NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 N 4.7043 8.4244 118.1213 53.2112 40.1414 173.0375 6 V 3.6429 8.3145 117.1583 66.1379 31.6206 177.2642 7 W 4.3901 8.4465 118.0950 58.3812 29.8621 175.3914 8 F 4.6667 8.0291 122.3589 58.0504 39.1504 175.9105 9 S 4.0037 8.1040 123.0777 59.7570 62.9723 173.8417 10 H 4.5127 5.8203 120.6570 53.1333 29.2753 171.4105 11 P 4.5784 0.0000 0.0000 61.4809 32.5953 177.4197 12 R 3.8548 8.4949 118.0641 59.1267 30.0641 176.2746 13 R 4.6865 7.4120 114.2129 54.1426 32.8502 176.0112 14 F 4.2696 8.8775 113.0201 59.5054 38.0738 176.1686 15 G 2.6507 6.0009 111.6412 43.1958 0.0000 176.5874 16 K 3.2890 7.6583 121.8001 57.2835 34.1925 175.5240 17 G 3.8329 7.9242 125.4071 45.9702 0.0000 173.3694 18 S 4.8622 7.9578 127.1002 57.6799 61.8167 176.5194 19 R 4.7629 8.5419 116.3741 54.3727 32.4836 174.1907 20 Q 4.6804 8.2179 118.1574 54.4385 33.1355 174.1434 21 C 4.5175 8.2896 119.4360 59.1360 32.4858 173.5652 22 R 4.3002 8.5788 123.2223 59.0309 29.7463 177.7793 23 V 3.6764 7.5055 116.1931 65.3704 31.9633 176.6624 24 C 4.5570 7.6296 119.9243 58.0753 33.1712 173.2921 25 S 4.3138 8.4130 114.2811 60.0775 63.3204 174.8302 26 S 4.3230 7.9761 117.2301 59.2143 63.1986 174.4718 27 H 4.8058 8.3644 115.7312 56.5895 30.3393 174.4110 28 T 3.9176 7.4397 114.7025 61.3553 65.0824 169.2034 29 G 3.7984 8.1553 116.7952 44.9890 0.0000 171.8230 30 L 4.7277 7.6394 132.6504 53.8879 40.5188 178.6178 31 V 4.4230 7.9430 125.7405 62.5462 34.3491 174.4272 32 R 4.1188 8.5891 125.7625 58.9145 30.4319 178.2609 33 K 3.9152 7.9996 115.8104 59.0273 32.3856 176.5911 34 Y 4.2461 7.5965 116.9868 55.8037 40.3867 175.3206 35 D 4.2801 8.7290 124.0740 55.4096 41.7595 175.8500 36 L 4.4135 7.1053 118.8284 54.6043 43.5172 174.3724 37 N 4.7689 8.7870 117.4758 54.0675 37.8846 174.6278 38 I 4.0321 8.4549 123.8874 64.0471 38.9637 175.7226 39 C 4.7609 8.1559 114.7232 58.7261 35.4228 175.0990 40 R 4.2013 9.2945 122.5768 58.3822 30.6516 178.8150 41 Q 3.9656 8.2363 116.9024 59.4724 28.9786 177.6793 42 C 4.6965 8.0035 112.2288 59.5257 28.5550 175.4067 43 F 4.3716 8.4979 124.9840 61.4502 39.1943 177.7732 44 R 3.8854 7.9541 118.8951 58.6195 30.5013 178.7453 45 E 3.9207 7.8967 118.3487 59.4433 29.4310 178.6469 46 K 4.5477 8.0592 113.7784 56.1645 32.3909 178.3056 47 A 4.2044 7.2879 121.6108 54.9490 18.7634 179.4954 48 N 4.4469 7.7429 113.7014 56.4777 38.4675 176.5097 49 D 4.4691 7.9316 121.7275 54.6558 40.7676 175.3840 50 I 4.3793 7.1443 117.9359 61.1723 41.5614 176.1226 51 G 3.8441 10.0705 116.7557 45.5727 0.0000 171.2710 52 F 4.7571 8.2400 119.8361 58.1511 42.3465 173.4287 53 H 4.4624 6.3412 120.3710 54.4103 32.3769 173.0601 54 K 4.3882 8.4074 125.2420 56.8131 31.9221 175.8385 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 N 8.42 4.70 0.00 2.57 2.79 0.00 0.00 6.88 6.79 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 6 V 8.31 3.64 2.26 0.00 0.00 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 1.00 0.00 0.00 7 W 8.45 4.39 0.00 3.33 3.23 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.03 4.67 0.00 3.22 3.03 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 9 S 8.10 4.00 0.00 3.66 3.76 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 10 H 5.82 4.51 0.00 2.54 2.72 0.00 5.95 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.58 0.00 2.15 2.09 0.00 3.79 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.89 0.00 12 R 8.49 3.85 0.00 1.78 1.97 0.00 3.21 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 13 R 7.41 4.69 0.00 1.74 1.87 0.00 3.27 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 14 F 8.88 4.27 0.00 3.18 3.22 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 0.00 15 G 6.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.66 3.29 0.00 1.79 2.02 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.40 7.81 17 G 7.92 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 18 S 7.96 4.86 0.00 3.98 3.24 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 0.00 19 R 8.54 4.76 0.00 1.81 1.87 0.00 3.17 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 20 Q 8.22 4.68 0.00 2.44 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.05 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 21 C 8.29 4.52 0.00 3.08 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 22 R 8.58 4.30 0.00 1.79 1.97 0.00 3.49 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.51 0.00 23 V 7.51 3.68 2.14 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 0.86 0.00 0.00 0.99 0.00 0.00 24 C 7.63 4.56 0.00 3.01 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 25 S 8.41 4.31 0.00 3.91 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 26 S 7.98 4.32 0.00 4.04 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 27 H 8.36 4.81 0.00 3.19 3.53 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 T 7.44 3.92 3.93 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 1.10 0.00 0.00 29 G 8.16 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 0.00 0.00 0.00 30 L 7.64 4.73 0.00 1.64 1.13 0.97 1.11 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 31 V 7.94 4.42 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 0.48 0.00 0.00 0.89 0.00 0.00 32 R 8.59 4.12 0.00 1.80 1.92 0.00 3.25 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 33 K 8.00 3.92 0.00 1.70 1.88 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.59 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.49 7.81 34 Y 7.60 4.25 0.00 3.05 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 35 D 8.73 4.28 0.00 2.56 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 36 L 7.11 4.41 0.00 1.94 1.69 1.03 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 37 N 8.79 4.77 0.00 2.90 3.10 0.00 0.00 6.82 7.45 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 38 I 8.45 4.03 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.50 0.93 0.00 0.00 39 C 8.16 4.76 0.00 3.08 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 40 R 9.29 4.20 0.00 1.91 2.10 0.00 3.34 0.00 0.00 3.44 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.63 0.00 41 Q 8.24 3.97 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 7.10 0.00 0.00 0.00 0.00 0.00 2.48 2.41 0.00 42 C 8.00 4.70 0.00 3.21 2.97 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 0.00 0.00 0.00 43 F 8.50 4.37 0.00 3.05 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 44 R 7.95 3.89 0.00 1.96 1.91 0.00 3.21 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 45 E 7.90 3.92 0.00 2.23 1.99 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 2.33 2.47 0.00 46 K 8.06 4.55 0.00 1.84 1.77 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.62 1.34 7.81 47 A 7.29 4.20 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 48 N 7.74 4.45 0.00 2.79 2.87 0.00 0.00 7.10 7.96 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 49 D 7.93 4.47 0.00 2.78 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 I 7.14 4.38 1.87 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 1.36 0.53 0.91 0.00 0.00 51 G 10.07 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 52 F 8.24 4.76 0.00 2.89 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 H 6.34 4.46 0.00 3.04 3.04 0.00 6.02 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 54 K 8.41 4.39 0.00 1.78 1.76 0.00 1.90 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.60 7.81