NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8073 8.2516 120.4243 55.5798 33.6317 174.1800 2 V 4.3164 8.8523 125.1674 60.1624 35.0603 168.7547 3 V 4.7528 9.2884 128.2854 61.0740 34.2465 173.8487 4 L 4.6524 9.0784 128.4432 52.9843 43.7962 175.1389 5 K 4.8610 8.6800 125.8608 54.6582 34.0029 175.2091 6 V 4.3440 8.9277 128.2729 61.6115 33.5088 174.2307 7 T 4.9835 8.5076 125.2345 61.9894 69.7253 173.9567 8 L 4.8065 8.0299 125.1584 54.2422 44.4672 174.8439 9 L 4.5997 8.5478 119.8018 54.5532 42.1802 177.0288 10 E 4.1491 8.5703 124.1185 57.1755 29.8414 175.9579 11 G 3.8105 8.2803 113.0320 45.8155 0.0000 175.1979 12 R 4.0033 7.8882 119.3177 55.5106 30.9349 175.3246 13 P 4.4625 0.0000 0.0000 61.8876 33.4129 175.5362 14 P 4.2339 0.0000 0.0000 66.0960 31.3241 178.6043 15 E 3.9424 8.1941 115.5258 59.4188 29.2665 178.9561 16 K 3.9506 7.9469 119.9859 59.1444 32.2965 178.8286 17 K 3.9496 7.9736 118.5764 59.3729 32.0784 179.2564 18 R 3.8639 8.1813 119.1424 59.4450 29.9246 178.2594 19 E 3.9438 8.3157 119.0971 58.9587 29.5564 178.3405 20 L 3.9050 8.1266 120.6504 58.3910 42.3065 179.0904 21 V 3.5521 8.0435 118.2779 66.0250 31.3042 178.2871 22 R 3.9487 7.9478 119.7147 59.8977 30.0580 179.7358 23 R 3.9453 8.2567 120.6540 61.5059 29.4412 180.7220 24 L 4.1802 8.1495 120.3826 58.0434 41.7207 179.9435 25 T 3.7367 7.7686 115.2223 66.0717 68.3087 176.5563 26 E 3.9675 8.1140 124.0367 60.2461 29.8022 179.3999 27 M 4.1090 8.0872 120.1842 59.6786 31.5558 180.2530 28 A 4.2031 8.1033 121.9882 54.9754 18.5793 179.7235 29 S 4.1292 7.9406 111.6323 61.6583 62.2691 176.0297 30 R 3.9673 7.9688 121.3114 59.3834 29.7220 178.5090 31 L 4.0313 8.1675 119.3160 56.9766 41.9152 178.2142 32 L 4.4341 7.8067 116.0793 53.3714 42.3772 176.4898 33 G 4.0415 7.6234 106.9767 47.0840 0.0000 173.7183 34 E 4.7438 8.1012 115.3531 53.5518 33.0612 175.1667 35 P 4.5610 0.0000 0.0000 62.5105 32.5097 176.8310 36 Y 4.2218 9.1667 121.4763 61.4828 37.8943 178.9072 37 E 4.0616 8.4250 116.7700 58.8620 29.9259 177.5970 38 E 4.3592 9.0659 118.0051 55.9867 30.0477 174.9938 39 V 4.3072 7.8675 120.7717 61.4464 32.6475 175.0287 40 R 4.7141 8.8793 127.8021 54.3499 32.7834 175.4120 41 V 4.9019 8.3418 122.2681 61.1147 34.4251 174.4771 42 I 4.5574 8.8271 128.0750 59.4771 40.4817 174.4015 43 L 4.8618 8.6238 126.9476 53.6624 43.0053 176.0299 44 Y 4.6466 9.0459 128.1326 56.3930 38.9404 173.1560 45 E 4.7495 8.5428 125.2197 55.2224 30.8275 176.1116 46 V 4.1947 8.1315 118.2706 59.4020 34.6007 176.1883 47 R 4.5420 8.7856 122.7636 55.4767 30.9068 178.2433 48 R 4.1904 8.5677 118.9646 59.1891 30.1975 177.4180 49 D 5.1037 8.0137 115.0139 52.6494 39.4482 176.5235 50 Q 4.6513 8.3319 115.6042 55.4599 30.4811 175.0044 51 W 5.4126 8.1838 127.9561 55.5561 33.7026 173.6482 52 A 4.7904 8.7478 126.4574 50.3381 22.1725 174.9747 53 A 4.3848 7.6974 122.0139 51.4386 22.0514 177.0196 54 G 3.9080 9.4617 110.2951 46.6406 0.0000 174.6549 55 G 3.8276 8.4300 105.1609 45.1215 0.0000 174.0694 56 V 4.2769 7.2761 119.3442 60.1169 33.8690 175.0703 57 L 4.4647 8.2274 127.0399 54.4759 43.7131 178.1994 58 F 4.2481 8.7171 121.7629 60.5808 38.6971 178.4312 59 S 4.2146 8.1601 113.7278 61.7132 63.0647 176.1995 60 D 4.4083 8.0630 122.1246 56.5565 40.4329 178.4512 61 K 3.9842 7.9900 119.7574 59.3151 32.3169 178.0864 62 E 4.2704 8.0389 116.4008 56.3260 29.8432 177.0886 63 G 4.0186 8.6387 104.8034 45.1760 0.0000 173.7685 64 T 4.1965 7.8283 107.3591 61.8537 68.8592 173.7432 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 M 8.25 4.81 0.00 2.04 2.27 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.38 0.00 2 V 8.85 4.32 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 0.93 0.00 0.00 0.98 0.00 0.00 3 V 9.29 4.75 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.92 0.00 0.00 4 L 9.08 4.65 0.00 1.55 1.55 0.88 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.68 4.86 0.00 1.74 1.70 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.43 7.81 6 V 8.93 4.34 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 0.99 0.00 0.00 0.94 0.00 0.00 7 T 8.51 4.98 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 0.44 0.00 0.00 8 L 8.03 4.81 0.00 1.76 1.75 0.92 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 9 L 8.55 4.60 0.00 1.51 1.59 0.37 1.00 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 10 E 8.57 4.15 0.00 1.94 1.82 0.00 0.00 0.00 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 2.41 0.00 11 G 8.28 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 0.00 0.00 0.00 12 R 7.89 4.00 0.00 1.80 1.88 0.00 3.37 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 13 P 0.00 4.46 0.00 2.60 2.17 0.00 3.72 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 2.05 0.00 14 P 0.00 4.23 0.00 2.17 2.17 0.00 3.60 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 15 E 8.19 3.94 0.00 2.16 2.22 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 2.36 2.32 0.00 16 K 7.95 3.95 0.00 1.88 1.99 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.59 7.81 17 K 7.97 3.95 0.00 2.03 1.84 0.00 1.86 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.59 7.81 18 R 8.18 3.86 0.00 2.00 2.12 0.00 3.10 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 19 E 8.32 3.94 0.00 2.22 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 2.31 2.32 0.00 20 L 8.13 3.90 0.00 1.85 1.83 0.92 1.15 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 21 V 8.04 3.55 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 0.96 0.00 0.00 0.97 0.00 0.00 22 R 7.95 3.95 0.00 2.14 1.99 0.00 3.20 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 23 R 8.26 3.95 0.00 1.79 1.94 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 24 L 8.15 4.18 0.00 1.70 1.71 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 25 T 7.77 3.74 4.12 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 0.50 0.00 0.00 26 E 8.11 3.97 0.00 2.23 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 0.00 2.36 2.43 0.00 27 M 8.09 4.11 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.43 0.00 28 A 8.10 4.20 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.94 4.13 0.00 3.78 4.08 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 30 R 7.97 3.97 0.00 2.11 2.11 0.00 3.18 0.00 0.00 3.18 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 31 L 8.17 4.03 0.00 1.70 1.72 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.81 4.43 0.00 1.78 1.67 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 33 G 7.62 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 34 E 8.10 4.74 0.00 1.94 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 2.41 2.37 0.00 35 P 0.00 4.56 0.00 2.22 2.01 0.00 3.66 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 36 Y 9.17 4.22 0.00 2.95 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 37 E 8.43 4.06 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 2.35 2.45 0.00 38 E 9.07 4.36 0.00 2.11 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 39 V 7.87 4.31 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 0.64 0.00 0.00 0.85 0.00 0.00 40 R 8.88 4.71 0.00 1.72 1.77 0.00 3.27 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 41 V 8.34 4.90 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 0.81 0.00 0.00 0.88 0.00 0.00 42 I 8.83 4.56 1.86 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 1.21 0.55 0.91 0.00 0.00 43 L 8.62 4.86 0.00 1.53 1.63 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 44 Y 9.05 4.65 0.00 2.87 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 45 E 8.54 4.75 0.00 1.85 1.80 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 2.22 2.31 0.00 46 V 8.13 4.19 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 0.34 0.00 0.00 47 R 8.79 4.54 0.00 2.06 1.86 0.00 3.14 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.59 0.00 48 R 8.57 4.19 0.00 1.87 2.23 0.00 3.22 0.00 0.00 3.34 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 49 D 8.01 5.10 0.00 2.82 2.80 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 50 Q 8.33 4.65 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.62 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 51 W 8.18 5.41 0.00 3.37 3.40 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.75 4.79 1.14 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 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.70 4.38 0.90 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 0.00 0.00 54 G 9.46 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 55 G 8.43 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 56 V 7.28 4.28 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 0.91 0.00 0.00 0.92 0.00 0.00 57 L 8.23 4.46 0.00 1.73 1.60 0.99 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 58 F 8.72 4.25 0.00 3.36 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.21 0.00 4.09 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 0.00 60 D 8.06 4.41 0.00 2.82 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 61 K 7.99 3.98 0.00 1.80 2.08 0.00 1.91 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.50 1.48 7.81 62 E 8.04 4.27 0.00 2.06 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 0.00 2.77 2.51 0.00 63 G 8.64 4.02 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 0.00 0.00 0.00 64 T 7.83 4.20 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