NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -4 G 3.9615 8.3393 109.7357 45.1969 0.0000 173.4144 -3 P 4.3030 0.0000 0.0000 64.5883 32.7543 177.2040 -2 L 3.9133 8.1222 118.7149 56.1047 42.6463 179.2656 -1 G 3.7955 7.9687 105.0298 44.8637 0.0000 172.1574 0 S 4.5619 8.2391 114.6978 57.2116 63.3625 175.1360 1 E 4.2687 8.4637 129.2274 55.6308 29.0016 177.6078 2 N 4.3802 7.9226 117.2006 53.8244 38.0609 174.0894 3 D 4.7445 8.0153 120.3190 52.6236 44.6367 175.0693 4 L 4.4443 8.6482 123.1938 53.7017 43.1875 177.9223 5 G 3.7729 10.0506 108.3725 46.6617 0.0000 173.8555 6 I 4.2214 8.2069 123.2706 61.4321 37.8168 175.5810 7 T 5.2234 9.1200 117.1679 60.3548 72.1790 172.8561 8 A 4.8683 8.7662 122.5725 51.0695 23.4947 175.3536 9 V 4.7115 8.3632 118.5696 59.5090 34.4675 175.0583 10 A 3.9114 8.9180 126.5209 52.1431 18.6075 178.1959 11 L 3.7371 8.6893 123.8907 56.7934 42.4227 176.5539 12 Y 5.0762 7.4341 112.9091 55.8228 42.2082 175.1379 13 D 5.0942 8.9677 120.0413 55.1958 42.3285 176.0025 14 Y 4.5395 8.7275 122.1377 56.8211 42.4640 173.3536 15 Q 4.4229 7.7935 126.1386 53.8270 29.9205 175.4897 16 A 4.1009 8.3865 126.7560 52.7279 18.3806 177.0527 17 A 4.3058 9.2950 123.7715 52.3805 20.4440 176.8529 18 G 4.2127 7.5152 103.1247 43.7041 0.0000 172.6673 19 D 4.6001 8.5512 117.2564 55.2474 41.2300 177.0453 20 D 4.6748 7.8635 118.5224 53.0560 39.9985 175.2452 21 E 5.4515 7.7084 119.0334 54.8306 32.7548 174.8103 22 I 4.7245 8.4801 114.5297 59.4439 40.6608 174.5168 23 S 4.9828 8.1973 117.2797 57.0095 66.6245 173.3965 24 F 4.9744 8.0508 113.9349 56.6950 41.4917 172.6014 25 D 5.4598 9.9081 120.4711 51.6475 44.0735 174.3268 26 P 4.5018 0.0000 0.0000 64.7211 31.6955 176.8216 27 D 4.6324 9.1001 120.4926 54.5125 39.3422 174.3479 28 D 4.7059 7.7099 119.3876 54.0601 42.4708 175.1716 29 I 4.7431 8.1311 121.2531 59.8430 39.3140 175.0468 30 I 4.6949 8.8234 127.7419 59.7194 39.7369 174.9847 31 T 4.8832 8.9602 116.4711 59.1122 72.5798 173.0768 32 N 4.2975 9.1056 116.7872 54.3667 36.6717 175.2620 33 I 4.5079 7.8178 117.2032 61.6360 38.4639 176.8063 34 E 4.5916 9.0929 124.0881 54.9571 33.9952 174.3712 35 M 4.2340 8.3577 123.8364 54.7262 32.3143 176.3092 36 I 4.0230 8.6008 125.5117 63.6723 37.8915 175.2717 37 D 4.6471 7.7026 115.4748 52.9387 41.4246 173.9948 38 D 4.5740 9.1445 118.2656 57.8792 41.1821 177.9986 39 G 3.5143 8.7673 105.7643 47.2521 0.0000 173.9991 40 W 5.1660 8.2889 119.9837 54.3789 31.9941 175.3926 41 W 5.6561 8.5943 122.9756 54.7605 33.2655 174.2925 42 R 5.1892 8.8592 116.9081 55.3057 32.5469 175.0570 43 G 4.8224 9.1891 106.9528 46.2781 0.0000 171.3023 44 V 5.2514 8.9321 119.7585 61.3630 34.4716 175.5525 45 C 4.8118 9.1635 127.3144 58.9572 34.2930 173.9950 46 K 3.6377 9.9453 128.2569 57.5396 29.3052 175.5429 47 G 4.1957 8.4691 107.2011 45.5917 0.0000 174.5221 48 R 4.2747 7.8950 119.4292 55.6706 30.8227 174.6531 49 Y 5.3181 8.7810 123.6597 55.0599 40.8994 175.3451 50 G 3.7721 7.5577 112.9305 46.0052 0.0000 170.9849 51 L 5.2981 7.8614 119.3839 54.0626 43.5885 176.2319 52 F 5.2823 8.9167 116.1095 55.0025 42.1731 171.5937 53 P 3.6614 0.0000 0.0000 62.0237 31.3189 177.1949 54 A 2.7000 8.3709 129.6103 54.7767 18.0767 178.5771 55 N 4.5030 7.6085 109.8450 54.4042 37.7476 174.9777 56 Y 4.6846 8.2004 116.8414 58.4060 38.6726 175.0298 57 V 4.8153 7.4052 112.5491 59.2917 36.1204 174.5847 58 E 4.6267 9.0008 123.2524 54.0334 32.0313 175.0785 59 L 4.5509 8.8384 127.2909 55.5963 42.3596 177.0588 60 R 4.3999 8.4980 124.6484 55.2457 32.7494 174.8825 61 Q 4.4818 8.6014 124.1357 55.3686 28.9622 175.8178 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 -4 G 8.34 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 -3 P 0.00 4.30 0.00 2.27 2.18 0.00 3.77 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 1.96 2.04 0.00 -2 L 8.12 3.91 0.00 1.65 1.76 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 -1 G 7.97 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 0.00 0.00 0.00 0 S 8.24 4.56 0.00 3.86 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 1 E 8.46 4.27 0.00 1.92 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 2.29 2.38 0.00 2 N 7.92 4.38 0.00 2.70 2.82 0.00 0.00 6.88 8.06 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 3 D 8.02 4.74 0.00 2.56 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 4 L 8.65 4.44 0.00 1.74 1.66 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 5 G 10.05 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 I 8.21 4.22 1.80 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.36 0.81 0.00 0.00 7 T 9.12 5.22 4.23 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 0.00 0.00 1.26 0.00 0.00 8 A 8.77 4.87 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 9 V 8.36 4.71 2.01 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 0.84 0.00 0.00 0.83 0.00 0.00 10 A 8.92 3.91 0.83 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 0.00 0.00 11 L 8.69 3.74 0.00 0.62 0.32 0.72 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.43 5.08 0.00 2.76 2.76 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 13 D 8.97 5.09 0.00 2.69 2.70 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 14 Y 8.73 4.54 0.00 2.98 1.80 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 15 Q 7.79 4.42 0.00 1.68 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.63 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 16 A 8.39 4.10 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 A 9.30 4.31 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 18 G 7.52 4.21 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 0.00 19 D 8.55 4.60 0.00 2.66 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 20 D 7.86 4.67 0.00 2.70 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 21 E 7.71 5.45 0.00 2.01 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 0.00 2.34 2.06 0.00 22 I 8.48 4.72 2.02 0.00 0.00 1.00 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 0.89 1.07 0.00 0.00 23 S 8.20 4.98 0.00 3.71 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 24 F 8.05 4.97 0.00 3.18 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 25 D 9.91 5.46 0.00 2.64 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.50 0.00 2.06 2.12 0.00 3.82 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 27 D 9.10 4.63 0.00 2.80 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 D 7.71 4.71 0.00 2.72 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.13 4.74 1.84 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 1.31 0.80 0.92 0.00 0.00 30 I 8.82 4.69 1.67 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.22 0.76 0.00 0.00 31 T 8.96 4.88 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 1.21 0.00 0.00 32 N 9.11 4.30 0.00 2.86 2.93 0.00 0.00 7.05 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 33 I 7.82 4.51 1.92 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.73 0.83 0.00 0.00 34 E 9.09 4.59 0.00 1.90 1.76 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 2.22 2.33 0.00 35 M 8.36 4.23 0.00 1.84 1.82 0.00 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.23 0.00 36 I 8.60 4.02 2.20 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.39 0.96 0.00 0.00 37 D 7.70 4.65 0.00 2.79 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 38 D 9.14 4.57 0.00 2.71 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 39 G 8.77 3.51 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 0.00 0.00 0.00 40 W 8.29 5.17 0.00 3.25 2.99 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 41 W 8.59 5.66 0.00 2.15 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 42 R 8.86 5.19 0.00 1.85 1.94 0.00 2.68 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 43 G 9.19 4.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 8.93 5.25 2.15 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 0.91 0.00 0.00 1.00 0.00 0.00 45 C 9.16 4.81 0.00 2.97 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 K 9.95 3.64 0.00 1.97 1.88 0.00 1.87 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.39 1.46 7.81 47 G 8.47 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 R 7.89 4.27 0.00 2.10 1.95 0.00 3.32 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 49 Y 8.78 5.32 0.00 2.81 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.56 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.86 5.30 0.00 1.48 1.55 0.66 1.04 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 52 F 8.92 5.28 0.00 3.08 3.29 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 53 P 0.00 3.66 0.00 1.31 1.15 0.00 2.74 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.77 0.00 54 A 8.37 2.70 -0.51 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 0.00 0.00 55 N 7.61 4.50 0.00 2.84 2.84 0.00 0.00 5.96 7.55 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 56 Y 8.20 4.68 0.00 3.40 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.41 4.82 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 0.38 0.00 0.00 1.26 0.00 0.00 58 E 9.00 4.63 0.00 1.89 1.72 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 2.18 2.25 0.00 59 L 8.84 4.55 0.00 1.66 1.68 0.99 0.91 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 60 R 8.50 4.40 0.00 1.83 1.76 0.00 3.23 0.00 0.00 3.21 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 61 Q 8.60 4.48 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.42 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00