NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9034 8.3393 109.7362 45.4497 0.0000 173.6614 3 S 4.2074 8.0456 114.7620 56.9126 64.9994 169.6919 4 V 3.5988 8.1747 121.5168 66.1265 31.5447 178.8923 5 E 3.9538 8.1476 116.7663 59.6436 29.3827 178.5746 6 D 4.3538 8.1120 119.9397 57.2890 40.8858 179.1046 7 R 4.0582 7.9423 117.8497 58.6942 30.1397 179.2460 8 V 3.5853 7.9568 118.4469 66.2783 31.6425 178.2774 9 T 4.3805 7.8750 116.9290 65.9843 68.2590 176.5731 10 Q 3.9136 8.0674 121.5137 59.2379 29.1611 178.1087 11 L 3.9781 8.0189 120.0401 58.0313 41.5145 179.4082 12 E 4.0351 8.6860 118.7267 59.5422 29.3820 179.7312 13 R 3.9604 7.8725 117.8725 59.2001 30.0748 179.1589 14 I 3.7065 7.8579 119.7600 64.0726 37.0155 178.3607 15 S 4.0404 8.4695 114.7936 61.4269 62.2842 176.0509 16 N 4.3477 8.1480 119.1688 55.6269 37.0253 177.0196 17 A 3.9998 7.9527 123.1994 55.3950 18.4739 179.2309 18 H 4.1706 8.5816 115.0110 59.2050 28.7909 178.0581 19 S 4.1625 8.2895 116.9538 61.8921 62.6719 176.9462 20 Q 3.9972 8.2243 120.5507 58.7974 28.4440 178.5910 21 L 3.9485 8.2255 121.6010 58.0295 42.1090 178.8159 22 L 3.9896 8.4284 119.6288 58.0843 41.6311 179.6135 23 T 4.0318 7.8685 109.5139 64.9864 68.5047 176.5009 24 Q 4.0906 8.0535 120.9649 58.6651 28.7736 178.5989 25 L 3.9693 8.3375 120.3414 58.0016 41.6384 179.5789 26 Q 4.0264 8.2809 117.9219 59.0997 28.5927 179.1443 27 Q 3.9737 8.0375 118.7973 59.1545 28.7754 178.7275 28 Q 4.2322 8.2844 120.6512 58.1958 28.6235 178.6915 29 L 3.9336 8.3399 121.7371 58.4875 42.1111 179.3841 30 S 4.1660 8.1324 114.9043 61.3963 62.5463 176.4593 31 D 4.3376 8.2136 121.9115 57.5129 40.5466 178.4847 32 N 4.4133 8.2966 116.9674 56.2453 38.4361 177.0872 33 Q 3.9483 8.4128 121.2841 59.6047 29.1275 178.8969 34 S 4.1277 8.3107 115.9962 61.5313 62.7022 176.4889 35 D 4.3614 8.2324 121.9038 57.2884 40.5577 178.7567 36 I 3.7084 8.0265 120.5659 64.3421 37.0755 178.1527 37 D 4.3635 8.3597 119.9438 57.5546 40.7033 179.0965 38 S 4.1404 8.2241 115.5763 61.6205 62.7593 176.8482 39 L 4.0051 8.1635 121.8471 57.6498 41.3725 179.3485 40 R 3.9748 8.5552 119.2909 59.5058 30.0029 178.7960 41 G 3.6345 8.1512 105.3576 47.7878 0.0000 175.6595 42 Q 4.0089 8.1801 120.4951 58.8759 28.7396 178.8316 43 I 3.6976 8.0057 119.7405 64.1957 37.7508 177.9758 44 Q 4.0199 8.0617 118.2229 58.9054 28.5261 178.0740 45 E 4.3172 8.3944 119.7169 59.5742 29.5403 179.1951 46 N 4.4884 8.5198 116.7118 56.1044 38.5229 176.9172 47 Q 3.9207 8.4339 121.4891 59.6300 28.9891 178.4179 48 Y 3.9175 7.6758 116.0447 61.3641 38.0298 178.6609 49 Q 4.0283 8.2154 119.6612 58.9765 29.1742 177.9043 50 L 3.9310 7.9181 121.2681 58.3861 41.7216 178.7531 51 N 4.3497 8.3332 116.5001 56.3084 38.4026 177.4803 52 Q 4.0172 8.0784 119.4238 58.9722 28.7532 178.9863 53 V 3.5808 7.8523 119.2572 65.7937 31.2337 177.8526 54 V 3.5761 7.7100 118.1377 66.5007 31.3019 177.9769 55 E 4.0775 7.8681 117.1573 59.2912 29.3118 179.2912 56 R 3.9722 8.2005 118.7835 59.2556 30.0346 178.6189 57 Q 3.9905 8.4304 118.5326 58.7490 28.6654 178.6466 58 K 3.9473 7.7056 118.2019 59.6898 32.0969 179.4197 59 Q 3.9939 7.9596 117.6990 58.9228 28.6483 178.6592 60 I 3.7060 7.9265 120.9285 64.4111 37.0646 178.4642 61 L 3.9736 8.3062 120.0095 57.9119 41.2796 179.6098 62 L 3.9747 7.8336 117.5915 57.8924 41.8258 179.0089 63 Q 4.0654 8.2915 119.9246 59.2398 28.9781 178.2964 64 I 3.8909 8.5039 114.2235 63.4663 37.5682 177.5822 65 D 4.4298 8.2052 120.3237 56.7593 40.7471 177.9438 66 S 4.3449 7.7764 113.8530 59.8189 63.0443 174.1233 67 L 4.2578 7.3703 126.6403 54.7788 41.5497 176.2552 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 G 8.34 3.90 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 0.00 0.00 0.00 3 S 8.05 4.21 0.00 4.21 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 4 V 8.17 3.60 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 1.08 0.00 0.00 0.93 0.00 0.00 5 E 8.15 3.95 0.00 2.19 2.19 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 2.36 2.35 0.00 6 D 8.11 4.35 0.00 3.03 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 7 R 7.94 4.06 0.00 2.03 1.96 0.00 3.12 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 8 V 7.96 3.59 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 0.97 0.00 0.00 1.01 0.00 0.00 9 T 7.88 4.38 4.44 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 1.21 0.00 0.00 10 Q 8.07 3.91 0.00 2.18 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 11 L 8.02 3.98 0.00 1.90 1.70 0.92 0.79 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 12 E 8.69 4.04 0.00 2.20 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 2.32 2.35 0.00 13 R 7.87 3.96 0.00 2.02 1.96 0.00 3.11 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 14 I 7.86 3.71 1.79 0.00 0.00 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 1.58 0.90 0.68 0.00 0.00 15 S 8.47 4.04 0.00 3.90 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 16 N 8.15 4.35 0.00 3.07 3.05 0.00 0.00 6.93 6.50 0.00 0.00 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 7.95 4.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.58 4.17 0.00 3.34 3.35 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.29 4.16 0.00 4.03 3.93 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 0.00 0.00 0.00 20 Q 8.22 4.00 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 21 L 8.23 3.95 0.00 1.85 1.81 0.92 0.89 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 22 L 8.43 3.99 0.00 1.84 1.71 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 23 T 7.87 4.03 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 1.28 0.00 0.00 24 Q 8.05 4.09 0.00 2.28 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.59 0.00 25 L 8.34 3.97 0.00 1.63 1.72 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.28 4.03 0.00 2.28 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 27 Q 8.04 3.97 0.00 2.32 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 28 Q 8.28 4.23 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 29 L 8.34 3.93 0.00 1.78 1.92 0.92 0.86 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 30 S 8.13 4.17 0.00 4.07 3.90 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 31 D 8.21 4.34 0.00 2.89 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 32 N 8.30 4.41 0.00 2.91 2.87 0.00 0.00 6.71 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 33 Q 8.41 3.95 0.00 2.13 2.26 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 2.36 2.46 0.00 34 S 8.31 4.13 0.00 3.90 3.90 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 35 D 8.23 4.36 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 36 I 8.03 3.71 2.04 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 1.79 0.80 0.91 0.00 0.00 37 D 8.36 4.36 0.00 2.89 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 S 8.22 4.14 0.00 3.97 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 39 L 8.16 4.01 0.00 1.68 1.72 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 40 R 8.56 3.97 0.00 1.89 2.08 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 41 G 8.15 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.18 4.01 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 43 I 8.01 3.70 1.88 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 1.62 0.99 0.00 0.00 44 Q 8.06 4.02 0.00 2.32 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 45 E 8.39 4.32 0.00 2.04 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 2.56 2.51 0.00 46 N 8.52 4.49 0.00 2.98 2.88 0.00 0.00 6.61 6.88 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 47 Q 8.43 3.92 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.20 2.31 0.00 48 Y 7.68 3.92 0.00 3.27 3.04 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 49 Q 8.22 4.03 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 50 L 7.92 3.93 0.00 1.83 1.80 0.92 0.66 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 51 N 8.33 4.35 0.00 2.71 2.81 0.00 0.00 7.11 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 52 Q 8.08 4.02 0.00 2.33 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.61 0.00 53 V 7.85 3.58 2.22 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 1.09 0.00 0.00 1.00 0.00 0.00 54 V 7.71 3.58 2.07 0.00 0.00 0.00 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 1.00 0.00 0.00 55 E 7.87 4.08 0.00 2.05 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 2.46 2.45 0.00 56 R 8.20 3.97 0.00 2.10 1.93 0.00 3.33 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 57 Q 8.43 3.99 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 58 K 7.71 3.95 0.00 2.02 1.86 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.60 7.81 59 Q 7.96 3.99 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 60 I 7.93 3.71 2.00 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 0.60 0.91 0.00 0.00 61 L 8.31 3.97 0.00 1.79 1.71 0.92 0.50 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 62 L 7.83 3.97 0.00 1.62 1.73 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.29 4.07 0.00 2.19 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 64 I 8.50 3.89 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 1.79 0.93 0.91 0.00 0.00 65 D 8.21 4.43 0.00 2.76 2.77 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 66 S 7.78 4.34 0.00 4.14 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 67 L 7.37 4.26 0.00 1.58 1.57 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00