NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.1899 0.0000 0.0000 63.1290 31.9901 173.6956 3 K 3.5040 8.7352 128.6495 55.2158 29.4673 173.0443 4 M 4.1354 9.0921 124.7646 55.3035 33.6224 175.6758 5 K 4.5817 8.2640 120.9574 54.7900 34.1735 176.7483 6 T 4.2355 8.1558 112.7972 61.4132 69.7475 174.9804 7 H 4.3052 8.8104 122.9644 55.2656 29.6001 176.1972 8 K 4.3344 8.5602 128.2480 59.6147 31.9084 179.0347 9 G 3.8174 8.3329 103.6291 47.9294 0.0000 175.0571 10 A 4.0743 8.0194 122.1317 54.9603 18.5033 179.2063 11 K 3.8714 8.7025 117.9349 59.9264 32.3516 178.0836 12 K 4.3930 8.2392 115.7633 57.3430 32.0214 177.7872 13 R 4.6845 8.1911 115.2906 55.2432 30.4239 175.2585 14 V 4.5005 7.7170 117.6975 61.5431 33.6831 172.8411 15 K 4.5636 9.0131 127.6911 54.7359 34.3380 174.5994 16 I 4.8548 8.2524 126.3074 59.7895 40.1484 175.2444 17 T 4.4773 8.6397 119.5243 60.4720 71.3237 175.2314 18 A 3.9361 8.7336 123.3916 55.8900 18.3045 179.4219 19 S 4.1513 7.9209 109.0270 60.0619 62.9278 175.3263 20 G 3.9999 8.0525 108.8652 44.7601 0.0000 173.4508 21 K 4.1697 7.6288 118.7938 55.4349 33.5122 176.3266 22 V 4.1435 8.2473 125.1077 62.5545 32.2877 175.1849 23 V 5.0663 9.5024 127.4567 60.5597 35.0941 173.9918 24 A 4.8409 8.1697 126.0700 50.9863 22.7813 175.2687 25 M 4.9493 8.3720 124.2998 55.0681 31.2644 177.1272 26 K 4.5947 8.3940 125.1121 55.3914 35.2471 176.2456 27 T 3.9868 8.5256 113.9209 62.4616 69.5861 173.1714 28 G 3.8516 8.8545 112.2654 45.3474 0.0000 171.9724 29 K 4.6199 7.5739 121.2039 58.0324 38.9213 177.4087 30 R 4.1573 8.3079 114.4566 56.8665 29.5816 175.7683 31 H 4.9023 7.8932 118.2555 55.3772 31.1096 175.3872 32 L 4.0172 8.6387 120.9203 58.5987 41.5114 177.0314 33 N 4.1889 7.4803 113.6687 51.6212 39.7493 173.7841 34 W 4.2240 7.9698 135.0000 58.3676 29.1649 174.2912 35 Q 4.0828 6.1367 113.4311 55.0825 29.3050 170.8066 36 K 4.2731 7.8163 119.0246 53.6301 34.9355 176.1316 37 S 3.9964 8.4984 118.7726 57.6712 63.9008 175.6461 38 G 3.8721 9.0722 112.0602 49.4338 0.0000 175.5603 39 K 3.9692 8.1915 121.1394 59.6643 32.0352 177.0740 40 E 4.0574 8.4823 117.8589 58.6025 29.1398 178.3648 41 I 3.7783 7.9576 120.9586 64.4216 38.0283 177.9996 42 R 3.9795 8.1641 120.6152 59.1986 30.6811 179.8713 43 Q 4.5415 8.3864 119.2581 55.2381 28.3356 178.3163 44 K 4.6090 7.7368 119.3019 54.1980 34.0068 177.6465 45 G 4.0258 7.7359 113.7039 45.4701 0.0000 173.7925 46 R 5.0309 8.5916 123.9251 54.1614 33.8666 172.6883 47 K 4.4772 9.0735 118.3682 55.8877 36.1888 175.7391 48 F 5.3024 8.5955 123.2130 58.6337 41.3843 175.8152 49 V 4.6575 7.9798 128.8391 62.3720 33.4671 169.7957 50 L 4.4118 7.9063 126.9202 53.8199 44.3588 175.8997 51 A 5.0523 8.5790 128.2810 53.5456 17.4473 180.4041 52 K 4.0176 7.7811 114.5942 58.8582 32.0204 177.7330 53 P 4.2193 0.0000 0.0000 65.8069 31.3192 177.8813 54 E 3.8542 8.2694 117.6219 59.6060 29.1869 179.1078 55 A 4.0057 7.5619 119.4766 55.2046 18.6422 179.1049 56 E 3.9568 8.2142 117.9896 59.5076 30.0247 179.0760 57 R 4.0433 8.6335 118.2620 58.6771 29.9048 177.6879 58 I 4.3707 7.2885 118.7735 61.2536 37.8269 176.5131 59 K 4.6800 8.1111 116.0795 56.0483 35.2870 176.8112 60 L 5.0067 7.4646 119.9344 53.9564 41.9277 178.0867 61 L 4.2286 7.3202 120.4223 58.0162 41.3719 178.8015 62 L 4.2022 7.9382 123.2793 55.7496 42.0089 176.6078 63 P 4.5355 0.0000 0.0000 62.0564 32.4175 175.0982 64 Y 4.2306 8.1559 121.3546 57.7023 38.4369 169.5938 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 2 P 0.00 4.19 0.00 2.19 2.16 0.00 3.86 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 1.88 1.96 0.00 3 K 8.74 3.50 0.00 1.99 1.89 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.53 7.81 4 M 9.09 4.14 0.00 2.06 2.02 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 2.62 2.59 0.00 5 K 8.26 4.58 0.00 1.72 1.71 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.40 7.81 6 T 8.16 4.24 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 1.24 0.00 0.00 7 H 8.81 4.31 0.00 3.26 3.28 0.00 5.60 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.56 4.33 0.00 1.81 1.86 0.00 1.77 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.46 7.81 9 G 8.33 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.02 4.07 1.24 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 0.00 0.00 0.00 11 K 8.70 3.87 0.00 1.72 2.07 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.55 7.81 12 K 8.24 4.39 0.00 1.90 1.85 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.57 7.81 13 R 8.19 4.68 0.00 1.80 1.92 0.00 3.08 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 1.77 1.55 0.00 14 V 7.72 4.50 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 0.67 0.00 0.00 1.01 0.00 0.00 15 K 9.01 4.56 0.00 1.88 1.71 0.00 1.62 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.38 7.81 16 I 8.25 4.85 1.86 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 1.39 1.18 0.91 0.00 0.00 17 T 8.64 4.48 4.27 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 0.00 0.00 0.00 1.27 0.00 0.00 18 A 8.73 3.94 1.32 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 19 S 7.92 4.15 0.00 3.85 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 20 G 8.05 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.63 4.17 0.00 1.76 1.49 0.00 1.77 0.00 0.00 1.21 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.16 1.30 7.81 22 V 8.25 4.14 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 0.73 0.00 0.00 0.89 0.00 0.00 23 V 9.50 5.07 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 1.10 0.00 0.00 24 A 8.17 4.84 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.37 4.95 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.47 0.00 26 K 8.39 4.59 0.00 1.68 1.68 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.31 7.81 27 T 8.53 3.99 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 28 G 8.85 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 29 K 7.57 4.62 0.00 1.77 1.75 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.46 7.81 30 R 8.31 4.16 0.00 1.86 1.96 0.00 3.51 0.00 0.00 3.28 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 31 H 7.89 4.90 0.00 3.30 3.34 0.00 5.58 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.64 4.02 0.00 1.70 1.85 0.95 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 33 N 7.48 4.19 0.00 2.78 2.80 0.00 0.00 6.82 7.68 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 34 W 7.97 4.22 0.00 3.37 3.46 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 6.14 4.08 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.62 0.00 0.00 0.00 0.00 0.00 1.71 1.84 0.00 36 K 7.82 4.27 0.00 1.65 1.63 0.00 1.92 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.27 1.32 7.81 37 S 8.50 4.00 0.00 3.94 3.96 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 0.00 0.00 0.00 38 G 9.07 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 0.00 0.00 0.00 39 K 8.19 3.97 0.00 1.81 1.81 0.00 1.71 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.56 7.81 40 E 8.48 4.06 0.00 2.11 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 2.32 2.43 0.00 41 I 7.96 3.78 1.86 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 1.64 0.51 0.98 0.00 0.00 42 R 8.16 3.98 0.00 1.79 2.11 0.00 3.24 0.00 0.00 3.20 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 43 Q 8.39 4.54 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 44 K 7.74 4.61 0.00 1.89 1.71 0.00 1.57 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.45 7.81 45 G 7.74 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 46 R 8.59 5.03 0.00 1.63 1.82 0.00 3.21 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 47 K 9.07 4.48 0.00 1.74 1.84 0.00 1.31 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.67 1.46 7.81 48 F 8.60 5.30 0.00 2.93 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 49 V 7.98 4.66 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 0.63 0.00 0.00 0.96 0.00 0.00 50 L 7.91 4.41 0.00 1.50 1.52 0.84 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.58 5.05 1.38 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 0.00 0.00 52 K 7.78 4.02 0.00 1.85 1.86 0.00 1.55 0.00 0.00 1.86 0.00 0.00 3.12 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.55 7.81 53 P 0.00 4.22 0.00 2.19 2.36 0.00 3.74 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 54 E 8.27 3.85 0.00 2.06 2.02 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 2.36 2.38 0.00 55 A 7.56 4.01 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.21 3.96 0.00 2.20 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 0.00 2.29 2.37 0.00 57 R 8.63 4.04 0.00 1.78 1.90 0.00 3.07 0.00 0.00 3.27 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 58 I 7.29 4.37 2.01 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.67 0.90 0.00 0.00 59 K 8.11 4.68 0.00 1.92 1.80 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.41 7.81 60 L 7.46 5.01 0.00 1.66 1.63 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 61 L 7.32 4.23 0.00 1.94 1.84 0.95 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 62 L 7.94 4.20 0.00 1.69 1.83 1.01 1.01 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 63 P 0.00 4.54 0.00 2.21 2.20 0.00 4.05 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.01 0.00 64 Y 8.16 4.23 0.00 2.97 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