00 1.42 1.57 0.00 1.49 0.00 0.00 1.45 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.72 0.79 7.81 60 I 7.46 3.66 1.37 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.34 0.67 0.00 0.00 61 K 8.18 3.92 0.00 1.78 1.78 0.00 1.58 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.49 7.81 62 K 7.84 4.16 0.00 1.78 1.80 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.53 7.81 63 T 7.54 4.02 4.19 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 1.23 0.00 0.00 64 G 7.99 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 0.00 0.00 0.00 65 K 7.26 4.08 0.00 1.74 1.72 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.49 7.81 66 E 8.66 4.08 0.00 2.04 1.83 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 2.38 2.30 0.00 67 V 8.28 4.42 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 0.92 0.00 0.00 0.86 0.00 0.00 68 R 9.08 4.32 0.00 1.76 1.99 0.00 3.48 0.00 0.00 3.35 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 69 S 8.00 4.67 0.00 3.86 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 70 G 8.45 4.86 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 0.00 0.00 0.00 0.00 0.00 0.00 71 K 8.75 4.68 0.00 1.48 1.52 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.27 1.48 7.81 72 Q 8.38 5.06 0.00 1.83 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.84 0.00 0.00 0.00 0.00 0.00 2.18 1.82 0.00 73 L 8.80 4.34 0.00 1.09 1.40 0.71 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00