NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 F 4.4446 8.3249 119.4317 57.7954 40.8725 173.8683 6 E 3.6748 8.9158 117.7469 55.9980 26.5755 175.3153 7 I 4.3405 6.7377 114.9900 60.0869 40.8892 170.3763 8 P 4.6336 0.0000 0.0000 62.4929 32.6784 176.5003 9 D 4.9332 8.2202 115.1316 54.1525 41.2003 178.6528 10 D 4.4721 8.2397 121.4826 56.5402 41.5294 176.4914 11 V 4.5391 7.0346 117.2321 58.8881 34.7089 174.9650 12 P 4.4674 0.0000 0.0000 62.7032 32.4659 174.3983 13 L 4.3776 8.0749 118.8383 52.9332 43.9483 173.7187 14 P 4.4836 0.0000 0.0000 61.7387 32.4160 175.7880 15 A 4.1424 8.3902 122.4960 52.9590 19.3370 177.1871 16 G 4.0166 8.7203 105.6193 45.9576 0.0000 174.8768 17 W 5.1452 7.7864 118.1367 55.4052 32.1361 175.6228 18 E 4.6157 9.2294 128.1757 55.9133 31.4679 174.3967 19 M 5.1773 8.0399 116.2275 54.2358 34.7411 173.7964 20 A 4.2170 7.5163 117.7117 50.9456 23.2705 175.2767 21 K 4.8001 8.6579 120.0071 55.3957 34.2112 176.1707 22 T 4.6581 8.5113 118.2969 61.1416 67.8361 174.1420 23 S 4.6054 7.2346 112.9541 58.7755 66.4872 176.5868 24 S 4.6159 8.6506 109.1992 58.6398 59.8280 174.0284 25 G 3.8364 8.2162 107.0651 45.6371 0.0000 172.5365 26 Q 4.3575 7.4744 121.1913 55.5523 27.2002 177.5140 27 R 4.8211 7.4121 117.8803 56.6066 26.9081 177.2032 28 Y 4.4985 8.9127 124.6819 57.8202 40.0657 175.7666 29 F 4.8650 9.8297 122.4933 56.5328 41.2198 175.0556 30 L 4.7079 9.1689 124.6764 53.5235 42.5485 175.6650 31 N 3.1400 8.4244 125.2495 52.9287 38.7165 175.2180 32 H 3.8986 8.6195 127.3835 58.9283 30.2806 177.2916 33 I 3.7456 7.6847 110.9630 63.1449 37.0835 175.5966 34 D 4.6623 7.3837 116.1789 52.7254 42.6778 175.1287 35 Q 3.2610 7.5976 116.3821 56.8928 26.0314 171.6064 36 T 4.6333 6.6820 115.9532 62.6973 74.1159 172.7653 37 T 5.1734 8.1144 111.8821 60.4908 71.3661 173.3784 38 T 4.3146 9.0412 118.2995 60.2667 71.3818 175.1951 39 W 5.1117 7.9472 126.3419 56.5830 29.8054 175.6884 40 Q 4.4835 9.1023 118.2268 58.0453 28.6737 174.8214 41 D 4.4269 8.0885 128.2985 54.9258 46.0008 176.2246 42 P 4.0364 0.0000 0.0000 65.7354 31.1856 177.6059 43 R 3.7177 7.0083 117.2046 58.2406 30.4531 176.6292 44 K 4.1353 7.6787 121.4998 57.1447 32.9020 176.7329 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 5 F 8.32 4.44 0.00 3.15 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 6 E 8.92 3.67 0.00 2.25 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 0.00 2.26 2.47 0.00 7 I 6.74 4.34 1.93 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.42 0.93 0.00 0.00 8 P 0.00 4.63 0.00 2.23 2.09 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 9 D 8.22 4.93 0.00 2.79 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 10 D 8.24 4.47 0.00 2.61 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.03 4.54 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 0.87 0.00 0.00 12 P 0.00 4.47 0.00 2.17 2.12 0.00 3.70 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 1.94 1.96 0.00 13 L 8.07 4.38 0.00 1.59 1.62 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.48 0.00 1.84 1.68 0.00 3.62 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.11 0.00 15 A 8.39 4.14 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.72 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 17 W 7.79 5.15 0.00 3.28 3.21 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 18 E 9.23 4.62 0.00 2.15 1.89 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 2.32 2.30 0.00 19 M 8.04 5.18 0.00 2.45 1.62 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.46 0.00 20 A 7.52 4.22 0.68 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 0.00 0.00 21 K 8.66 4.80 0.00 1.76 1.78 0.00 1.47 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.49 7.81 22 T 8.51 4.66 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 23 S 7.23 4.61 0.00 3.85 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.65 4.62 0.00 3.88 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 25 G 8.22 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.47 4.36 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.75 0.00 0.00 0.00 0.00 0.00 2.28 2.51 0.00 27 R 7.41 4.82 0.00 1.41 1.84 0.00 3.45 0.00 0.00 3.48 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 28 Y 8.91 4.50 0.00 2.77 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.83 4.87 0.00 3.48 3.58 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 0.00 0.00 0.00 0.00 30 L 9.17 4.71 0.00 1.63 1.57 0.98 0.56 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 31 N 8.42 3.14 0.00 1.44 2.08 0.00 0.00 6.56 8.70 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 32 H 8.62 3.90 0.00 3.13 3.19 0.00 5.66 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.68 3.75 1.91 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.79 0.98 0.00 0.00 34 D 7.38 4.66 0.00 2.62 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.60 3.26 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.33 0.00 0.00 0.00 0.00 0.00 2.29 2.22 0.00 36 T 6.68 4.63 4.10 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 1.13 0.00 0.00 37 T 8.11 5.17 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 1.13 0.00 0.00 38 T 9.04 4.31 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 39 W 7.95 5.11 0.00 3.48 3.18 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 0.00 0.00 0.00 0.00 40 Q 9.10 4.48 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 7.06 0.00 0.00 0.00 0.00 0.00 2.52 2.77 0.00 41 D 8.09 4.43 0.00 2.80 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.04 0.00 1.60 1.39 0.00 3.54 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.11 0.00 43 R 7.01 3.72 0.00 1.64 1.90 0.00 3.27 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.40 0.00 44 K 7.68 4.14 0.00 1.88 1.81 0.00 1.64 0.00 0.00 1.80 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.43 7.81