NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.5413 0.0000 0.0000 62.5905 33.5165 174.7475 3 M 5.2834 8.6885 121.5179 53.3585 34.9556 173.6647 4 I 4.9754 9.0996 123.7181 59.6113 42.1419 174.2646 5 S 5.2592 8.7486 118.6038 56.8976 66.4592 172.9164 6 C 4.7695 9.1378 122.3080 57.9067 34.2471 172.4198 7 D 5.3396 8.8840 127.2557 53.7782 41.2690 175.9438 8 M 4.7568 9.4429 122.9576 53.0151 36.6435 175.4816 9 R 4.2181 7.6890 118.8610 56.0992 30.9904 176.2447 10 Y 4.1135 8.6198 123.5121 58.3682 39.0561 174.6383 11 G 3.7171 7.9381 113.7400 45.8849 0.0000 175.1067 12 R 4.2024 7.4872 119.1656 56.1210 30.8469 177.0869 13 T 4.2136 8.9464 112.6638 61.3210 71.0001 175.7092 14 D 4.4255 8.6856 123.9547 58.1125 40.8332 179.7019 15 E 3.9969 8.0638 118.4146 61.1925 29.8489 181.9102 16 Q 4.2044 8.0779 119.4219 58.8354 28.8244 179.2182 17 K 4.0307 8.1457 119.6282 59.0364 32.0330 179.0965 18 R 4.3530 8.1335 116.8849 57.3093 29.7847 178.4138 19 A 4.0939 7.7412 121.4465 54.4179 18.4248 179.4126 20 L 3.8545 7.9942 119.5591 58.3668 42.1437 179.2739 21 S 3.8671 8.2794 114.0827 61.3568 62.9366 176.3141 22 A 4.0532 8.1592 124.6132 54.6820 17.9846 179.8957 23 G 3.4632 8.0277 104.3201 47.9470 0.0000 176.0596 24 L 3.8798 8.1559 122.0583 57.2687 41.4882 179.5638 25 L 3.8853 8.0640 119.4225 57.6090 41.4970 179.2569 26 R 3.8348 7.8369 118.5665 59.6687 30.0264 178.9295 27 V 3.5904 7.5285 111.6804 64.5996 31.5681 178.7834 28 I 3.6903 7.7162 119.4913 64.1784 36.7809 178.4648 29 S 4.4241 8.1988 115.6367 60.9546 62.0435 176.1402 30 E 3.9230 8.0633 119.6318 59.4854 29.3209 179.0345 31 A 4.1168 7.9965 119.5027 54.9096 18.8104 179.0614 32 T 4.2368 8.3328 113.7428 63.4182 68.8532 176.9796 33 G 4.0242 8.3624 108.0945 45.2262 0.0000 172.9533 34 E 4.2908 7.5474 120.7734 54.1966 30.5989 174.1329 35 P 4.5270 0.0000 0.0000 62.4262 32.4233 177.1746 36 R 3.8270 8.9571 121.7249 60.4290 30.0817 179.4050 37 E 4.1400 8.1831 111.8032 58.1453 29.8430 179.3800 38 N 4.8365 8.3025 113.3430 53.6441 38.6444 174.5401 39 I 4.6432 7.5298 120.3833 59.6347 38.5026 175.1686 40 F 4.6837 9.6072 131.1306 57.6123 40.8837 174.2354 41 F 5.4144 7.4773 126.7603 56.4325 42.2194 173.7822 42 V 3.9983 8.3678 125.0665 59.6594 34.5272 174.3443 43 I 4.6617 7.8579 123.5941 59.5479 39.5149 174.9845 44 R 4.6642 9.2165 125.6309 54.5155 32.7224 174.9740 45 E 5.7792 8.0996 122.7609 54.5582 32.7136 174.8246 46 G 4.2481 8.2142 106.8260 46.0416 0.0000 173.0636 47 S 4.8066 8.5916 115.7527 57.9809 63.7515 176.1128 48 G 3.7126 10.1700 112.9724 48.8357 0.0000 175.9338 49 I 3.9718 7.7647 118.3863 63.1161 38.1548 176.1525 50 N 4.5954 8.1746 116.2911 54.6206 38.8480 174.7965 51 F 4.7260 8.4721 118.2668 55.3057 41.3130 174.4931 52 V 4.6917 8.3905 124.0812 61.0077 33.7375 174.2702 53 E 4.5172 8.8696 126.9436 55.7884 31.9262 175.9898 54 H 4.3904 9.4618 121.2175 57.0709 25.9818 176.5119 55 G 3.9971 8.5625 109.4276 46.2568 0.0000 174.4809 56 E 4.7164 7.6282 115.9071 54.0962 31.6682 181.0485 57 H 4.8143 8.6933 120.3066 55.1085 29.5860 174.9448 58 L 4.7607 8.4656 122.5450 53.2538 42.9707 174.8633 59 P 4.7049 0.0000 0.0000 62.0084 32.6652 175.5359 60 D 4.5621 8.8028 121.0003 55.1000 41.6956 176.2618 61 Y 4.2380 8.5495 120.8020 57.9839 38.8947 175.1896 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 P 0.00 4.54 0.00 2.12 2.06 0.00 3.60 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 2.02 2.14 0.00 3 M 8.69 5.28 0.00 2.17 2.05 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 2.63 2.78 0.00 4 I 9.10 4.98 1.93 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 1.29 0.95 0.91 0.00 0.00 5 S 8.75 5.26 0.00 3.86 3.86 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 6 C 9.14 4.77 0.00 3.24 2.94 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 7 D 8.88 5.34 0.00 2.72 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 8 M 9.44 4.76 0.00 1.66 1.82 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.39 0.00 9 R 7.69 4.22 0.00 1.36 1.77 0.00 3.26 0.00 0.00 3.05 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.73 0.00 10 Y 8.62 4.11 0.00 3.02 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 11 G 7.94 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 12 R 7.49 4.20 0.00 1.61 1.77 0.00 2.79 0.00 0.00 2.85 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.80 0.00 13 T 8.95 4.21 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 1.21 0.00 0.00 14 D 8.69 4.43 0.00 2.72 2.75 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 15 E 8.06 4.00 0.00 1.97 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 0.00 2.31 1.97 0.00 16 Q 8.08 4.20 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 17 K 8.15 4.03 0.00 1.95 1.84 0.00 1.59 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.58 7.81 18 R 8.13 4.35 0.00 1.99 2.19 0.00 3.16 0.00 0.00 3.27 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.50 0.00 19 A 7.74 4.09 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 20 L 7.99 3.85 0.00 2.00 1.94 1.06 0.70 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 21 S 8.28 3.87 0.00 4.29 4.45 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 22 A 8.16 4.05 1.37 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 23 G 8.03 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.16 3.88 0.00 1.42 1.21 0.79 0.19 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 25 L 8.06 3.89 0.00 1.76 1.66 0.78 0.65 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 26 R 7.84 3.83 0.00 1.93 2.08 0.00 3.08 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 27 V 7.53 3.59 2.04 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 0.73 0.00 0.00 0.95 0.00 0.00 28 I 7.72 3.69 1.97 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.42 0.89 0.00 0.00 29 S 8.20 4.42 0.00 3.97 4.03 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 30 E 8.06 3.92 0.00 2.10 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 2.33 2.44 0.00 31 A 8.00 4.12 1.33 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 32 T 8.33 4.24 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 1.24 0.00 0.00 33 G 8.36 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 0.00 0.00 0.00 34 E 7.55 4.29 0.00 2.12 1.83 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 2.29 2.29 0.00 35 P 0.00 4.53 0.00 2.26 2.16 0.00 3.79 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.99 0.00 36 R 8.96 3.83 0.00 1.89 2.05 0.00 3.12 0.00 0.00 3.36 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 37 E 8.18 4.14 0.00 1.98 1.87 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 2.23 1.90 0.00 38 N 8.30 4.84 0.00 2.82 2.88 0.00 0.00 6.85 8.22 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 39 I 7.53 4.64 2.01 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 1.09 0.46 0.89 0.00 0.00 40 F 9.61 4.68 0.00 3.17 3.01 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 0.00 0.00 0.00 41 F 7.48 5.41 0.00 2.68 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.37 4.00 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 0.79 0.00 0.00 0.88 0.00 0.00 43 I 7.86 4.66 1.65 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 1.00 -0.28 0.89 0.00 0.00 44 R 9.22 4.66 0.00 1.87 1.84 0.00 3.30 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 45 E 8.10 5.78 0.00 2.01 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 2.23 2.15 0.00 46 G 8.21 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 0.00 0.00 0.00 0.00 47 S 8.59 4.81 0.00 3.98 3.86 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 48 G 10.17 3.71 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 0.00 0.00 0.00 49 I 7.76 3.97 1.92 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.84 0.96 0.00 0.00 50 N 8.17 4.60 0.00 3.18 2.67 0.00 0.00 6.79 7.58 0.00 0.00 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 F 8.47 4.73 0.00 3.09 2.96 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 52 V 8.39 4.69 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 0.78 0.00 0.00 0.60 0.00 0.00 53 E 8.87 4.52 0.00 1.96 1.63 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 2.25 2.41 0.00 54 H 9.46 4.39 0.00 3.33 3.38 0.00 5.78 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.56 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.63 4.72 0.00 1.92 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 2.15 2.12 0.00 57 H 8.69 4.81 0.00 3.17 3.33 0.00 5.66 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 L 8.47 4.76 0.00 1.82 1.63 0.89 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.70 0.00 2.10 2.07 0.00 3.84 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 60 D 8.80 4.56 0.00 2.62 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.55 4.24 0.00 2.82 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00