NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2765 8.3449 121.7110 56.1865 29.6309 172.6225 2 S 4.4108 8.0315 113.3988 58.1843 66.0122 172.9910 3 L 4.9086 8.1595 121.2231 53.0214 46.4893 176.9435 4 I 4.0250 8.3176 120.5116 63.1821 37.8865 175.6323 5 D 4.5563 8.4063 120.3043 54.2635 45.8471 174.9406 6 E 3.8246 8.4917 116.2108 57.4306 27.3343 174.4287 7 D 4.2862 7.8911 116.7578 55.4390 38.6302 174.1003 8 A 4.9169 7.3452 113.0099 52.2385 20.0092 177.9432 9 V 4.3988 7.3408 112.4806 60.7736 35.6338 175.6752 10 C 4.8141 8.1837 124.2852 59.2431 32.0516 173.7809 11 S 4.4544 8.3066 117.6314 59.5990 63.2544 175.5960 12 I 3.9428 7.8592 120.5038 63.5206 35.6978 176.1455 13 C 4.7423 7.7337 111.2994 56.9038 30.5436 173.7283 14 M 4.0855 8.0815 117.4838 55.6636 29.2775 175.7071 15 D 4.8283 7.6682 117.5063 52.6208 43.5747 176.7380 16 G 4.3033 8.4551 119.1540 44.5389 0.0000 174.8618 17 E 4.3786 7.5070 118.0051 54.1202 30.4952 176.8060 18 S 4.3046 8.5319 118.8027 58.1262 62.0439 173.1612 19 Q 4.7559 8.6915 126.6825 53.4466 32.0376 176.7770 20 N 4.3601 8.8691 117.9587 57.0642 39.1004 176.1747 21 S 4.2002 8.1595 110.7355 60.7784 62.6787 173.2364 22 N 5.0492 7.7810 116.8572 51.3804 40.8102 172.9226 23 V 4.2716 8.6180 116.9715 59.9373 33.2570 175.4391 24 I 4.0243 7.9880 126.2412 60.8123 37.5861 175.1284 25 L 4.4482 8.3272 129.7881 54.3233 42.9725 176.0735 26 F 5.2439 8.8131 120.7475 56.1937 41.5856 176.3821 27 C 5.4344 8.7096 120.0708 59.6717 28.7198 172.1959 28 D 4.7829 8.8055 116.2738 55.0018 42.6112 175.7281 29 M 4.4547 7.5845 115.4975 57.0892 34.2810 176.4299 30 C 4.1590 7.7437 114.2800 59.3262 30.3488 173.7082 31 N 4.4780 8.3217 116.4998 53.6690 36.7192 173.3063 32 L 4.1791 7.9677 117.8213 54.5611 43.7601 175.1071 33 A 4.8951 8.1870 126.8061 50.1313 21.7398 175.6492 34 V 4.5142 8.0260 114.7648 60.0288 36.9022 173.5255 35 H 5.1516 8.9334 122.2928 55.3928 29.2706 176.6732 36 Q 3.8030 8.8717 120.2460 58.7153 28.6305 178.1770 37 E 4.0106 8.0194 116.9159 58.3332 30.2794 177.4225 38 C 4.3099 7.9867 115.8707 62.7249 28.5081 174.2968 39 Y 4.0119 8.1623 120.2012 59.4248 38.4950 175.8373 40 G 4.2903 8.3984 108.1965 45.7377 0.0000 172.9835 41 V 4.3918 8.3455 119.4686 60.0275 33.1602 173.5863 42 P 4.5216 0.0000 0.0000 65.1708 31.3737 175.4117 43 Y 4.7061 6.9574 111.1667 56.4351 40.0105 172.9292 44 I 3.7375 8.5814 121.4174 60.9398 37.4236 174.6326 45 P 4.3930 0.0000 0.0000 61.8463 32.5222 176.2923 46 E 4.1757 8.6757 117.3564 59.6315 30.4583 178.0389 47 G 4.3627 7.4101 112.8252 45.5627 0.0000 174.6932 48 Q 4.7895 8.5011 128.7866 54.5632 31.5771 172.7108 49 W 4.9322 8.2340 125.9416 55.7638 34.1858 176.1207 50 L 4.5862 7.2981 124.9176 52.4435 44.0375 176.0914 51 C 3.0811 7.4642 119.2162 57.0215 30.1057 174.9173 52 R 3.9273 8.1703 117.1307 59.6029 28.4222 178.1375 53 H 4.2395 8.0462 118.0294 58.3790 30.1535 176.8489 54 C 4.0389 7.6459 118.5832 62.5956 28.1788 175.6841 55 L 3.8841 8.2650 121.7026 58.9780 39.7471 179.0290 56 Q 3.9947 7.5194 119.3073 58.7291 29.3447 178.3052 57 S 4.2444 7.7389 116.3511 61.6430 63.0406 176.8280 58 R 4.0935 7.9424 117.8288 58.6662 29.1041 178.4535 59 A 4.0097 8.1871 121.6700 55.1983 18.3149 179.1275 60 R 3.9380 7.3893 115.1441 59.0836 30.2058 177.0758 61 P 4.2288 0.0000 0.0000 65.1987 31.7390 175.9875 62 A 4.0473 7.8384 125.0961 52.1527 19.2412 176.5245 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 Q 8.34 4.28 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.24 2.45 0.00 2 S 8.03 4.41 0.00 3.92 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.16 4.91 0.00 1.58 1.55 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 4 I 8.32 4.02 1.89 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 1.48 0.49 0.92 0.00 0.00 5 D 8.41 4.56 0.00 2.81 2.86 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 6 E 8.49 3.82 0.00 2.28 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 0.00 2.30 2.45 0.00 7 D 7.89 4.29 0.00 2.74 2.53 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 8 A 7.35 4.92 1.53 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 9 V 7.34 4.40 2.06 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 0.70 0.00 0.00 0.90 0.00 0.00 10 C 8.18 4.81 0.00 2.66 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 11 S 8.31 4.45 0.00 3.87 3.89 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 12 I 7.86 3.94 1.90 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.53 0.97 0.00 0.00 13 C 7.73 4.74 0.00 3.06 3.11 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 14 M 8.08 4.09 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 15 D 7.67 4.83 0.00 2.75 2.58 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 16 G 8.46 4.30 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 0.00 17 E 7.51 4.38 0.00 2.23 1.92 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 2.24 2.32 0.00 18 S 8.53 4.30 0.00 3.87 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 19 Q 8.69 4.76 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.56 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 20 N 8.87 4.36 0.00 2.66 2.85 0.00 0.00 6.94 7.63 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 21 S 8.16 4.20 0.00 3.86 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 22 N 7.78 5.05 0.00 2.66 2.42 0.00 0.00 6.77 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.62 4.27 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 0.72 0.00 0.00 0.99 0.00 0.00 24 I 7.99 4.02 1.71 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.59 1.06 0.00 0.00 25 L 8.33 4.45 0.00 1.11 1.44 0.62 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.81 5.24 0.00 2.94 3.02 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 27 C 8.71 5.43 0.00 3.11 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 28 D 8.81 4.78 0.00 2.75 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 29 M 7.58 4.45 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 30 C 7.74 4.16 0.00 3.10 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 31 N 8.32 4.48 0.00 2.92 3.23 0.00 0.00 7.04 8.14 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 32 L 7.97 4.18 0.00 1.85 1.77 1.07 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.19 4.90 0.54 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 34 V 8.03 4.51 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 0.95 0.00 0.00 0.30 0.00 0.00 35 H 8.93 5.15 0.00 3.18 3.19 0.00 6.10 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 8.87 3.80 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.85 0.00 0.00 0.00 0.00 0.00 2.57 2.36 0.00 37 E 8.02 4.01 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.50 0.00 38 C 7.99 4.31 0.00 3.16 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 39 Y 8.16 4.01 0.00 2.81 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 40 G 8.40 4.29 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 0.00 0.00 0.00 41 V 8.35 4.39 2.20 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 0.88 0.00 0.00 1.15 0.00 0.00 42 P 0.00 4.52 0.00 2.30 2.32 0.00 3.79 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 43 Y 6.96 4.71 0.00 3.06 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 44 I 8.58 3.74 1.98 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.44 0.93 0.00 0.00 45 P 0.00 4.39 0.00 2.16 2.02 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 46 E 8.68 4.18 0.00 1.97 2.06 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 2.34 2.41 0.00 47 G 7.41 4.36 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 0.00 48 Q 8.50 4.79 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.58 6.67 0.00 0.00 0.00 0.00 0.00 2.52 2.59 0.00 49 W 8.23 4.93 0.00 3.44 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 50 L 7.30 4.59 0.00 1.20 1.35 0.81 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 51 C 7.46 3.08 0.00 2.90 2.38 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 0.00 52 R 8.17 3.93 0.00 2.04 2.34 0.00 2.78 0.00 0.00 3.11 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 53 H 8.05 4.24 0.00 3.27 3.27 0.00 5.86 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 C 7.65 4.04 0.00 2.87 2.72 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 55 L 8.27 3.88 0.00 1.77 1.76 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 7.52 3.99 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.96 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 57 S 7.74 4.24 0.00 4.14 3.87 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 0.00 0.00 0.00 58 R 7.94 4.09 0.00 2.04 2.15 0.00 2.72 0.00 0.00 3.13 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 59 A 8.19 4.01 1.33 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 0.00 0.00 0.00 60 R 7.39 3.94 0.00 2.04 1.96 0.00 3.16 0.00 0.00 3.26 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 61 P 0.00 4.23 0.00 2.21 2.17 0.00 4.00 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 2.13 2.01 0.00 62 A 7.84 4.05 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00