NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.4171 8.0276 120.5807 54.5262 43.9899 175.1980 2 K 4.2883 9.1144 123.5633 55.3304 34.3073 173.2728 3 C 5.2632 9.4353 124.7079 55.1027 44.0942 174.3059 4 K 4.7916 8.1450 118.8261 55.7533 33.0804 178.2604 5 K 4.3099 8.0183 122.1724 55.2833 33.5641 176.1659 6 L 4.0172 8.1812 117.6797 58.9070 42.0398 177.5203 7 V 3.9908 7.4774 117.4953 61.5838 33.0359 175.2772 8 P 4.8786 0.0000 0.0000 62.9978 30.3042 176.1297 9 L 4.2476 7.6382 117.8194 56.0054 44.5121 177.0300 10 F 5.1577 7.8173 114.7281 55.6604 43.7058 174.0713 11 S 5.0764 8.7609 113.8158 56.7555 66.0909 172.9527 12 K 4.7194 8.8206 121.1724 55.4467 36.2917 174.5502 13 T 5.4593 8.2056 119.8705 61.4467 70.1934 175.2793 14 C 4.6301 8.7614 124.2512 55.8574 35.1191 172.0856 15 P 4.4769 0.0000 0.0000 61.2059 32.2109 175.0390 16 A 4.0045 8.2806 120.8143 54.0127 18.7469 176.5390 17 G 4.3148 9.1750 114.3936 45.6815 0.0000 174.9400 18 K 4.7599 7.2875 123.2243 54.4557 31.7130 175.2856 19 N 4.8205 8.4437 121.0028 53.3821 39.3301 175.0372 20 L 4.8582 7.4158 118.6771 53.2122 46.2018 176.1855 21 C 5.0916 8.9454 121.4701 56.4748 38.9186 172.3403 22 Y 5.5983 8.4276 120.4921 55.0858 41.3927 174.6501 23 K 4.6790 8.9563 118.9772 55.7538 36.1699 174.7043 24 M 5.2290 9.1356 125.4412 53.5903 34.0021 175.1463 25 F 5.3247 8.8701 117.4669 55.4640 42.1181 173.7881 26 M 4.4381 8.6323 119.5863 54.0370 33.3963 177.8614 27 V 3.6847 7.9537 120.6413 63.7976 31.7946 177.3914 28 A 4.0651 7.9324 123.2212 55.1223 18.3421 177.3018 29 A 4.7938 7.7097 115.2406 50.1693 22.3025 174.6607 30 P 4.5030 0.0000 0.0000 65.1146 32.3598 176.3544 31 H 4.8387 7.7192 117.3215 53.7194 29.4421 174.4257 32 V 4.3727 7.1363 118.7547 61.3505 32.7312 171.3196 33 P 4.7969 0.0000 0.0000 62.1701 32.4204 176.8298 34 V 4.4644 8.0051 118.7611 62.9405 33.5140 176.1114 35 K 4.5373 7.6619 116.3515 56.1771 35.1539 174.5162 36 R 4.5596 8.2866 119.9134 55.0503 34.8045 174.8248 37 G 3.8512 6.0150 105.1177 46.5199 0.0000 171.6384 38 C 5.3092 9.0229 117.9812 55.4246 38.1362 172.7587 39 I 4.4998 8.6739 121.8172 60.5622 41.1816 174.1788 40 D 4.5755 8.7606 119.3176 55.1010 42.2613 176.3580 41 V 4.4351 7.4224 116.2179 59.6660 33.7067 175.2114 42 C 4.5691 8.5014 122.2161 54.8298 44.4865 171.6890 43 P 4.5971 0.0000 0.0000 61.6212 31.9945 175.7609 44 K 4.1038 8.4300 120.0887 56.6135 32.6496 176.0160 45 S 4.2573 8.5020 121.7521 57.1857 63.9171 173.8521 46 S 4.7142 7.4819 118.9513 56.0300 65.4888 174.5339 47 L 3.9739 8.3259 119.8321 57.8818 41.0152 178.4513 48 L 3.9006 7.7164 119.8265 57.5763 42.4744 176.3241 49 V 4.2367 7.6864 110.5142 59.2968 34.9860 174.3356 50 K 4.3160 7.5868 120.5707 54.7422 36.4689 175.0506 51 Y 5.4358 8.0875 118.9141 56.4535 41.7998 175.2618 52 V 4.6883 8.7384 121.7309 61.4394 35.1273 173.6336 53 C 5.8047 8.6805 123.1470 55.6837 39.1664 172.1813 54 C 4.9760 8.7215 113.2843 54.2009 44.7666 173.9698 55 N 4.9275 8.4535 120.6607 51.5017 35.9729 173.1523 56 T 4.7272 7.0702 108.7162 60.2870 72.7446 174.0193 57 D 4.3472 8.6219 122.2858 55.5429 41.7369 176.9761 58 K 3.8270 8.0583 122.3722 57.9978 32.1364 172.8541 59 C 4.4197 8.0346 114.5561 58.5092 43.0277 173.6679 60 N 4.4831 7.9585 121.0696 52.4780 37.2132 174.5734 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 1 L 8.03 4.42 0.00 1.63 1.67 0.93 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 2 K 9.11 4.29 0.00 1.80 1.95 0.00 1.28 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.49 7.81 3 C 9.44 5.26 0.00 2.90 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 4 K 8.15 4.79 0.00 1.60 1.71 0.00 1.69 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.54 7.81 5 K 8.02 4.31 0.00 1.93 1.82 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.59 7.81 6 L 8.18 4.02 0.00 1.63 1.72 1.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 7 V 7.48 3.99 2.18 0.00 0.00 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 0.97 0.00 0.00 8 P 0.00 4.88 0.00 2.18 2.07 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 9 L 7.64 4.25 0.00 1.49 0.53 0.95 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 10 F 7.82 5.16 0.00 3.07 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.76 5.08 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 12 K 8.82 4.72 0.00 1.87 1.62 0.00 1.50 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.46 7.81 13 T 8.21 5.46 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 1.25 0.00 0.00 14 C 8.76 4.63 0.00 2.97 3.12 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 0.00 0.00 0.00 15 P 0.00 4.48 0.00 2.22 2.20 0.00 3.75 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 16 A 8.28 4.00 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 17 G 9.17 4.31 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 0.00 18 K 7.29 4.76 0.00 2.01 1.85 0.00 1.63 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.57 1.53 7.81 19 N 8.44 4.82 0.00 2.72 2.89 0.00 0.00 6.95 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.42 4.86 0.00 1.58 1.55 1.01 0.97 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 21 C 8.95 5.09 0.00 2.91 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 8.43 5.60 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 23 K 8.96 4.68 0.00 1.88 1.90 0.00 1.29 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.59 1.50 7.81 24 M 9.14 5.23 0.00 2.18 2.33 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.05 0.00 25 F 8.87 5.32 0.00 3.28 3.09 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 0.00 0.00 0.00 26 M 8.63 4.44 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.51 0.00 27 V 7.95 3.68 2.06 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 0.72 0.00 0.00 0.93 0.00 0.00 28 A 7.93 4.07 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 29 A 7.71 4.79 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 30 P 0.00 4.50 0.00 2.18 2.23 0.00 3.75 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 31 H 7.72 4.84 0.00 2.98 3.14 0.00 5.77 0.00 0.00 0.00 0.00 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 7.14 4.37 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.95 0.00 0.00 33 P 0.00 4.80 0.00 2.28 2.11 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 34 V 8.01 4.46 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.98 0.00 0.00 35 K 7.66 4.54 0.00 1.85 1.94 0.00 1.51 0.00 0.00 1.87 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.52 7.81 36 R 8.29 4.56 0.00 1.53 1.71 0.00 3.28 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 1.52 1.62 0.00 37 G 6.01 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 38 C 9.02 5.31 0.00 2.99 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 39 I 8.67 4.50 1.71 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.07 0.96 0.00 0.00 40 D 8.76 4.58 0.00 2.74 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 41 V 7.42 4.44 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 0.75 0.00 0.00 0.93 0.00 0.00 42 C 8.50 4.57 0.00 3.00 3.07 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 0.00 0.00 0.00 43 P 0.00 4.60 0.00 2.25 1.93 0.00 3.83 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.53 0.00 44 K 8.43 4.10 0.00 1.75 1.80 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.53 7.81 45 S 8.50 4.26 0.00 3.85 3.66 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.48 4.71 0.00 3.87 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 47 L 8.33 3.97 0.00 1.61 1.72 0.89 0.89 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 48 L 7.72 3.90 0.00 1.66 1.56 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 49 V 7.69 4.24 1.96 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 0.83 0.00 0.00 0.77 0.00 0.00 50 K 7.59 4.32 0.00 1.10 1.55 0.00 1.54 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.15 1.35 7.81 51 Y 8.09 5.44 0.00 2.86 2.79 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 0.00 0.00 0.00 52 V 8.74 4.69 2.20 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 0.98 0.00 0.00 1.03 0.00 0.00 53 C 8.68 5.80 0.00 2.92 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 54 C 8.72 4.98 0.00 2.99 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 8.45 4.93 0.00 2.83 2.90 0.00 0.00 5.89 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 56 T 7.07 4.73 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 57 D 8.62 4.35 0.00 2.69 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 8.06 3.83 0.00 1.90 1.86 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.34 7.81 59 C 8.03 4.42 0.00 3.10 3.35 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 60 N 7.96 4.48 0.00 2.86 2.77 0.00 0.00 5.88 7.52 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