NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 S 4.4154 8.3344 116.7925 56.8677 65.3454 173.4563 9 K 4.2386 7.5257 129.7865 53.2475 32.5361 172.3889 10 P 4.3528 0.0000 0.0000 61.7235 33.0538 175.4612 11 L 4.5328 8.2611 123.0764 53.0621 42.8371 176.5478 12 L 4.4026 8.2568 124.0664 54.4481 42.6709 177.4856 13 T 4.2745 8.8875 113.2425 60.5852 71.0523 175.6998 14 K 3.7812 8.5992 121.7284 60.0760 31.9776 178.4211 15 R 4.1708 7.7801 119.2758 58.9098 30.2003 178.0383 16 E 4.0305 7.9640 118.0092 59.3486 29.4818 179.3857 17 R 3.9570 8.1137 118.5919 59.5423 30.1098 178.0511 18 E 4.2025 8.2843 119.9750 58.8642 29.5100 179.7272 19 V 3.5440 7.8958 117.7480 66.1318 31.6027 178.1401 20 F 3.7211 8.1769 117.0744 60.3867 38.5663 177.4048 21 E 4.0416 8.8930 118.6468 59.5597 29.2063 179.4865 22 L 4.1255 7.9773 118.9165 57.2668 41.8049 178.9685 23 L 3.8234 8.1604 121.2344 58.3481 42.0302 178.7632 24 V 3.9415 7.8553 108.0834 62.1607 31.1567 176.3808 25 Q 4.4740 7.9619 117.9740 55.4081 28.7538 174.8595 26 D 4.4242 7.8595 115.5702 55.4443 39.8113 173.6333 27 K 4.5099 7.9322 115.7889 54.6419 34.1445 177.4584 28 T 4.3265 8.0767 113.8653 60.9778 71.4735 175.8803 29 T 3.8299 8.2622 111.1003 64.6334 68.5987 176.1282 30 K 3.8370 8.0348 122.0325 59.5175 32.1347 178.2011 31 E 3.9759 8.0566 118.9305 59.1029 29.5502 178.7274 32 I 3.6435 7.8996 119.7255 64.2639 37.2702 178.0273 33 A 4.0086 8.3545 121.9245 55.4235 18.0747 179.7291 34 S 4.1161 8.0724 113.4391 61.9936 62.7433 176.7749 35 E 4.0131 8.2957 120.5521 58.4595 29.4608 177.7068 36 L 4.4433 7.9196 116.2936 53.1034 42.9278 175.9532 37 F 4.0908 8.0177 120.6829 59.0437 37.9786 173.3265 38 I 4.5269 7.6032 111.8932 58.0272 41.4870 175.5257 39 S 4.3913 8.1434 115.5040 58.0694 64.8806 174.9680 40 E 3.9666 8.5275 121.7173 59.0903 29.2650 179.1440 41 K 3.7961 8.0809 119.3640 60.1496 32.1162 178.6071 42 T 3.7980 8.0956 115.8681 66.5470 68.3115 176.7723 43 V 3.6016 7.6325 119.8501 66.1719 31.5197 178.3223 44 R 3.9570 8.2583 118.0101 59.2620 29.8330 178.8814 45 N 4.3378 8.1892 116.3630 56.6509 38.4702 177.2091 46 H 4.3202 8.3491 117.6945 58.7875 28.6738 177.9735 47 I 3.9154 7.8763 121.6086 64.5903 36.9114 178.4593 48 S 4.1746 8.4038 116.2887 61.9521 62.7000 176.7526 49 N 4.3467 8.4089 118.7048 56.1171 38.3273 177.3593 50 A 3.9756 8.3819 122.3971 55.5014 18.5937 179.5092 51 M 3.9914 8.3961 117.4234 58.7977 31.8212 179.0760 52 Q 4.0351 8.2087 117.2867 58.9421 28.9338 178.7765 53 K 4.1174 7.8320 118.6832 58.9602 32.1409 178.7067 54 L 4.3078 7.6753 117.5882 54.5303 41.8709 177.2939 55 G 3.8075 7.8421 106.4566 46.4659 0.0000 173.3689 56 V 4.4570 7.7779 113.4708 59.7652 34.9531 176.2336 57 K 4.3618 8.5493 120.8294 55.6354 32.9708 175.3137 58 G 4.3313 7.4949 102.2057 42.6658 0.0000 173.5184 59 R 4.1426 8.5019 118.3051 59.2836 30.0204 179.4272 60 S 4.1886 8.0929 113.6270 61.7443 62.8968 176.4331 61 Q 3.9746 8.1377 120.9616 58.3809 28.3949 178.4457 62 A 3.8536 7.8754 121.5776 55.0235 18.4534 179.7431 63 V 3.5426 7.9973 116.8171 66.2579 31.6385 178.4418 64 V 3.6098 7.9792 117.9595 66.0713 31.3803 177.8808 65 E 3.9666 8.4888 118.7097 59.3843 29.2704 179.3314 66 L 3.9819 8.2295 119.4341 57.5744 41.7033 179.6242 67 L 3.9899 8.0193 119.1307 57.6944 41.3320 179.5500 68 R 3.9300 7.7971 116.9062 59.6656 30.2220 178.6843 69 M 4.3060 7.8589 115.4631 55.9056 31.9748 177.3746 70 G 3.8830 7.6598 106.9063 46.0717 0.0000 174.1898 71 E 4.4158 8.1842 117.8424 56.1719 30.1466 176.2063 72 L 4.9442 7.5294 117.5234 52.7872 45.6017 175.4375 73 E 4.7691 8.5415 119.3982 54.6543 33.1090 176.1338 74 L 4.3149 8.4525 120.2956 54.9828 41.9792 176.5480 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 8 S 8.33 4.42 0.00 3.87 3.82 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 9 K 7.53 4.24 0.00 1.73 1.67 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.51 7.81 10 P 0.00 4.35 0.00 2.04 2.07 0.00 3.68 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 1.99 2.08 0.00 11 L 8.26 4.53 0.00 1.62 1.59 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.26 4.40 0.00 1.62 1.60 0.84 0.91 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 13 T 8.89 4.27 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 1.23 0.00 0.00 14 K 8.60 3.78 0.00 1.84 1.88 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.54 7.81 15 R 7.78 4.17 0.00 1.87 1.57 0.00 3.33 0.00 0.00 3.38 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.29 0.00 16 E 7.96 4.03 0.00 2.24 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 0.00 2.62 2.37 0.00 17 R 8.11 3.96 0.00 2.03 2.15 0.00 3.13 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 18 E 8.28 4.20 0.00 2.23 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 0.00 2.35 2.43 0.00 19 V 7.90 3.54 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 0.74 0.00 0.00 0.98 0.00 0.00 20 F 8.18 3.72 0.00 3.33 3.17 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 21 E 8.89 4.04 0.00 2.16 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 2.37 2.56 0.00 22 L 7.98 4.13 0.00 1.99 1.66 1.02 0.52 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 23 L 8.16 3.82 0.00 1.59 1.67 0.75 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.86 3.94 2.11 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 0.80 0.00 0.00 1.01 0.00 0.00 25 Q 7.96 4.47 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.61 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 26 D 7.86 4.42 0.00 2.82 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 27 K 7.93 4.51 0.00 1.74 1.68 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.33 7.81 28 T 8.08 4.33 4.22 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 0.00 0.00 0.00 1.20 0.00 0.00 29 T 8.26 3.83 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 1.16 0.00 0.00 30 K 8.03 3.84 0.00 1.83 1.85 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.51 1.77 7.81 31 E 8.06 3.98 0.00 2.12 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 2.30 2.38 0.00 32 I 7.90 3.64 1.97 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.77 0.88 0.00 0.00 33 A 8.35 4.01 1.44 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 0.00 0.00 34 S 8.07 4.12 0.00 4.08 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 35 E 8.30 4.01 0.00 1.96 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 36 L 7.92 4.44 0.00 1.70 1.72 0.92 0.73 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 37 F 8.02 4.09 0.00 2.86 3.08 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 0.00 0.00 0.00 0.00 38 I 7.60 4.53 1.83 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.82 0.89 0.00 0.00 39 S 8.14 4.39 0.00 4.04 3.99 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 40 E 8.53 3.97 0.00 2.02 2.02 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 2.39 2.35 0.00 41 K 8.08 3.80 0.00 1.79 1.79 0.00 1.70 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.54 7.81 42 T 8.10 3.80 4.35 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 1.15 0.00 0.00 43 V 7.63 3.60 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 0.98 0.00 0.00 1.01 0.00 0.00 44 R 8.26 3.96 0.00 2.02 1.96 0.00 3.17 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 45 N 8.19 4.34 0.00 2.85 2.80 0.00 0.00 6.98 7.71 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 46 H 8.35 4.32 0.00 3.34 3.36 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 I 7.88 3.92 2.01 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.72 0.99 0.00 0.00 48 S 8.40 4.17 0.00 4.00 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 49 N 8.41 4.35 0.00 3.03 3.02 0.00 0.00 6.96 7.32 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 50 A 8.38 3.98 1.45 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 0.00 0.00 51 M 8.40 3.99 0.00 2.25 2.32 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.01 2.69 0.00 52 Q 8.21 4.04 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.00 0.00 0.00 0.00 0.00 0.00 2.52 2.56 0.00 53 K 7.83 4.12 0.00 1.91 1.85 0.00 1.69 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.64 7.81 54 L 7.68 4.31 0.00 1.70 1.65 0.69 0.83 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 55 G 7.84 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 V 7.78 4.46 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 0.72 0.00 0.00 0.97 0.00 0.00 57 K 8.55 4.36 0.00 1.76 1.71 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.28 0.98 7.81 58 G 7.49 4.33 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 0.00 59 R 8.50 4.14 0.00 1.91 2.06 0.00 3.14 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 60 S 8.09 4.19 0.00 4.07 4.15 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 61 Q 8.14 3.97 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.95 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 62 A 7.88 3.85 1.25 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 0.00 0.00 0.00 63 V 8.00 3.54 2.30 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 1.04 0.00 0.00 1.24 0.00 0.00 64 V 7.98 3.61 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 0.97 0.00 0.00 0.97 0.00 0.00 65 E 8.49 3.97 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 2.50 2.45 0.00 66 L 8.23 3.98 0.00 1.56 1.64 0.39 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.02 3.99 0.00 1.86 1.71 0.93 0.70 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 68 R 7.80 3.93 0.00 1.96 1.98 0.00 3.15 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 69 M 7.86 4.31 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.52 0.00 70 G 7.66 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 0.00 0.00 0.00 71 E 8.18 4.42 0.00 1.93 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 2.26 2.23 0.00 72 L 7.53 4.94 0.00 1.58 1.53 1.02 0.91 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 73 E 8.54 4.77 0.00 1.91 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 74 L 8.45 4.31 0.00 1.62 1.56 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00