NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3273 8.1744 110.9433 61.2923 70.6122 173.3901 6 N 4.7050 7.9421 120.0862 53.3163 39.1810 173.3584 7 S 4.4498 8.1259 112.1492 57.4417 64.8148 172.7946 8 D 4.8903 8.5112 121.8724 54.6515 42.5168 174.2440 9 F 5.2929 7.8985 115.5093 55.5103 41.5613 173.8018 10 V 4.5429 8.8071 111.2831 59.5273 35.7744 174.9604 11 V 4.8119 8.5706 123.8511 61.3494 33.9073 174.4686 12 I 4.8955 9.1730 128.3004 59.4779 40.7353 174.0863 13 K 5.0438 9.3034 129.4458 54.3388 34.2073 175.2034 14 A 4.4256 8.7835 130.3989 52.1529 19.2360 177.3940 15 L 4.6862 8.9192 121.9506 54.4293 42.6461 175.7811 16 E 4.6547 7.6590 115.7154 55.0450 32.2179 174.3844 17 D 4.4780 8.3867 119.2275 55.5592 41.3102 176.6387 18 G 3.8471 8.6429 109.1595 46.2817 0.0000 174.0099 19 V 3.9228 7.5960 119.5893 62.6669 32.8788 174.4327 20 N 5.3479 9.0482 124.6030 51.4529 41.4820 173.6444 21 V 4.4680 8.7770 124.5952 61.4848 33.3963 174.1189 22 I 4.4900 8.6803 130.3766 59.3735 39.4196 175.2146 23 G 4.0772 8.9347 115.3667 45.2389 0.0000 172.6041 24 L 5.2999 8.8621 126.7915 53.6515 43.5150 176.5883 25 T 4.4075 8.6458 114.3498 61.7457 69.2760 174.2930 26 R 4.4349 7.8351 125.6268 57.3289 30.8736 175.1880 27 G 3.8083 8.9706 108.6792 44.0488 0.0000 172.5697 28 A 4.0743 8.8724 121.2533 55.0235 18.4191 177.8837 29 D 4.8041 7.8263 113.0721 53.4755 42.5024 176.1542 30 T 4.7184 8.2455 121.9079 61.3610 69.5811 172.5997 31 R 4.7450 9.0456 123.0335 53.8370 33.8601 174.1555 32 F 5.4237 8.6448 117.9016 57.5742 39.0223 175.8356 33 H 4.8938 9.0532 119.4156 56.7726 30.2247 174.7753 34 H 4.8714 7.6225 117.5589 54.9250 33.2924 172.2238 35 S 4.8364 8.3191 119.6445 56.4400 65.1404 172.6920 36 E 4.3320 8.8952 127.2906 54.4414 30.8611 174.7267 37 K 4.6655 8.6136 129.1668 56.0614 33.3921 175.6576 38 L 4.9737 9.1248 127.5835 53.1656 44.8991 176.0998 39 D 5.0865 9.1774 123.4508 52.2484 43.5525 175.8949 40 K 3.9814 8.7816 121.7300 58.4306 32.2675 176.9537 41 G 4.0331 9.0954 115.6914 45.2365 0.0000 173.5589 42 E 4.2084 8.1301 119.8126 56.3449 30.7183 176.0454 43 V 4.9397 8.3235 122.5122 60.9982 34.2369 174.2027 44 L 4.7905 9.1183 129.7027 53.2379 44.8618 174.8215 45 I 5.0749 8.4281 125.9559 59.5184 39.7723 174.8169 46 A 4.6210 9.1155 128.9766 50.2936 22.1425 175.5221 47 Q 4.7563 8.7048 121.5070 55.3006 30.1950 175.8952 48 F 4.7790 8.4194 120.3889 57.9377 39.8649 175.2101 49 T 4.7141 8.7842 111.5133 59.9884 72.0103 173.0222 50 E 4.0057 9.0095 121.2853 59.5764 29.5322 177.4129 51 H 4.6014 8.1768 113.5746 56.2774 29.9175 174.1668 52 T 5.4963 8.3830 116.7546 60.8399 71.3515 174.4399 53 S 4.9591 8.9820 119.6474 58.0580 65.0076 173.2598 54 A 5.1513 7.8700 121.1378 51.2478 22.5272 175.1855 55 I 4.9475 8.5468 120.6955 59.3947 40.7277 174.6657 56 K 4.5789 8.8926 128.2803 54.5351 34.6451 174.7116 57 V 4.7972 8.3791 126.5849 61.1981 33.5964 174.5320 58 R 4.5354 9.0855 127.4003 55.4474 32.7199 176.1068 59 G 4.1232 9.0162 109.1981 44.0240 0.0000 172.4968 60 K 4.6074 9.8427 120.5451 55.4756 33.0555 175.5902 61 A 5.0977 8.5187 127.0393 51.0102 23.4512 173.7314 62 Y 5.0427 9.3433 121.5333 55.9162 41.4730 174.6548 63 I 4.9781 8.0664 126.5392 59.5461 41.1924 174.1944 64 Q 5.0034 8.8749 125.8719 54.3340 31.8196 174.9167 65 T 4.7969 8.6824 112.8324 59.6426 72.4978 174.4810 66 R 3.7409 8.5553 120.6165 59.6282 29.8239 176.5668 67 H 4.6215 8.2610 112.4154 55.4727 29.4304 174.4052 68 G 3.7365 6.8236 106.3068 44.0736 0.0000 173.0235 69 V 4.7470 7.7521 112.4619 59.9882 34.4550 175.2494 70 I 4.3686 8.0626 120.9692 60.2263 41.9107 172.6981 71 E 5.2265 8.6345 126.8916 54.5365 31.3989 176.1690 72 S 4.5444 8.7952 119.2172 58.2076 64.9057 172.8940 73 E 4.8125 8.7074 119.5961 54.4829 33.0175 176.2898 74 G 3.7166 8.6208 110.6413 45.7425 0.0000 172.9038 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 5 T 8.17 4.33 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 6 N 7.94 4.71 0.00 2.80 2.85 0.00 0.00 7.11 6.75 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 7 S 8.13 4.45 0.00 4.13 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 8 D 8.51 4.89 0.00 2.81 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 9 F 7.90 5.29 0.00 2.99 2.93 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 0.00 0.00 0.00 0.00 10 V 8.81 4.54 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 0.57 0.00 0.00 0.86 0.00 0.00 11 V 8.57 4.81 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 1.17 0.00 0.00 1.16 0.00 0.00 12 I 9.17 4.90 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 1.08 0.50 0.91 0.00 0.00 13 K 9.30 5.04 0.00 1.87 1.84 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.39 7.81 14 A 8.78 4.43 1.30 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 15 L 8.92 4.69 0.00 1.61 1.70 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.66 4.65 0.00 2.03 1.90 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 2.19 2.32 0.00 17 D 8.39 4.48 0.00 2.69 2.64 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 18 G 8.64 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 19 V 7.60 3.92 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 0.88 0.00 0.00 1.06 0.00 0.00 20 N 9.05 5.35 0.00 2.59 2.56 0.00 0.00 6.34 7.43 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 21 V 8.78 4.47 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 0.99 0.00 0.00 0.89 0.00 0.00 22 I 8.68 4.49 1.53 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.24 -0.42 0.00 0.00 23 G 8.93 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 0.00 0.00 0.00 24 L 8.86 5.30 0.00 1.90 1.71 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.65 4.41 4.31 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 1.33 0.00 0.00 26 R 7.84 4.43 0.00 1.90 1.94 0.00 3.18 0.00 0.00 3.07 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.44 0.00 27 G 8.97 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 28 A 8.87 4.07 1.30 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 29 D 7.83 4.80 0.00 2.64 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 30 T 8.25 4.72 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 1.28 0.00 0.00 31 R 9.05 4.75 0.00 1.79 2.01 0.00 2.78 0.00 0.00 3.50 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 32 F 8.64 5.42 0.00 2.90 2.91 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 33 H 9.05 4.89 0.00 3.17 3.51 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.62 4.87 0.00 3.26 3.05 0.00 5.80 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.32 4.84 0.00 3.63 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.90 4.33 0.00 2.13 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 2.25 2.28 0.00 37 K 8.61 4.67 0.00 1.78 1.68 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.40 1.45 7.81 38 L 9.12 4.97 0.00 1.54 1.51 0.92 0.92 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 39 D 9.18 5.09 0.00 2.58 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.78 3.98 0.00 1.69 1.74 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.45 1.30 7.81 41 G 9.10 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 42 E 8.13 4.21 0.00 2.06 1.88 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 2.33 2.26 0.00 43 V 8.32 4.94 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 0.85 0.00 0.00 0.96 0.00 0.00 44 L 9.12 4.79 0.00 1.72 1.45 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.43 5.07 1.78 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 1.29 0.81 0.74 0.00 0.00 46 A 9.12 4.62 1.11 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 0.00 0.00 47 Q 8.70 4.76 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.93 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 48 F 8.42 4.78 0.00 3.03 2.96 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 49 T 8.78 4.71 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 1.28 0.00 0.00 50 E 9.01 4.01 0.00 1.94 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 0.00 2.06 2.29 0.00 51 H 8.18 4.60 0.00 3.21 3.16 0.00 5.80 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.38 5.50 4.38 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 1.42 0.00 0.00 53 S 8.98 4.96 0.00 3.83 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 54 A 7.87 5.15 1.30 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 55 I 8.55 4.95 1.87 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.74 0.84 0.00 0.00 56 K 8.89 4.58 0.00 1.82 1.54 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.36 7.81 57 V 8.38 4.80 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 0.85 0.00 0.00 0.90 0.00 0.00 58 R 9.09 4.54 0.00 1.73 1.78 0.00 3.16 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 1.54 1.52 0.00 59 G 9.02 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 0.00 0.00 0.00 0.00 60 K 9.84 4.61 0.00 1.82 1.71 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.26 7.81 61 A 8.52 5.10 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 62 Y 9.34 5.04 0.00 3.02 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 63 I 8.07 4.98 1.85 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 1.18 0.51 0.83 0.00 0.00 64 Q 8.87 5.00 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.17 2.13 0.00 65 T 8.68 4.80 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 1.15 0.00 0.00 66 R 8.56 3.74 0.00 1.71 1.70 0.00 3.20 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 67 H 8.26 4.62 0.00 3.18 3.27 0.00 5.70 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 6.82 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 7.75 4.75 1.81 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 0.68 0.00 0.00 0.95 0.00 0.00 70 I 8.06 4.37 1.81 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 1.20 1.31 0.84 0.00 0.00 71 E 8.63 5.23 0.00 1.91 1.88 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 2.40 2.42 0.00 72 S 8.80 4.54 0.00 3.95 3.98 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 73 E 8.71 4.81 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 2.21 2.29 0.00 74 G 8.62 3.72 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 0.00 0.00 0.00