NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 H 4.1208 8.4449 120.3650 56.0733 31.0080 171.9895 3 Y 4.6684 7.1920 118.6138 55.9213 39.2708 172.5358 4 E 4.2535 9.3686 122.4302 56.4453 31.1581 176.0422 5 E 4.6455 8.6418 120.7899 54.7886 33.5587 175.0131 6 G 3.8616 8.7239 105.6930 43.7061 0.0000 171.2965 7 P 4.2992 0.0000 0.0000 64.1161 31.4597 177.4479 8 G 3.8438 8.8452 109.7234 45.7657 0.0000 173.8122 9 K 4.4440 8.0472 117.1986 55.8195 33.8676 176.1482 10 N 4.9293 7.8692 116.1833 52.2401 37.9637 174.5976 11 I 4.5271 7.0814 110.2021 59.4379 40.6059 173.1677 12 P 4.3802 0.0000 0.0000 63.6930 31.7467 175.8879 13 F 4.9581 7.1961 113.4358 54.8915 40.5172 174.3954 14 S 4.5314 8.4884 116.1939 57.6030 63.2020 174.2177 15 V 4.4920 7.9533 119.2541 61.1348 32.3749 176.6688 16 E 3.9698 8.1702 123.5656 58.1968 29.7277 177.0214 17 N 4.9104 7.8535 117.2993 51.0337 41.5775 174.9084 18 K 3.7133 8.3985 128.0211 59.3888 32.5445 178.9663 19 W 4.4770 7.7460 119.9137 59.3797 29.3423 178.3561 20 R 4.0003 8.8853 119.2306 59.1850 29.4168 178.2679 21 L 3.9644 8.2305 120.5746 58.1001 42.1134 178.6920 22 L 3.9572 7.8791 119.9597 58.0549 42.0224 178.8597 23 A 4.0582 8.1539 120.7205 55.3978 18.3196 179.4884 24 M 4.0054 8.1693 117.1562 59.0014 32.0052 178.9912 25 M 4.1282 8.3071 118.9427 58.5992 32.0022 179.0772 26 T 3.9900 8.1285 115.9348 66.6550 68.5947 176.8065 27 L 4.0002 8.0572 120.8692 57.9459 41.4989 178.9179 28 F 4.0621 8.5838 120.9925 61.6668 39.2681 177.2280 29 F 4.2762 8.7663 117.6891 60.2347 38.7295 178.2294 30 G 3.7009 8.5843 106.1614 47.7479 0.0000 175.9371 31 S 4.2252 8.4417 117.3204 61.0273 62.6852 176.8624 32 G 3.5253 7.4792 108.3780 47.6242 0.0000 175.2161 33 F 4.4581 8.1513 122.0644 60.8112 39.7973 176.7688 34 A 4.4623 8.7525 120.5608 54.5739 18.2261 179.0910 35 A 4.0186 8.0966 119.8271 55.3773 18.3065 178.0365 36 P 4.1039 0.0000 0.0000 65.7412 31.3210 178.8355 37 F 3.9481 7.9285 115.9986 60.6084 38.9026 177.5259 38 F 4.0107 8.5310 116.8740 59.9874 38.6164 178.0203 39 I 3.8509 7.8836 120.0561 64.1240 36.9233 178.3902 40 V 3.5232 8.0280 119.4964 66.0072 31.3340 178.0613 41 R 3.8390 8.1175 118.5048 59.5224 28.4485 177.9402 42 H 4.1548 8.3154 118.0676 59.5653 28.5257 177.3854 43 Q 4.2185 8.4206 120.0081 58.7962 28.2324 178.7152 44 L 4.2705 7.7440 119.5030 57.0698 41.7354 178.3056 45 L 4.4315 7.5707 116.5382 54.7666 41.7033 177.3581 46 K 4.2117 7.0388 119.7962 57.2460 33.1215 176.6295 47 K 3.9515 7.2170 121.0196 57.2503 33.4833 173.8222 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 H 8.44 4.12 0.00 3.00 3.22 0.00 5.68 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 Y 7.19 4.67 0.00 3.02 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 4 E 9.37 4.25 0.00 1.96 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 2.34 2.27 0.00 5 E 8.64 4.65 0.00 1.92 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 2.25 2.50 0.00 6 G 8.72 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 0.00 0.00 0.00 7 P 0.00 4.30 0.00 2.02 1.99 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 8 G 8.85 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 9 K 8.05 4.44 0.00 1.75 1.77 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.44 7.81 10 N 7.87 4.93 0.00 2.77 2.85 0.00 0.00 5.83 7.81 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 11 I 7.08 4.53 0.83 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.27 0.68 0.00 0.00 12 P 0.00 4.38 0.00 2.21 2.17 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.98 0.00 13 F 7.20 4.96 0.00 3.01 2.84 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 14 S 8.49 4.53 0.00 3.83 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 15 V 7.95 4.49 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 0.85 0.00 0.00 0.85 0.00 0.00 16 E 8.17 3.97 0.00 1.93 1.97 0.00 0.00 0.00 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 2.29 0.00 17 N 7.85 4.91 0.00 2.77 2.65 0.00 0.00 6.95 7.34 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 18 K 8.40 3.71 0.00 1.51 1.72 0.00 0.87 0.00 0.00 1.11 0.00 0.00 2.72 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.73 0.21 7.81 19 W 7.75 4.48 0.00 3.62 3.29 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.89 4.00 0.00 1.91 1.96 0.00 3.13 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 21 L 8.23 3.96 0.00 1.86 1.68 1.07 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.88 3.96 0.00 2.04 2.05 1.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.15 4.06 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.17 4.01 0.00 1.96 2.20 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 2.64 2.89 0.00 25 M 8.31 4.13 0.00 2.31 2.21 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 2.70 2.48 0.00 26 T 8.13 3.99 4.58 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 1.26 0.00 0.00 27 L 8.06 4.00 0.00 1.89 1.74 0.94 0.76 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 28 F 8.58 4.06 0.00 2.87 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 29 F 8.77 4.28 0.00 3.37 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 30 G 8.58 3.70 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 0.00 0.00 0.00 31 S 8.44 4.23 0.00 3.99 4.15 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 0.00 0.00 0.00 0.00 32 G 7.48 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 33 F 8.15 4.46 0.00 3.07 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 34 A 8.75 4.46 1.54 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 0.00 0.00 35 A 8.10 4.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.10 0.00 1.60 1.83 0.00 3.74 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 1.92 2.06 0.00 37 F 7.93 3.95 0.00 3.26 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.53 4.01 0.00 3.24 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 39 I 7.88 3.85 1.98 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 1.42 0.92 0.92 0.00 0.00 40 V 8.03 3.52 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 0.94 0.00 0.00 0.81 0.00 0.00 41 R 8.12 3.84 0.00 1.75 1.98 0.00 2.96 0.00 0.00 2.96 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 42 H 8.32 4.15 0.00 3.40 3.45 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 8.42 4.22 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 44 L 7.74 4.27 0.00 1.77 1.70 0.89 1.01 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 45 L 7.57 4.43 0.00 1.63 1.68 0.93 0.91 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 46 K 7.04 4.21 0.00 1.78 1.80 0.00 1.46 0.00 0.00 1.45 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.31 7.81 47 K 7.22 3.95 0.00 1.63 1.60 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.18 1.17 7.81