NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 Q 4.2679 8.3293 118.8251 55.5250 30.5027 175.3677 13 R 4.2303 7.3561 116.5591 53.5566 29.8559 173.0680 14 P 4.3094 0.0000 0.0000 65.2869 32.4740 179.4561 15 L 3.9951 7.9464 117.3727 57.2317 41.4179 178.4828 16 D 4.4584 8.0320 117.9520 56.7330 40.8696 177.8147 17 A 3.9519 7.8332 121.0348 55.0100 18.5290 179.2979 18 L 3.8834 7.5589 117.3431 57.5943 41.3897 179.6727 19 G 3.9200 7.9584 105.2214 48.1745 0.0000 175.2751 20 N 4.5032 8.4183 117.7435 55.0977 38.8687 176.5720 21 S 4.6537 7.8385 115.0403 56.8989 63.5367 173.8291 22 L 4.2891 7.1763 122.7087 56.5603 41.7917 176.8768 23 N 4.4218 9.7353 120.2264 53.8051 36.6951 173.8641 24 S 4.8938 7.6909 111.8049 55.6106 66.9826 171.4358 25 P 4.9899 0.0000 0.0000 62.9353 32.0378 176.1325 26 V 4.6643 9.0863 116.4192 59.7815 36.9771 174.1373 27 I 5.0192 8.7846 122.2291 59.7157 40.2123 174.9643 28 I 4.8293 9.2689 127.9971 59.3891 39.9090 174.2970 29 K 4.5062 8.5902 129.3971 54.7999 33.8216 175.5924 30 L 5.0804 8.3665 126.8437 52.4681 44.9722 175.9654 31 K 4.0389 8.4805 119.9685 57.4966 32.5647 177.8710 32 G 3.7558 9.0370 110.1944 46.3451 0.0000 174.4183 33 D 4.6731 7.7466 116.4925 53.9076 39.5155 174.9256 34 R 4.1834 7.4585 118.4717 56.4191 31.6310 175.1389 35 E 5.0931 8.2616 121.8537 54.9231 33.5930 173.8448 36 F 5.3448 9.6237 124.9097 55.7569 42.8065 174.4693 37 R 5.0344 8.7338 120.4804 54.6056 33.8643 175.3266 38 G 3.9706 8.2188 108.2182 46.3864 0.0000 171.3599 39 V 4.6889 7.8075 120.1052 61.3677 33.1227 175.3793 40 L 4.4985 8.7030 130.9595 55.3321 42.2980 177.0035 41 K 4.0379 8.9312 126.0885 57.6746 34.5089 176.5082 42 S 4.7831 7.9062 111.4291 57.6914 65.5378 173.8555 43 F 6.0470 8.3698 118.3349 56.9317 40.6999 172.2806 44 D 4.8968 8.5180 118.8139 50.9002 42.3322 176.2328 45 L 4.2523 8.3943 118.2162 58.6699 40.2949 177.5734 46 H 4.4896 8.4084 115.8106 56.1358 29.0559 176.2989 47 M 3.4066 8.6153 118.5251 55.6693 29.9941 176.4092 48 N 4.9422 8.1063 117.0487 53.6499 39.8560 173.9432 49 L 5.1607 8.8263 121.6573 54.6830 44.7039 174.2706 50 V 4.8469 8.9370 120.5170 61.2148 33.9825 174.4099 51 L 5.3713 8.7412 126.7643 53.1711 45.4179 175.4407 52 N 5.2337 8.9566 118.8723 51.3564 41.7820 174.1875 53 D 4.5454 8.4365 116.9943 55.2527 39.4297 174.4510 54 A 4.6345 8.2001 120.1394 52.0236 19.9951 177.5259 55 E 5.1017 9.5088 121.9149 54.4594 33.0224 174.5949 56 E 4.1432 9.0151 125.4441 54.4976 31.3292 174.6562 57 L 5.3630 8.5423 126.2653 53.2978 45.8897 175.6806 58 E 4.6262 8.9410 120.7241 56.2317 33.2959 175.5471 59 D 4.4290 9.7139 122.6093 55.3400 38.3930 174.8171 60 G 3.9066 8.3569 104.7636 45.7994 0.0000 173.8488 61 E 4.5103 8.1781 119.9049 54.3342 31.2369 175.4298 62 V 4.3479 8.2067 122.6106 62.7525 31.8802 175.5581 63 T 4.5573 8.4775 117.2374 61.8063 70.6238 174.4728 64 R 4.6466 7.6411 121.9046 55.1925 33.7485 173.3279 65 R 5.1759 8.6522 124.5536 54.4195 32.7660 175.1964 66 L 4.6945 9.1690 123.7158 52.7104 44.7733 177.8135 67 G 3.7319 8.9801 111.6898 49.7048 0.0000 173.2946 68 T 5.2317 7.4854 114.5214 62.4863 72.7191 173.7337 69 V 4.4248 8.8864 125.6862 59.7744 35.1370 174.0228 70 L 4.8713 8.5080 125.6668 53.7749 43.3805 175.1472 71 I 4.3741 8.4463 128.0789 59.3440 39.6919 175.6794 72 R 4.5573 8.5358 126.4706 55.7184 30.8992 177.8712 73 G 3.8510 9.4283 112.1779 48.0691 0.0000 175.0778 74 D 4.5252 8.0831 117.9482 56.3882 41.4975 176.2740 75 N 4.6815 7.9397 114.7391 53.7195 39.2731 174.8785 76 I 4.2712 7.8111 121.0815 61.3148 37.7637 175.7388 77 V 4.0924 8.6214 126.9979 65.0903 31.7647 175.2874 78 Y 5.0434 7.2024 116.1597 55.8637 41.6685 172.7818 79 I 5.1087 8.4941 119.9770 59.6230 40.5975 175.1501 80 S 4.6791 9.4732 121.1697 55.7078 65.4188 172.1690 81 P 4.4421 0.0000 0.0000 63.0645 31.3214 176.0317 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 12 Q 8.33 4.27 0.00 2.18 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.88 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 13 R 7.36 4.23 0.00 2.06 2.09 0.00 2.99 0.00 0.00 3.35 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 14 P 0.00 4.31 0.00 2.18 2.13 0.00 3.61 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 15 L 7.95 4.00 0.00 1.81 1.88 0.94 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.03 4.46 0.00 2.69 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.83 3.95 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 18 L 7.56 3.88 0.00 0.57 0.13 0.32 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.96 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 20 N 8.42 4.50 0.00 2.85 2.90 0.00 0.00 6.98 7.90 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 21 S 7.84 4.65 0.00 3.80 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 22 L 7.18 4.29 0.00 1.65 1.69 1.06 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 23 N 9.74 4.42 0.00 2.84 2.97 0.00 0.00 6.78 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 24 S 7.69 4.89 0.00 3.87 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 25 P 0.00 4.99 0.00 1.97 2.04 0.00 3.63 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 2.04 2.13 0.00 26 V 9.09 4.66 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.98 0.00 0.00 27 I 8.78 5.02 2.08 0.00 0.00 0.91 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 0.71 1.02 0.00 0.00 28 I 9.27 4.83 1.94 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.92 0.88 0.00 0.00 29 K 8.59 4.51 0.00 0.83 0.74 0.00 1.45 0.00 0.00 1.50 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.84 1.11 7.81 30 L 8.37 5.08 0.00 1.64 1.65 1.07 0.72 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 31 K 8.48 4.04 0.00 1.64 1.74 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.47 1.51 7.81 32 G 9.04 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 0.00 0.00 0.00 33 D 7.75 4.67 0.00 2.99 2.87 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 34 R 7.46 4.18 0.00 1.78 1.86 0.00 3.14 0.00 0.00 3.28 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 35 E 8.26 5.09 0.00 1.96 1.64 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 2.16 2.43 0.00 36 F 9.62 5.34 0.00 2.87 2.88 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.73 5.03 0.00 1.74 1.81 0.00 3.19 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 38 G 8.22 3.97 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 0.00 0.00 0.00 39 V 7.81 4.69 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.95 0.00 0.00 40 L 8.70 4.50 0.00 1.85 1.70 1.01 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.93 4.04 0.00 1.79 1.83 0.00 1.90 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.55 1.50 7.81 42 S 7.91 4.78 0.00 3.85 3.64 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 43 F 8.37 6.05 0.00 3.11 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 44 D 8.52 4.90 0.00 2.83 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 45 L 8.39 4.25 0.00 1.74 1.81 0.85 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 46 H 8.41 4.49 0.00 3.40 3.37 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 M 8.62 3.41 0.00 2.17 2.27 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 2.54 2.51 0.00 48 N 8.11 4.94 0.00 3.01 2.75 0.00 0.00 6.55 6.74 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 49 L 8.83 5.16 0.00 1.92 1.81 0.88 0.57 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 50 V 8.94 4.85 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 1.01 0.00 0.00 0.92 0.00 0.00 51 L 8.74 5.37 0.00 1.58 1.59 0.91 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 52 N 8.96 5.23 0.00 2.64 2.72 0.00 0.00 7.30 7.66 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 53 D 8.44 4.55 0.00 2.79 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 54 A 8.20 4.63 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 55 E 9.51 5.10 0.00 1.85 1.79 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 0.00 2.22 2.23 0.00 56 E 9.02 4.14 0.00 1.41 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 1.85 1.47 0.00 57 L 8.54 5.36 0.00 1.53 1.44 0.86 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.94 4.63 0.00 1.87 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 59 D 9.71 4.43 0.00 2.80 2.73 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 60 G 8.36 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.18 4.51 0.00 2.06 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 2.40 2.35 0.00 62 V 8.21 4.35 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 0.79 0.00 0.00 0.96 0.00 0.00 63 T 8.48 4.56 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 1.29 0.00 0.00 64 R 7.64 4.65 0.00 1.84 1.70 0.00 3.18 0.00 0.00 3.38 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 65 R 8.65 5.18 0.00 1.71 1.83 0.00 3.21 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 66 L 9.17 4.69 0.00 1.59 1.57 1.12 0.70 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 67 G 8.98 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 0.00 0.00 0.00 68 T 7.49 5.23 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 1.20 0.00 0.00 69 V 8.89 4.42 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 0.55 0.00 0.00 0.64 0.00 0.00 70 L 8.51 4.87 0.00 1.61 1.57 0.98 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 71 I 8.45 4.37 1.75 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.43 0.82 0.00 0.00 72 R 8.54 4.56 0.00 1.85 1.84 0.00 3.12 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 73 G 9.43 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.08 4.53 0.00 2.63 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 75 N 7.94 4.68 0.00 2.90 2.82 0.00 0.00 6.85 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 76 I 7.81 4.27 1.96 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 1.15 0.69 0.89 0.00 0.00 77 V 8.62 4.09 2.01 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 0.87 0.00 0.00 0.92 0.00 0.00 78 Y 7.20 5.04 0.00 3.01 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 79 I 8.49 5.11 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.70 0.95 0.00 0.00 80 S 9.47 4.68 0.00 3.88 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 81 P 0.00 4.44 0.00 2.21 2.00 0.00 3.84 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00