NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.1963 8.3645 123.5821 51.5581 19.8744 177.0926 5 R 3.8456 8.5747 120.9943 55.7264 29.4408 172.6395 6 T 4.7796 7.7324 117.4124 59.3443 71.6984 173.0102 7 V 4.1898 7.6505 119.4831 61.4184 33.6965 173.4347 8 R 4.5164 8.3463 124.3015 54.2415 30.0361 173.7611 9 C 4.7907 7.8357 118.3859 55.1610 42.8480 173.8910 10 N 4.3767 8.8180 117.9993 55.9184 38.3480 175.7677 11 C 4.6620 8.6275 116.4331 55.9761 40.9947 173.3934 12 I 4.1209 8.3581 116.5900 60.7879 39.0481 175.0461 13 H 4.7586 8.0302 119.8151 54.1922 32.5522 172.0183 14 I 4.3092 7.8862 126.8232 59.2747 38.4552 175.0654 15 D 4.6436 9.0065 126.3741 54.1133 41.7588 176.3516 16 D 4.5005 8.3500 120.6700 53.2589 41.5580 175.2368 17 G 3.7182 8.4075 107.9969 45.1616 0.0000 170.7802 18 P 4.2202 0.0000 0.0000 62.3819 32.1027 176.3607 19 V 4.5153 7.9177 113.6099 59.2295 35.3423 175.8780 20 R 4.0982 8.4283 122.6875 56.1914 30.6021 177.3178 21 M 3.9447 9.0027 122.8348 58.6963 32.0027 178.2286 22 R 4.1633 7.9260 110.6617 56.5446 30.1887 176.4646 23 A 4.3993 8.3861 122.2521 52.7205 19.6594 176.9843 24 I 4.4798 7.1015 117.1503 60.2308 38.4160 175.8848 25 G 3.9394 9.1839 112.5607 47.9545 0.0000 173.7485 26 K 4.8577 7.7146 119.6365 54.6192 36.3073 174.5861 27 L 5.2626 8.3587 124.8159 53.4122 45.2435 175.0391 28 E 4.7685 9.5567 125.2767 54.5770 32.8992 175.1398 29 I 4.7509 8.4138 123.8445 59.7466 39.9758 175.0208 30 I 4.2735 8.5883 129.7927 58.4408 38.8930 173.2985 31 P 4.7869 0.0000 0.0000 61.9699 32.1319 176.3320 32 A 4.5206 8.6253 123.5513 53.3149 18.5815 176.8280 33 S 4.6049 9.2039 115.1702 56.6964 66.9091 175.1713 34 L 3.9825 8.6428 119.2270 58.0007 41.4797 179.1613 35 S 4.2442 8.0044 112.4900 60.8497 62.8732 173.7058 36 C 5.0570 7.9016 119.9079 54.2565 44.1473 172.1102 37 P 4.3625 0.0000 0.0000 62.8114 31.1621 176.8596 38 R 4.8544 7.4440 115.4505 54.2062 31.8100 176.1067 39 V 4.0771 8.3509 120.8670 61.9579 32.7182 175.1092 40 E 4.7314 9.0784 121.0650 54.7514 33.9522 174.7980 41 I 5.4411 8.2951 123.4532 58.8576 40.4770 174.0386 42 I 4.9069 8.3239 128.2154 59.5193 39.4188 174.5790 43 A 5.0081 9.2882 129.4896 50.5581 21.5061 175.9597 44 T 4.6365 8.6210 120.3232 62.5095 68.7626 174.3299 45 M 4.4249 8.7239 126.7211 55.6977 32.9475 178.3159 46 K 3.8827 9.3466 122.4654 59.4525 32.7678 178.4667 47 K 3.9331 7.9838 119.4830 57.4431 32.0236 177.4375 48 N 4.1876 9.2209 119.4922 53.0292 36.9525 173.5924 49 D 5.2456 7.8073 116.0780 53.9345 39.3732 173.5621 50 E 4.3895 7.8507 115.9185 55.9334 31.5827 176.1038 51 Q 5.1199 8.6239 122.6769 55.4293 30.1821 175.0935 52 R 4.6995 8.9105 118.1375 55.5282 33.6300 172.8313 53 C 5.2939 8.7530 117.1842 55.6790 42.3680 172.8510 54 L 5.1013 8.3166 122.4925 52.5488 44.7027 175.9815 55 N 4.4493 8.1591 120.6760 52.7792 39.1971 174.0978 56 P 4.2849 0.0000 0.0000 65.8527 31.5451 177.7575 57 E 4.1255 8.1962 115.5041 58.4539 29.9221 178.0809 58 S 4.3594 7.8567 116.2162 57.8821 64.7367 175.3036 59 K 3.9567 8.5428 125.1115 60.0007 32.1821 179.7530 60 T 3.9978 8.0280 115.0692 65.8551 68.2657 175.8902 61 I 4.0982 7.3417 121.0158 63.4559 37.8756 177.7815 62 K 4.0163 8.2188 118.0635 59.5935 32.1302 178.9356 63 N 4.4827 8.8552 116.9970 56.2644 38.3640 177.2889 64 L 4.0209 7.2515 119.0439 58.2558 42.2056 178.2429 65 M 4.3184 8.2416 116.6961 56.0593 32.6357 176.8905 66 K 4.2911 7.8148 120.1560 56.0416 31.7768 176.9350 67 A 4.1612 7.8497 126.1753 52.5745 18.2796 178.0210 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 A 8.36 4.20 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 5 R 8.57 3.85 0.00 1.93 1.77 0.00 3.21 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.25 0.00 6 T 7.73 4.78 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 7 V 7.65 4.19 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 0.70 0.00 0.00 0.93 0.00 0.00 8 R 8.35 4.52 0.00 1.72 1.87 0.00 3.15 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 9 C 7.84 4.79 0.00 2.95 3.43 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 0.00 10 N 8.82 4.38 0.00 2.89 2.87 0.00 0.00 7.02 7.73 0.00 0.00 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 C 8.63 4.66 0.00 3.05 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 12 I 8.36 4.12 1.89 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 1.32 0.67 0.92 0.00 0.00 13 H 8.03 4.76 0.00 3.05 3.18 0.00 5.87 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 7.89 4.31 1.80 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.02 0.88 0.00 0.00 15 D 9.01 4.64 0.00 2.67 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.35 4.50 0.00 2.70 2.68 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 0.00 0.00 0.00 0.00 17 G 8.41 3.72 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 0.00 0.00 0.00 18 P 0.00 4.22 0.00 2.05 2.04 0.00 3.62 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 19 V 7.92 4.52 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 0.93 0.00 0.00 20 R 8.43 4.10 0.00 1.87 1.85 0.00 3.16 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 21 M 9.00 3.94 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.57 0.00 22 R 7.93 4.16 0.00 1.89 2.03 0.00 3.07 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 23 A 8.39 4.40 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 24 I 7.10 4.48 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 1.23 0.79 0.98 0.00 0.00 25 G 9.18 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 0.00 0.00 0.00 26 K 7.71 4.86 0.00 1.79 1.59 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.43 7.81 27 L 8.36 5.26 0.00 1.61 1.46 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 28 E 9.56 4.77 0.00 2.02 1.79 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 2.21 2.24 0.00 29 I 8.41 4.75 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 1.23 0.61 0.91 0.00 0.00 30 I 8.59 4.27 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 1.23 1.44 0.94 0.00 0.00 31 P 0.00 4.79 0.00 1.97 1.97 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 32 A 8.63 4.52 1.24 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 0.00 0.00 0.00 33 S 9.20 4.60 0.00 3.79 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 34 L 8.64 3.98 0.00 1.66 1.77 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.00 4.24 0.00 3.85 3.85 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 36 C 7.90 5.06 0.00 2.96 2.88 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 37 P 0.00 4.36 0.00 2.21 2.16 0.00 3.37 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.93 0.00 38 R 7.44 4.85 0.00 1.79 1.91 0.00 3.03 0.00 0.00 3.27 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 39 V 8.35 4.08 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 0.93 0.00 0.00 40 E 9.08 4.73 0.00 1.90 1.82 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 2.21 2.26 0.00 41 I 8.30 5.44 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 1.36 1.43 0.91 0.00 0.00 42 I 8.32 4.91 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 1.28 0.85 0.99 0.00 0.00 43 A 9.29 5.01 1.21 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 44 T 8.62 4.64 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 1.21 0.00 0.00 45 M 8.72 4.42 0.00 1.95 2.01 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 2.63 2.85 0.00 46 K 9.35 3.88 0.00 1.70 1.87 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.54 7.81 47 K 7.98 3.93 0.00 1.82 1.75 0.00 1.81 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.46 7.81 48 N 9.22 4.19 0.00 2.87 2.93 0.00 0.00 7.31 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 49 D 7.81 5.25 0.00 2.82 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 50 E 7.85 4.39 0.00 2.04 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 0.00 2.34 2.34 0.00 51 Q 8.62 5.12 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 52 R 8.91 4.70 0.00 1.86 1.98 0.00 2.76 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 53 C 8.75 5.29 0.00 3.11 3.03 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 0.00 0.00 0.00 54 L 8.32 5.10 0.00 1.51 1.55 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 55 N 8.16 4.45 0.00 2.73 2.70 0.00 0.00 7.39 7.59 0.00 0.00 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 P 0.00 4.28 0.00 2.07 2.11 0.00 3.73 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 57 E 8.20 4.13 0.00 1.95 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 2.31 2.33 0.00 58 S 7.86 4.36 0.00 4.02 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 59 K 8.54 3.96 0.00 1.79 1.97 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.53 7.81 60 T 8.03 4.00 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 1.22 0.00 0.00 61 I 7.34 4.10 2.03 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 1.61 1.12 0.91 0.00 0.00 62 K 8.22 4.02 0.00 1.65 1.88 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.16 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.53 7.81 63 N 8.86 4.48 0.00 2.84 2.85 0.00 0.00 6.62 7.15 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 64 L 7.25 4.02 0.00 1.96 1.83 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 65 M 8.24 4.32 0.00 1.97 2.32 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 2.63 2.72 0.00 66 K 7.81 4.29 0.00 1.90 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.38 7.81 67 A 7.85 4.16 1.23 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 0.00 0.00 0.00