NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 P 4.3356 0.0000 0.0000 61.9068 32.0754 174.7188 4 R 4.2168 7.5398 118.1078 52.8816 33.0621 173.3484 5 P 4.2063 0.0000 0.0000 65.8844 31.7394 178.2513 6 L 3.9470 7.8463 116.4073 57.2282 41.4278 178.8305 7 D 4.4726 8.3151 119.6282 56.7675 40.6058 178.8219 8 V 3.5944 7.2663 118.2687 65.6384 31.7049 177.7327 9 L 3.9660 7.6274 118.3515 57.7909 41.4605 178.6946 10 N 4.4169 7.5040 115.8153 56.7308 38.6819 176.1800 11 R 4.1918 7.6104 116.2920 57.4994 30.2574 176.5470 12 S 4.6947 8.0847 112.9284 58.5325 64.1966 174.0550 13 L 4.2960 7.7176 120.9461 56.1079 41.7808 177.2424 14 K 3.9156 9.1713 119.6479 56.9722 30.6177 175.4055 15 S 5.0383 7.5467 113.4919 55.3611 66.7100 171.5990 16 P 4.9083 0.0000 0.0000 63.2653 32.5411 175.6147 17 V 5.0339 9.0126 115.2853 59.9555 37.0905 174.0094 18 I 4.8665 8.7806 120.9637 60.0488 40.6548 175.0206 19 V 4.7967 8.7259 127.5285 60.9670 34.1686 174.1698 20 R 4.8426 8.1501 127.2225 54.4781 32.2769 174.5030 21 L 5.1467 8.6620 126.0376 52.5506 44.7073 176.0974 22 K 3.6144 8.2470 120.9308 58.6533 32.1553 176.2634 23 G 4.3158 9.4208 119.0146 43.0764 0.0000 174.6773 24 G 4.8136 7.1077 121.8860 45.3752 0.0000 173.2672 25 R 4.3741 7.1607 119.3446 56.3694 31.6490 175.4579 26 E 5.1606 8.8351 119.9574 54.9516 34.3255 174.7138 27 F 5.1644 9.5015 121.6897 55.9726 42.5495 175.0440 28 R 4.9046 8.5936 120.6670 55.6679 33.0881 174.2597 29 G 4.2855 8.1822 112.7971 46.0904 0.0000 171.3965 30 T 4.7316 8.1073 117.2659 62.7031 69.6143 174.4023 31 L 4.2743 8.9078 129.9037 55.9544 42.3802 176.4437 32 D 4.9264 9.0256 127.1545 54.4198 42.5107 175.9357 33 G 4.1746 7.8196 104.3222 46.8638 0.0000 171.2959 34 Y 5.8822 8.0644 117.3867 57.9354 40.8419 172.4051 35 D 4.5258 8.8541 117.4149 52.4160 42.1664 176.3139 36 I 3.7545 8.3605 119.6608 64.6749 37.9596 176.4038 37 H 4.3254 8.0109 114.8058 57.4613 28.7447 175.4325 38 M 3.4000 9.0322 119.0552 55.6157 31.2802 175.9768 39 N 4.8362 8.1988 113.9183 52.9051 40.1663 174.4440 40 L 5.2069 8.4388 121.3117 53.1229 46.2068 175.6928 41 V 4.6480 8.3250 119.1343 61.9531 34.6702 173.5092 42 L 5.3566 8.6399 127.4257 52.9756 45.2167 175.5343 43 L 4.9140 8.4978 120.9021 53.4914 44.8622 176.0757 44 D 4.5089 8.2321 119.7751 55.4708 38.7912 172.7278 45 A 5.7482 7.9955 122.5485 49.7696 23.1287 176.6865 46 E 5.0767 8.6254 117.2688 54.5082 33.8656 174.8972 47 E 3.8583 8.9024 124.0700 54.5983 31.4143 174.4928 48 I 4.7685 8.6636 128.8588 59.6354 39.9122 174.6242 49 Q 4.4922 8.8401 127.6646 55.1454 31.7735 175.4644 50 N 4.1455 9.3867 126.4944 55.2688 37.7259 173.8267 51 G 4.1349 8.3063 112.0794 45.6916 0.0000 174.7591 52 E 4.4116 8.1454 117.9245 54.0442 31.1654 175.7537 53 V 4.1464 7.9422 119.9337 62.5699 30.5315 175.8198 54 V 4.0354 8.7395 121.2000 59.4900 31.5882 175.3970 55 R 4.8468 6.0949 118.6271 54.6339 32.8742 173.4449 56 K 5.1078 7.8536 123.1037 55.0144 35.4759 175.9692 57 V 4.4639 8.3936 112.9718 60.1181 36.0051 175.7436 58 G 3.8596 9.1431 112.3934 49.4030 0.0000 173.0282 59 S 5.6360 7.6694 110.8678 58.8812 65.3939 175.9882 60 V 4.5395 7.7812 112.6593 60.2126 36.3520 173.3573 61 V 4.7049 8.2241 122.0986 61.2801 33.9457 174.5182 62 I 4.3580 8.1029 128.9500 59.1465 39.5073 175.7162 63 R 4.3701 8.6269 126.7432 56.1479 30.7760 177.6146 64 G 3.6323 10.2325 113.8543 48.8685 0.0000 174.9547 65 D 4.2598 8.1465 117.6397 56.1575 41.4241 176.6420 66 T 4.3988 7.8237 113.7803 63.9252 69.5947 174.2448 67 V 4.4249 8.2916 122.8848 62.1114 32.6485 174.8979 68 V 4.3399 8.5641 126.7438 64.1123 32.6839 175.5779 69 F 5.0835 7.3296 113.3949 55.6358 41.1693 172.3898 70 V 5.0450 8.6082 119.9607 61.3578 33.7927 174.6157 71 S 4.8895 9.1409 121.7733 55.5997 66.0545 171.1617 72 P 4.7196 0.0000 0.0000 62.4399 31.8324 175.8933 73 A 4.2213 8.4573 125.0948 51.0594 19.4916 175.8866 74 P 4.3440 0.0000 0.0000 63.1929 31.3832 176.6030 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 3 P 0.00 4.34 0.00 2.05 2.09 0.00 3.64 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 4 R 7.54 4.22 0.00 2.02 1.81 0.00 3.32 0.00 0.00 3.34 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.86 0.00 5 P 0.00 4.21 0.00 2.13 2.10 0.00 3.59 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 2.11 2.19 0.00 6 L 7.85 3.95 0.00 1.69 1.75 0.99 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.32 4.47 0.00 2.84 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.27 3.59 2.17 0.00 0.00 0.00 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 0.90 0.00 0.00 9 L 7.63 3.97 0.00 1.22 1.08 0.61 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 10 N 7.50 4.42 0.00 2.91 3.01 0.00 0.00 6.92 7.53 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 11 R 7.61 4.19 0.00 1.80 2.08 0.00 3.25 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 12 S 8.08 4.69 0.00 3.99 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 13 L 7.72 4.30 0.00 1.71 1.67 1.04 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 14 K 9.17 3.92 0.00 1.87 1.93 0.00 1.65 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.38 7.81 15 S 7.55 5.04 0.00 3.83 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 16 P 0.00 4.91 0.00 2.16 2.24 0.00 3.65 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 2.09 2.01 0.00 17 V 9.01 5.03 2.21 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 0.80 0.00 0.00 1.05 0.00 0.00 18 I 8.78 4.87 2.01 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.93 1.02 0.00 0.00 19 V 8.73 4.80 2.13 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 0.78 0.00 0.00 0.94 0.00 0.00 20 R 8.15 4.84 0.00 1.38 0.66 0.00 2.63 0.00 0.00 3.03 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.31 0.00 21 L 8.66 5.15 0.00 1.62 1.66 1.18 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 22 K 8.25 3.61 0.00 1.65 1.76 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.41 7.81 23 G 9.42 4.32 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 0.00 0.00 0.00 24 G 7.11 4.81 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 0.00 0.00 0.00 25 R 7.16 4.37 0.00 1.76 1.79 0.00 3.30 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.58 0.00 26 E 8.84 5.16 0.00 1.83 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 2.14 2.23 0.00 27 F 9.50 5.16 0.00 2.90 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 28 R 8.59 4.90 0.00 1.88 1.76 0.00 3.14 0.00 0.00 3.19 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 29 G 8.18 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 30 T 8.11 4.73 4.26 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 1.25 0.00 0.00 31 L 8.91 4.27 0.00 1.81 1.76 1.04 0.88 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 32 D 9.03 4.93 0.00 2.68 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 33 G 7.82 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.06 5.88 0.00 2.98 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 35 D 8.85 4.53 0.00 2.85 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.36 3.75 1.83 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 1.27 0.47 0.75 0.00 0.00 37 H 8.01 4.33 0.00 3.34 3.34 0.00 5.76 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 38 M 9.03 3.40 0.00 2.03 2.40 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 2.47 2.49 0.00 39 N 8.20 4.84 0.00 3.03 2.72 0.00 0.00 6.86 6.63 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 40 L 8.44 5.21 0.00 1.54 1.55 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.32 4.65 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 0.96 0.00 0.00 0.91 0.00 0.00 42 L 8.64 5.36 0.00 1.63 1.53 0.93 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.50 4.91 0.00 1.60 1.54 1.06 1.03 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 44 D 8.23 4.51 0.00 2.71 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 45 A 8.00 5.75 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 46 E 8.63 5.08 0.00 1.85 1.76 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 2.27 2.27 0.00 47 E 8.90 3.86 0.00 1.39 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.47 0.00 48 I 8.66 4.77 1.80 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 1.05 0.50 0.93 0.00 0.00 49 Q 8.84 4.49 0.00 2.01 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.22 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 50 N 9.39 4.15 0.00 2.78 2.97 0.00 0.00 7.39 7.98 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 51 G 8.31 4.13 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 0.00 0.00 0.00 52 E 8.15 4.41 0.00 2.15 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 2.19 2.19 0.00 53 V 7.94 4.15 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 0.95 0.00 0.00 0.90 0.00 0.00 54 V 8.74 4.04 2.03 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 0.73 0.00 0.00 0.92 0.00 0.00 55 R 6.09 4.85 0.00 1.94 1.88 0.00 3.05 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.33 0.00 56 K 7.85 5.11 0.00 1.75 1.68 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.40 7.81 57 V 8.39 4.46 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 1.08 0.00 0.00 58 G 9.14 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 0.00 0.00 0.00 59 S 7.67 5.64 0.00 3.82 3.79 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 0.00 0.00 0.00 60 V 7.78 4.54 1.91 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 0.90 0.00 0.00 0.65 0.00 0.00 61 V 8.22 4.70 2.04 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 0.79 0.00 0.00 0.90 0.00 0.00 62 I 8.10 4.36 1.73 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.64 0.80 0.00 0.00 63 R 8.63 4.37 0.00 1.81 1.85 0.00 3.28 0.00 0.00 3.32 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.56 0.00 64 G 10.23 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 65 D 8.15 4.26 0.00 2.63 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 66 T 7.82 4.40 4.43 0.00 0.00 0.00 0.00 0.00 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 67 V 8.29 4.42 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 0.73 0.00 0.00 0.90 0.00 0.00 68 V 8.56 4.34 1.93 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 0.93 0.00 0.00 0.90 0.00 0.00 69 F 7.33 5.08 0.00 3.06 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 V 8.61 5.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.95 0.00 0.00 71 S 9.14 4.89 0.00 3.92 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.72 0.00 2.12 2.04 0.00 3.83 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 73 A 8.46 4.22 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.34 0.00 2.06 2.03 0.00 3.73 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 2.05 2.14 0.00