NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.5199 8.3249 122.8242 58.5228 40.6546 174.2936 2 V 4.2836 7.5916 117.5517 60.5521 35.2845 172.0182 3 N 4.7605 8.6431 118.1739 54.5929 38.4310 173.8492 4 Q 4.5916 8.1528 121.2840 54.3253 33.3004 173.7956 5 H 5.0792 8.6985 116.0933 54.2169 29.0265 174.7281 6 L 4.7337 9.1951 126.9653 53.4229 43.8395 175.2493 7 C 4.9078 8.5850 122.8416 55.0674 43.3382 175.5373 8 G 4.8032 8.4705 109.5875 49.4885 0.0000 175.8036 9 S 4.1187 7.7241 116.8887 61.4792 62.7913 175.9936 10 D 4.4705 7.8792 121.4120 56.3154 40.7745 178.6261 11 L 3.9549 9.0896 122.3889 58.3909 41.9541 179.3182 12 V 3.0373 8.0067 112.4603 64.0742 31.2391 178.4254 13 E 4.2554 7.8205 118.6200 59.1441 29.3474 178.7775 14 A 4.0217 8.5872 120.8838 55.5182 18.5013 179.7101 15 L 3.8082 8.4955 117.9030 58.0589 41.6466 179.1567 16 Y 3.9726 8.7911 120.1083 59.8393 38.3313 177.5247 17 L 4.0213 7.9162 121.3262 57.8721 42.5235 178.4623 18 V 3.6603 8.2147 112.2275 64.8018 31.7951 177.4750 19 C 4.4294 8.7943 116.6687 58.4446 40.1247 173.8146 20 G 3.7421 7.9646 110.6788 45.5888 0.0000 173.6368 21 E 4.6211 7.3808 115.0315 54.8213 31.8797 177.8190 22 R 3.5728 8.0167 118.0513 56.7145 29.9865 173.4308 23 G 3.7082 7.7591 112.9486 45.0518 0.0000 173.0373 24 F 4.9632 8.4886 121.9631 55.8079 40.6326 173.9875 25 F 3.8068 6.6454 110.7862 56.3630 41.2095 172.5460 26 Y 4.9906 8.4237 119.9162 56.1144 40.6070 175.3022 27 T 4.4130 8.7818 121.1473 62.0310 68.9657 173.6946 28 D 4.3094 8.3857 121.8316 55.0287 38.1485 174.7294 29 P 4.7036 0.0000 0.0000 61.5301 29.7859 175.5862 30 T 4.4998 6.8848 111.7291 62.9519 73.7032 177.5339 31 G 3.9412 7.7839 113.6731 43.0491 0.0000 172.8537 32 G 3.6259 8.5200 108.2843 46.4983 0.0000 173.9426 33 G 4.0279 8.6555 110.7265 45.7646 0.0000 172.2564 34 P 4.3818 0.0000 0.0000 64.9359 32.4297 177.5754 35 R 4.6064 7.5142 114.9602 55.2329 29.9323 178.1618 36 R 4.1148 8.1495 117.9640 60.2464 29.4782 178.1451 37 G 4.0380 8.2006 104.7031 47.9928 0.0000 174.6898 38 I 3.9282 7.7712 121.7976 63.2293 37.2869 178.2121 39 V 3.5912 7.4345 118.3427 66.0953 31.0892 177.3190 40 E 4.2897 9.2357 117.9993 57.5557 29.6540 176.9969 41 Q 4.1338 8.3314 120.5583 56.8539 28.5087 176.5903 42 C 3.8615 8.6961 116.3055 60.6098 41.5294 177.2810 43 C 4.2761 7.6046 114.5233 59.4442 43.5127 174.3488 44 H 4.5305 8.1511 115.2699 58.3704 29.4591 175.8980 45 S 4.9043 8.3990 113.0192 57.8472 63.4501 176.0723 46 I 4.6988 8.2108 115.4941 61.5517 40.7765 172.3084 47 C 4.9034 8.5129 119.6931 56.6894 42.7967 172.9745 48 S 4.9799 8.0076 113.6375 55.7980 65.1127 174.3225 49 L 3.4295 8.0241 123.3700 58.2096 40.8607 179.3844 50 Y 4.0131 7.8913 116.7860 60.3506 37.9273 178.5822 51 Q 3.4201 7.6992 120.5204 58.4643 28.7636 178.5846 52 L 4.3669 7.5247 119.0154 57.2197 41.4676 178.9212 53 E 3.9321 8.6255 120.2907 58.3375 29.8425 177.5797 54 N 4.5340 8.0695 117.0675 54.6782 38.1622 175.9396 55 Y 4.7025 6.9973 117.4056 59.9509 38.1457 175.1984 56 C 4.7197 7.6557 117.4885 55.6341 42.5698 173.4682 57 N 4.7877 7.9228 117.1842 54.4304 36.5545 174.3435 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 F 8.32 4.52 0.00 3.11 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 2 V 7.59 4.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.88 0.00 0.00 3 N 8.64 4.76 0.00 2.61 2.84 0.00 0.00 6.59 7.77 0.00 0.00 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 Q 8.15 4.59 0.00 1.90 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 5.65 0.00 0.00 0.00 0.00 0.00 1.89 2.01 0.00 5 H 8.70 5.08 0.00 3.03 3.31 0.00 5.71 0.00 0.00 0.00 0.00 6.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 9.20 4.73 0.00 1.82 1.59 0.95 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.58 4.91 0.00 3.02 2.99 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 0.00 0.00 0.00 8 G 8.47 4.80 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 9 S 7.72 4.12 0.00 3.87 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 10 D 7.88 4.47 0.00 2.78 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 11 L 9.09 3.95 0.00 2.02 1.81 1.04 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.01 3.04 1.84 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 0.58 0.00 0.00 0.95 0.00 0.00 13 E 7.82 4.26 0.00 1.97 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 2.09 2.19 0.00 14 A 8.59 4.02 1.36 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 0.00 0.00 15 L 8.50 3.81 0.00 1.67 1.27 1.11 0.71 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 16 Y 8.79 3.97 0.00 2.68 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 17 L 7.92 4.02 0.00 1.87 1.59 1.14 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 18 V 8.21 3.66 2.00 0.00 0.00 0.00 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 0.91 0.00 0.00 19 C 8.79 4.43 0.00 3.13 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 7.96 3.74 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 0.00 0.00 0.00 21 E 7.38 4.62 0.00 1.91 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 2.24 2.20 0.00 22 R 8.02 3.57 0.00 1.83 2.24 0.00 3.39 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.57 0.00 23 G 7.76 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 24 F 8.49 4.96 0.00 3.02 3.04 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 0.00 0.00 0.00 25 F 6.65 3.81 0.00 2.90 2.93 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 0.00 26 Y 8.42 4.99 0.00 3.05 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 27 T 8.78 4.41 4.54 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 1.13 0.00 0.00 28 D 8.39 4.31 0.00 2.64 2.71 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 29 P 0.00 4.70 0.00 2.23 2.19 0.00 3.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 30 T 6.88 4.50 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 1.21 0.00 0.00 31 G 7.78 3.94 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 0.00 0.00 0.00 32 G 8.52 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 33 G 8.66 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 0.00 0.00 0.00 34 P 0.00 4.38 0.00 2.24 2.23 0.00 3.71 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.06 0.00 35 R 7.51 4.61 0.00 1.70 2.03 0.00 2.21 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.92 0.00 36 R 8.15 4.11 0.00 2.12 2.38 0.00 2.97 0.00 0.00 3.58 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.63 0.00 37 G 8.20 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 38 I 7.77 3.93 1.41 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.63 0.00 0.00 39 V 7.43 3.59 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 1.18 0.00 0.00 0.85 0.00 0.00 40 E 9.24 4.29 0.00 1.92 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.24 0.00 41 Q 8.33 4.13 0.00 2.26 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.68 0.00 0.00 0.00 0.00 0.00 2.54 2.46 0.00 42 C 8.70 3.86 0.00 3.16 3.32 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.60 4.28 0.00 3.06 3.30 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 44 H 8.15 4.53 0.00 3.35 3.39 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.40 4.90 0.00 3.82 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 46 I 8.21 4.70 1.83 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.12 1.01 0.00 0.00 47 C 8.51 4.90 0.00 2.77 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.01 4.98 0.00 4.01 3.94 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 49 L 8.02 3.43 0.00 1.58 1.54 0.78 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 50 Y 7.89 4.01 0.00 3.04 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.70 3.42 0.00 1.61 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.90 0.00 0.00 0.00 0.00 0.00 1.16 1.88 0.00 52 L 7.52 4.37 0.00 1.55 1.71 0.78 0.86 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 53 E 8.63 3.93 0.00 1.85 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 54 N 8.07 4.53 0.00 2.82 2.80 0.00 0.00 6.08 5.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Y 7.00 4.70 0.00 3.09 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 56 C 7.66 4.72 0.00 3.18 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.92 4.79 0.00 2.98 3.39 0.00 0.00 6.85 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00