NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4180 0.0000 0.0000 61.9525 32.6512 176.1942 2 K 3.9942 8.5745 121.7063 55.8468 32.6096 175.4484 3 I 3.9010 9.2657 125.4433 61.3797 38.5696 175.3827 4 K 4.4244 8.5347 124.9718 55.3404 33.0260 176.7175 5 T 4.1998 8.3622 114.4150 61.0775 69.8569 175.7278 6 V 3.8191 8.6919 125.0627 62.5850 29.0009 176.5065 7 R 3.7425 7.9422 121.1632 58.8520 29.9134 177.9370 8 G 3.9833 7.9051 107.1819 48.1335 0.0000 174.8823 9 A 4.3037 8.2579 122.8832 54.8082 18.2245 179.7271 10 A 4.3311 7.8495 115.0027 53.1296 17.7358 177.8437 11 K 4.6307 8.3910 115.2302 57.2811 33.1608 176.9792 12 R 4.3653 7.7686 114.3853 55.4400 32.1230 173.8894 13 F 5.2489 7.4178 115.5771 56.1496 43.9413 174.0457 14 K 4.3592 9.1033 114.2536 55.6609 35.1822 173.5849 15 K 3.5299 8.9487 129.1509 56.8448 32.9045 176.1423 16 T 4.8292 8.1853 116.1739 60.2923 70.5382 174.9931 17 G 3.8046 8.7020 108.9553 48.2506 0.0000 173.0025 18 K 4.2833 7.6485 118.8662 55.8810 34.5678 176.4182 19 G 3.6254 8.9824 105.9389 49.0392 0.0000 174.0221 20 G 4.0026 7.2831 108.2777 45.9332 0.0000 173.6774 21 F 4.4913 8.4022 114.4488 55.5077 41.8195 172.7997 22 K 4.4322 8.6613 125.8733 56.0385 33.5035 174.6039 23 H 4.6122 8.9093 120.6444 54.6075 30.1160 171.9001 24 K 4.5584 8.5210 119.1335 54.9153 35.0505 176.1079 25 H 4.6245 8.5190 120.9923 55.1825 29.6957 176.0573 26 A 4.2464 8.4190 125.3730 52.8210 20.3643 176.2206 27 N 4.2017 8.6768 110.3134 53.9946 36.0841 173.8963 28 L 4.8163 7.2711 112.8162 55.0604 42.9621 175.9080 29 R 4.5248 7.8674 110.2687 56.4533 32.6416 173.5695 30 H 4.7062 7.9635 117.6916 55.7732 32.9137 172.7877 31 I 3.2206 8.3482 118.2468 62.2046 35.4737 172.5870 32 L 4.6790 7.8017 124.7348 54.7078 44.4523 178.7467 33 T 3.8568 8.2578 112.6800 64.7119 67.1446 174.1371 34 K 4.5766 7.7531 118.6169 56.9494 33.4109 176.2649 35 K 4.5649 7.7130 117.0714 54.6449 35.9776 177.0124 36 A 4.0796 8.4921 124.3020 52.2585 19.2059 178.6018 37 T 3.8232 8.7793 116.3008 65.6489 68.3390 175.6292 38 K 3.8819 8.2050 121.6252 58.8299 32.0115 178.4783 39 R 3.8202 7.6491 119.0141 59.4653 30.5640 178.2483 40 K 4.1160 8.0438 117.9697 59.5637 32.0143 179.3904 41 R 3.9266 8.3297 117.3110 59.1129 29.9266 177.2743 42 H 4.6934 8.2296 114.9834 57.9820 29.4113 176.6307 43 L 4.2949 7.9266 118.7325 55.7732 41.7366 178.8747 44 R 4.1346 7.9565 118.3225 57.8175 30.3646 175.2015 45 P 4.4337 0.0000 0.0000 62.5228 31.9893 175.4898 46 K 4.5157 8.3379 118.2454 55.5069 34.2410 175.9119 47 A 4.3836 7.8732 117.6544 51.4233 21.9592 176.3604 48 M 4.5956 8.9036 121.4402 55.4511 33.1732 176.7653 49 V 4.0337 8.4460 113.4210 61.0019 32.4619 177.8740 50 S 4.1091 8.7983 117.3826 59.1674 62.9590 176.7621 51 K 3.6853 8.3440 124.6894 57.8579 32.9004 176.9674 52 G 3.7228 9.0868 107.9450 48.0185 0.0000 174.1450 53 D 4.6334 7.5743 117.8789 53.8615 41.8302 177.8922 54 L 3.8807 8.0888 122.1382 58.3401 41.5935 178.5912 55 G 3.9168 8.0612 103.3620 48.0695 0.0000 174.7057 56 L 4.0570 7.3808 120.0598 57.3443 42.0280 179.3781 57 V 3.2556 7.5027 117.2596 65.7774 32.0247 177.3403 58 I 4.0835 7.3810 118.0152 60.0492 34.0670 174.8830 59 A 4.6875 7.0976 121.1103 53.5821 26.3000 177.8904 60 C 4.3243 8.0759 113.2763 61.3545 29.2797 173.3299 61 L 4.9139 7.3183 118.9261 52.0367 41.4198 174.7689 62 P 4.1721 0.0000 0.0000 65.8357 31.8324 177.6104 63 Y 4.4426 7.9319 112.7913 58.0368 38.2193 175.3507 64 A 4.3088 7.8784 128.8933 52.6431 18.4185 178.3612 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 P 0.00 4.42 0.00 2.21 2.14 0.00 3.75 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.01 0.00 2 K 8.57 3.99 0.00 1.87 1.87 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.54 7.81 3 I 9.27 3.90 2.03 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.51 0.98 0.00 0.00 4 K 8.53 4.42 0.00 1.77 1.77 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.44 7.81 5 T 8.36 4.20 4.33 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 1.44 0.00 0.00 6 V 8.69 3.82 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 0.97 0.00 0.00 0.99 0.00 0.00 7 R 7.94 3.74 0.00 1.95 1.89 0.00 3.38 0.00 0.00 3.35 7.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.82 0.00 8 G 7.91 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.26 4.30 1.45 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 0.00 0.00 10 A 7.85 4.33 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 11 K 8.39 4.63 0.00 1.82 1.76 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.60 7.81 12 R 7.77 4.37 0.00 0.76 1.28 0.00 3.04 0.00 0.00 3.06 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.46 0.00 13 F 7.42 5.25 0.00 2.92 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 14 K 9.10 4.36 0.00 1.98 1.75 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.27 1.45 7.81 15 K 8.95 3.53 0.00 1.64 1.60 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.72 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.21 0.52 7.81 16 T 8.19 4.83 4.20 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 0.00 0.00 0.00 1.27 0.00 0.00 17 G 8.70 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 18 K 7.65 4.28 0.00 1.85 1.85 0.00 1.29 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.29 1.38 7.81 19 G 8.98 3.63 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 0.00 0.00 0.00 20 G 7.28 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 21 F 8.40 4.49 0.00 3.15 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 22 K 8.66 4.43 0.00 1.93 1.87 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.53 7.81 23 H 8.91 4.61 0.00 3.21 3.41 0.00 5.45 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.52 4.56 0.00 1.65 1.65 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.79 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.28 1.34 7.81 25 H 8.52 4.62 0.00 3.38 3.21 0.00 5.75 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 26 A 8.42 4.25 1.26 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 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.68 4.20 0.00 2.90 2.92 0.00 0.00 5.58 7.79 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 28 L 7.27 4.82 0.00 1.77 1.62 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.87 4.52 0.00 1.90 1.95 0.00 3.04 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.57 0.00 30 H 7.96 4.71 0.00 3.05 3.11 0.00 5.88 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 31 I 8.35 3.22 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.85 0.84 0.00 0.00 32 L 7.80 4.68 0.00 1.71 1.64 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.26 3.86 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 1.22 0.00 0.00 34 K 7.75 4.58 0.00 1.90 1.87 0.00 1.57 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.35 1.45 7.81 35 K 7.71 4.56 0.00 1.94 1.70 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.35 7.81 36 A 8.49 4.08 1.26 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 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.78 3.82 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 38 K 8.20 3.88 0.00 1.79 1.74 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.84 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.28 7.81 39 R 7.65 3.82 0.00 1.83 2.17 0.00 3.29 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 40 K 8.04 4.12 0.00 1.87 1.85 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.63 7.81 41 R 8.33 3.93 0.00 1.88 2.14 0.00 3.26 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 42 H 8.23 4.69 0.00 3.32 3.29 0.00 5.72 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.93 4.29 0.00 1.73 1.76 0.99 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 44 R 7.96 4.13 0.00 1.80 2.02 0.00 3.22 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 45 P 0.00 4.43 0.00 2.18 2.08 0.00 3.73 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 46 K 8.34 4.52 0.00 1.64 1.93 0.00 2.07 0.00 0.00 0.61 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.22 7.81 47 A 7.87 4.38 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 48 M 8.90 4.60 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.55 0.00 49 V 8.45 4.03 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 0.88 0.00 0.00 1.05 0.00 0.00 50 S 8.80 4.11 0.00 4.02 4.19 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.34 3.69 0.00 1.91 1.99 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.43 7.81 52 G 9.09 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 53 D 7.57 4.63 0.00 2.59 2.66 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 54 L 8.09 3.88 0.00 1.76 1.86 1.10 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.06 3.92 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 0.00 0.00 0.00 56 L 7.38 4.06 0.00 1.79 1.66 0.88 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.50 3.26 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.69 0.00 0.00 0.38 0.00 0.00 58 I 7.38 4.08 1.87 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.89 1.01 0.00 0.00 59 A 7.10 4.69 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 60 C 8.08 4.32 0.00 2.96 2.98 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 0.00 0.00 0.00 61 L 7.32 4.91 0.00 1.72 1.65 0.76 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.17 0.00 1.96 1.97 0.00 3.77 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.26 0.00 63 Y 7.93 4.44 0.00 3.00 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 64 A 7.88 4.31 1.60 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 0.00 0.00