NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.2977 8.1127 119.7054 56.0536 31.5976 173.6136 5 E 4.7943 8.2103 119.4130 53.2168 32.3405 173.6211 6 C 4.2676 9.6213 127.7145 59.4647 32.7128 173.5068 7 D 4.5363 8.5945 126.6135 55.8214 39.7247 175.6337 8 Y 4.4251 6.8871 118.4336 58.9247 41.6090 176.3399 9 C 3.9648 8.1991 113.7804 60.2090 30.6392 175.6000 10 G 3.9793 8.4265 106.1306 44.7230 0.0000 173.1482 11 T 4.3941 7.6910 110.1854 60.7811 71.1303 173.4285 12 D 4.9681 8.4745 122.3506 53.9352 41.5114 176.4959 13 I 3.9709 8.1980 125.6705 60.6575 37.6803 175.9841 14 E 3.9822 8.9264 129.0472 55.2754 29.9772 174.6420 15 P 4.2729 0.0000 0.0000 64.3327 31.7693 176.1914 16 G 3.9006 9.9410 108.7990 46.2386 0.0000 172.9178 17 T 4.5497 7.6504 113.5041 62.4765 72.5680 174.3981 18 G 4.1495 9.0615 108.0901 45.7988 0.0000 172.6549 19 T 4.7987 8.2876 114.2009 61.6871 72.5716 173.1712 20 M 5.0386 8.7373 124.1709 53.8924 34.2889 174.4078 21 F 4.8172 9.4462 130.1663 57.1351 41.3085 174.4193 22 V 4.3405 7.6195 126.3385 61.3158 32.3402 175.2191 23 H 4.1297 8.8904 126.2113 54.8654 29.5673 176.7639 24 K 3.8916 8.6995 121.8576 59.7774 31.9059 177.8091 25 D 4.4056 7.9462 116.0217 54.2224 39.5861 176.3092 26 G 3.8452 7.7113 106.5988 45.1105 0.0000 174.2364 27 A 4.1484 8.5471 122.8878 52.6776 19.6244 176.5261 28 T 4.9614 8.4385 116.9122 62.0173 71.3789 173.8079 29 T 4.6160 8.9182 122.8084 62.0439 71.8362 172.7624 30 H 4.9895 9.3960 125.1262 55.0479 30.2620 174.7467 31 F 5.3919 9.4928 122.0622 55.9785 41.7627 176.2073 32 C 4.3701 9.1492 116.3775 60.1421 30.4875 173.6498 33 S 4.6286 7.6148 113.9953 56.1930 66.6459 174.8698 34 S 4.2361 8.4906 116.1954 61.1118 62.8457 176.0973 35 K 3.7593 7.9495 122.8907 59.7671 31.9527 178.3956 36 C 4.2227 7.7274 116.5237 62.6170 28.1798 175.9677 37 E 2.5584 7.3183 118.8831 59.0123 28.4481 179.1626 38 N 4.2435 8.0825 116.6688 56.1486 38.4303 177.3387 39 N 4.4353 8.0108 117.6836 56.0176 38.7375 177.3696 40 A 4.1274 7.4238 121.9390 55.1263 18.2418 179.3701 41 D 4.3488 7.6631 116.0629 56.7813 40.9551 177.9600 42 L 4.3512 7.2854 116.8137 54.5202 41.8114 177.7075 43 G 3.9740 7.7008 106.7723 45.6801 0.0000 174.1655 44 R 4.2544 7.6430 118.7634 55.6075 31.0571 175.7280 45 E 4.5389 8.5611 120.8796 54.3668 30.8950 176.8347 46 A 3.4530 8.2010 126.6790 55.2455 18.3939 179.7711 47 R 3.8163 7.6773 113.5193 59.0981 30.2187 177.4104 48 N 4.4878 7.9794 113.2625 53.8010 39.0741 174.7416 49 L 4.5749 7.1849 119.4688 52.6246 42.6960 177.2376 50 E 3.9725 8.9123 124.4785 58.9838 29.6207 178.6628 51 W 4.3901 8.0095 114.6166 58.9247 29.0164 176.8091 52 T 3.7884 6.7042 116.9174 62.9964 67.0554 175.4684 53 D 4.4016 8.5102 124.8404 57.5611 41.1902 178.9298 54 T 3.9309 7.6326 114.9103 65.8648 68.7612 175.8029 55 A 4.0869 7.2226 122.3306 54.4898 19.0366 177.4328 56 R 4.1112 7.5215 114.9995 56.4409 29.7106 176.1909 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 4 R 8.11 4.30 0.00 1.88 1.89 0.00 2.94 0.00 0.00 3.11 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 5 E 8.21 4.79 0.00 1.95 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 2.17 2.52 0.00 6 C 9.62 4.27 0.00 3.09 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 7 D 8.59 4.54 0.00 2.67 2.63 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 8 Y 6.89 4.43 0.00 2.94 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.20 3.96 0.00 3.09 3.34 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 10 G 8.43 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 0.00 0.00 0.00 11 T 7.69 4.39 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 1.33 0.00 0.00 12 D 8.47 4.97 0.00 2.61 2.68 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 0.00 0.00 0.00 0.00 13 I 8.20 3.97 1.91 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 1.19 0.57 0.97 0.00 0.00 14 E 8.93 3.98 0.00 1.93 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 2.31 2.38 0.00 15 P 0.00 4.27 0.00 2.23 2.06 0.00 3.86 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 2.00 1.98 0.00 16 G 9.94 3.90 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 0.00 17 T 7.65 4.55 4.53 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 0.00 0.00 1.25 0.00 0.00 18 G 9.06 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.29 4.80 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 20 M 8.74 5.04 0.00 1.97 1.87 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.35 0.00 21 F 9.45 4.82 0.00 3.36 3.20 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 0.00 22 V 7.62 4.34 1.86 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 0.74 0.00 0.00 0.84 0.00 0.00 23 H 8.89 4.13 0.00 3.30 3.22 0.00 5.68 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.70 3.89 0.00 1.74 1.87 0.00 1.80 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.44 7.81 25 D 7.95 4.41 0.00 2.82 2.79 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 26 G 7.71 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 27 A 8.55 4.15 1.20 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 0.00 0.00 0.00 28 T 8.44 4.96 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 29 T 8.92 4.62 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 0.67 0.00 0.00 30 H 9.40 4.99 0.00 3.09 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.49 5.39 0.00 3.13 2.85 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 32 C 9.15 4.37 0.00 3.17 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.61 4.63 0.00 4.03 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 34 S 8.49 4.24 0.00 3.97 4.09 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 0.00 0.00 0.00 0.00 35 K 7.95 3.76 0.00 1.73 1.81 0.00 1.35 0.00 0.00 1.24 0.00 0.00 2.13 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.44 1.31 7.81 36 C 7.73 4.22 0.00 3.14 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 7.32 2.56 0.00 1.75 1.29 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 1.47 2.08 0.00 38 N 8.08 4.24 0.00 2.60 2.76 0.00 0.00 7.07 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 39 N 8.01 4.44 0.00 2.93 3.11 0.00 0.00 6.84 7.41 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 40 A 7.42 4.13 1.25 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 0.00 0.00 0.00 41 D 7.66 4.35 0.00 2.72 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 42 L 7.29 4.35 0.00 1.88 1.73 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 43 G 7.70 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 44 R 7.64 4.25 0.00 2.12 2.00 0.00 3.27 0.00 0.00 3.37 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 45 E 8.56 4.54 0.00 1.99 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 2.33 2.31 0.00 46 A 8.20 3.45 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.68 3.82 0.00 1.73 1.92 0.00 3.14 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 48 N 7.98 4.49 0.00 2.80 2.84 0.00 0.00 6.93 7.15 0.00 0.00 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 7.18 4.57 0.00 1.23 1.19 1.20 0.91 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 50 E 8.91 3.97 0.00 2.03 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 2.32 2.33 0.00 51 W 8.01 4.39 0.00 3.55 3.21 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 0.00 0.00 0.00 0.00 52 T 6.70 3.79 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 0.98 0.00 0.00 53 D 8.51 4.40 0.00 2.93 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 54 T 7.63 3.93 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 1.09 0.00 0.00 55 A 7.22 4.09 1.26 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 0.00 0.00 56 R 7.52 4.11 0.00 1.95 1.90 0.00 3.11 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.54 0.00