NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 74 M 4.7182 8.5298 120.4314 55.1441 33.5298 175.0465 75 P 4.3908 0.0000 0.0000 61.7141 33.0695 173.8456 76 K 4.4742 9.4671 123.6013 56.9420 33.6591 176.7852 77 H 5.4058 9.5262 122.7123 54.0858 32.1778 173.0779 78 E 5.0183 8.8786 121.2336 54.7834 31.7394 175.2054 79 F 5.4188 9.2512 122.2860 55.9402 43.2624 174.1867 80 S 5.2765 9.3397 116.7514 57.2965 67.3721 173.3801 81 V 4.7221 8.4635 114.3696 60.2574 35.6777 175.1113 82 D 4.5251 8.8740 119.8855 55.9613 41.0537 176.7036 83 M 4.4982 7.7526 117.0123 54.5050 32.5348 176.3369 84 T 4.8237 8.2830 118.6936 63.1398 69.8752 173.5904 85 C 4.7793 7.8955 120.0210 56.8486 34.8766 174.6628 86 G 3.8515 8.7710 112.7289 46.9439 0.0000 176.4478 87 G 3.5308 7.9831 107.9004 48.1953 0.0000 175.4188 88 C 4.0896 8.1352 119.3967 62.2479 28.0646 175.9372 89 A 3.9985 8.0771 122.2285 55.3146 17.9226 179.3582 90 E 3.8850 8.1229 117.1929 59.1298 29.5997 178.8645 91 A 3.9430 8.1509 120.9769 55.1237 18.4078 179.5610 92 V 3.4333 8.0832 117.1856 66.3858 31.6650 178.2029 93 S 4.3250 8.2172 114.1440 60.9913 62.0084 176.3652 94 R 4.0053 8.0644 120.1959 59.0759 29.9546 178.8660 95 V 3.7165 8.1837 118.6385 65.9206 31.5205 178.1812 96 L 3.9339 8.2050 119.1884 57.5426 41.1024 178.7245 97 N 4.4687 8.1874 116.3269 55.9643 38.5161 176.8208 98 K 3.9337 7.5758 119.4626 59.7114 32.1897 178.2021 99 L 4.0078 7.7543 118.2713 56.5053 41.9608 177.7799 100 G 4.3722 7.9755 109.9878 45.9068 0.0000 175.0010 101 G 4.0631 7.6293 108.5846 44.6462 0.0000 172.4935 102 V 4.8824 7.5157 112.4839 60.3274 36.3651 174.7231 103 K 4.6769 9.2989 127.8707 54.7191 34.5606 174.3312 104 Y 5.9082 7.7636 122.9960 56.8162 41.4225 172.9667 105 D 5.1915 8.9323 120.2842 52.7183 44.5475 174.9243 106 I 5.0848 8.4026 121.4543 59.5488 40.4840 174.3068 107 D 4.8301 9.0309 126.2926 52.6766 42.1397 176.5917 108 L 4.1620 8.6927 126.3452 56.9789 42.5111 177.5695 109 P 4.2941 0.0000 0.0000 65.5884 31.3185 177.1729 110 N 4.4362 8.5808 114.6491 54.0656 39.2364 174.9380 111 K 3.9655 7.7097 117.1137 57.5116 29.8791 174.7411 112 K 5.1226 7.8558 119.1226 53.9397 35.0137 174.9043 113 V 4.8579 9.0620 120.2693 59.8661 34.8488 174.4637 114 C 5.2495 9.1018 123.4825 58.4721 29.7288 172.7513 115 I 5.2365 8.7921 125.5735 59.6896 39.2493 174.9851 116 E 5.1765 9.2017 122.7668 55.0126 32.9406 174.3544 117 S 4.8945 8.5420 115.2373 56.8836 65.4092 173.7249 118 E 4.2161 8.4143 122.2366 58.1086 29.5076 176.4556 119 H 4.8861 7.9180 117.7973 54.4207 31.0062 175.4319 120 S 4.4352 8.2088 116.7972 58.3501 64.7530 175.2422 121 M 3.9996 8.5202 123.0436 58.9408 31.9465 178.2904 122 D 4.3280 7.9890 118.7600 56.4661 39.8062 178.6423 123 T 3.8221 7.7744 116.9008 66.3041 68.4580 176.4748 124 L 3.7941 7.7827 120.8331 57.6960 41.6560 179.4653 125 L 3.7130 7.7928 118.5673 57.8583 41.3849 179.5613 126 A 3.9739 7.6728 119.0686 55.3022 18.4418 179.6837 127 T 3.9006 7.7082 113.9322 66.7953 68.7114 176.9855 128 L 3.8476 7.9639 121.2093 57.8072 41.3839 179.6168 129 K 3.8701 7.7291 117.2833 59.4131 32.2809 178.8299 130 K 4.0284 7.7822 118.4652 59.8762 31.8365 178.8336 131 T 4.0896 7.3996 111.7578 63.8769 68.4014 174.1836 132 G 3.8288 8.0574 108.6199 46.6981 0.0000 173.9972 133 K 4.6621 7.7530 116.6421 54.1922 35.7402 177.0270 134 T 4.0909 9.1552 120.5366 63.5310 67.4821 174.0521 135 V 4.7182 8.0836 126.1610 59.9846 33.6211 175.5541 136 S 4.8795 8.8543 118.9871 56.8562 67.2682 172.7587 137 Y 4.8794 8.9648 125.1827 57.0321 39.4343 176.0112 138 L 4.2108 7.2977 125.9758 52.7999 39.9973 174.9986 139 G 4.1072 5.5159 112.6635 45.4468 0.0000 170.7266 140 L 5.0365 7.6624 125.2491 52.8212 44.6633 175.7387 141 E 4.1288 8.3644 123.4914 56.4613 29.4950 176.1092 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 74 M 8.53 4.72 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 75 P 0.00 4.39 0.00 2.11 2.01 0.00 3.86 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 1.99 2.07 0.00 76 K 9.47 4.47 0.00 1.71 1.81 0.00 1.67 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.55 1.58 7.81 77 H 9.53 5.41 0.00 3.10 2.78 0.00 5.58 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.88 5.02 0.00 1.79 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 2.21 2.20 0.00 79 F 9.25 5.42 0.00 2.92 2.89 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 80 S 9.34 5.28 0.00 3.74 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 81 V 8.46 4.72 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 0.66 0.00 0.00 0.97 0.00 0.00 82 D 8.87 4.53 0.00 2.67 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 83 M 7.75 4.50 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.55 0.00 84 T 8.28 4.82 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 1.28 0.00 0.00 85 C 7.90 4.78 0.00 2.89 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 86 G 8.77 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 0.00 0.00 0.00 87 G 7.98 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 C 8.14 4.09 0.00 2.98 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 8.08 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.12 3.89 0.00 2.26 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 2.39 0.00 91 A 8.15 3.94 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 92 V 8.08 3.43 2.17 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 0.85 0.00 0.00 0.93 0.00 0.00 93 S 8.22 4.32 0.00 4.19 4.06 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 0.00 0.00 0.00 0.00 94 R 8.06 4.01 0.00 1.96 1.98 0.00 3.23 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 1.68 1.73 0.00 95 V 8.18 3.72 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 1.05 0.00 0.00 0.94 0.00 0.00 96 L 8.20 3.93 0.00 1.59 1.60 0.06 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.19 4.47 0.00 2.97 3.06 0.00 0.00 7.19 6.07 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 98 K 7.58 3.93 0.00 1.80 1.84 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.54 7.81 99 L 7.75 4.01 0.00 1.81 1.72 0.81 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 100 G 7.98 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 7.63 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 7.52 4.88 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.12 0.00 0.00 103 K 9.30 4.68 0.00 1.86 1.74 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.31 7.81 104 Y 7.76 5.91 0.00 3.06 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 0.00 105 D 8.93 5.19 0.00 2.66 2.63 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 0.00 106 I 8.40 5.08 1.94 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 1.37 0.82 0.96 0.00 0.00 107 D 9.03 4.83 0.00 2.70 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.69 4.16 0.00 1.73 1.70 1.00 1.11 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 0.00 109 P 0.00 4.29 0.00 2.04 2.11 0.00 3.86 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 110 N 8.58 4.44 0.00 2.74 2.87 0.00 0.00 7.40 7.51 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 0.00 111 K 7.71 3.97 0.00 2.28 2.14 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.56 1.45 7.81 112 K 7.86 5.12 0.00 1.87 1.66 0.00 1.64 0.00 0.00 1.85 0.00 0.00 2.85 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.38 1.39 7.81 113 V 9.06 4.86 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 0.82 0.00 0.00 1.02 0.00 0.00 114 C 9.10 5.25 0.00 2.95 2.93 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 0.00 115 I 8.79 5.24 2.24 0.00 0.00 0.69 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 0.96 1.10 0.00 0.00 116 E 9.20 5.18 0.00 2.25 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 2.22 2.33 0.00 117 S 8.54 4.89 0.00 3.96 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 0.00 118 E 8.41 4.22 0.00 1.84 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 2.22 1.98 0.00 119 H 7.92 4.89 0.00 3.19 3.24 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 S 8.21 4.44 0.00 3.92 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 0.00 121 M 8.52 4.00 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 122 D 7.99 4.33 0.00 2.88 2.87 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 0.00 123 T 7.77 3.82 4.34 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 1.10 0.00 0.00 124 L 7.78 3.79 0.00 1.68 1.29 1.02 0.64 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 0.00 125 L 7.79 3.71 0.00 1.61 1.66 0.94 0.85 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 0.00 126 A 7.67 3.97 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 0.00 127 T 7.71 3.90 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 1.12 0.00 0.00 128 L 7.96 3.85 0.00 1.59 1.55 0.27 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 129 K 7.73 3.87 0.00 1.85 1.86 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.56 7.81 130 K 7.78 4.03 0.00 1.82 1.84 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.51 7.81 131 T 7.40 4.09 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 1.19 0.00 0.00 132 G 8.06 3.83 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 0.00 133 K 7.75 4.66 0.00 1.65 1.66 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.47 7.81 134 T 9.16 4.09 4.50 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 0.00 0.00 0.00 1.22 0.00 0.00 135 V 8.08 4.72 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 0.69 0.00 0.00 0.97 0.00 0.00 136 S 8.85 4.88 0.00 3.82 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 0.00 137 Y 8.96 4.88 0.00 3.04 2.93 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 0.00 138 L 7.30 4.21 0.00 1.45 1.50 0.87 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 139 G 5.52 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 7.66 5.04 0.00 1.66 1.53 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 141 E 8.36 4.13 0.00 1.98 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 2.29 2.24 0.00