NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2789 8.3144 121.7877 56.5603 33.8892 176.0753 3 L 4.4011 7.8792 119.2753 54.1787 44.3518 176.6702 4 S 4.1379 8.1709 113.4185 60.8766 63.4952 175.3988 5 E 3.8914 8.2105 123.1895 59.2985 29.3503 178.7310 6 V 3.6492 7.5819 117.7361 65.9720 31.7225 177.9393 7 R 3.8969 8.1357 118.0868 59.1947 30.0472 178.8772 8 K 3.9107 8.7437 119.5307 59.8330 32.1739 178.9601 9 Q 3.8858 9.0204 119.4425 58.9286 28.6468 180.0526 10 L 3.9709 8.2547 119.9438 57.8174 41.5027 178.9291 11 E 3.8860 7.8113 117.8868 59.6915 29.7046 178.8101 12 E 4.0467 8.2343 117.5083 59.2816 29.2404 178.8232 13 A 4.0684 7.6510 120.8072 55.7452 18.2865 179.8028 14 R 3.9155 7.8227 115.0552 57.9140 31.3883 177.1870 15 K 4.6993 8.4937 117.7125 56.1190 32.3185 175.0869 16 L 4.4630 8.1870 119.0617 57.2164 44.6388 178.6123 17 S 4.5940 8.7651 111.5522 57.8243 62.8556 168.6272 18 P 4.1429 0.0000 0.0000 65.6813 31.1964 178.5608 19 V 3.7501 7.7863 116.3569 66.2536 31.4968 177.5854 20 E 3.9922 7.9963 117.8297 59.3948 29.2071 179.5657 21 L 3.9497 8.1676 118.9880 57.8182 41.8460 178.9139 22 E 3.9475 8.8409 119.5054 60.1485 29.4673 179.4491 23 K 3.9439 8.3202 118.0786 58.9262 32.2389 179.0848 24 L 4.6814 8.2444 121.7502 58.4734 42.2056 179.3603 25 V 3.5332 8.1682 118.0829 66.2686 31.5434 177.9159 26 R 3.7966 7.8725 117.8817 59.5399 30.0675 177.8275 27 E 3.9204 8.1751 118.1597 59.6092 29.4771 179.6211 28 K 4.2245 7.9784 117.4682 58.8879 32.1630 179.3714 29 K 4.0493 7.8941 119.2499 58.9010 32.1652 179.1865 30 R 3.8626 7.7967 118.8719 59.3131 29.8888 178.0947 31 E 4.1718 8.6068 120.8122 58.3408 29.3872 178.7473 32 L 3.9637 7.5581 120.7537 58.1637 42.2733 178.2039 33 M 4.0241 7.8187 117.8140 58.8368 31.6050 177.6053 34 E 3.7632 8.0772 118.4711 59.6688 29.4539 179.4629 35 L 4.0252 7.6160 118.3142 58.1451 41.7797 179.6527 36 R 3.8342 8.2621 118.0193 59.5490 29.7365 179.1690 37 F 4.1053 8.2337 117.8105 59.9307 39.4889 177.5353 38 Q 4.1918 8.5230 117.6879 59.0702 28.5381 178.5073 39 A 3.9809 9.1251 122.8088 55.5216 17.9619 179.7134 40 S 4.0907 8.2959 112.8590 60.7506 62.6982 175.9251 41 I 4.3622 7.5979 113.2614 59.9865 37.6832 177.0611 42 G 4.0392 8.8078 112.8887 46.2839 0.0000 174.0663 43 Q 4.0472 8.1058 120.2456 56.6998 29.5236 177.2066 44 L 3.9622 7.0670 119.6709 55.2970 38.1346 175.6100 45 S 4.4734 8.6271 112.1600 56.8759 65.5196 175.9159 46 Q 4.5190 8.2818 126.5663 57.5493 29.1824 176.9258 47 N 3.8628 8.5119 122.4015 54.3767 40.1596 178.2953 48 H 3.7987 8.2082 121.7895 59.0576 30.8266 176.5877 49 K 3.7793 8.0291 120.5410 58.9757 31.4032 177.6873 50 I 4.1541 6.7978 119.5033 63.1713 37.6133 178.4996 51 R 4.4892 7.6233 122.0108 55.6547 28.6204 177.3179 52 D 4.6452 10.6100 116.4864 55.8296 45.9918 176.7236 53 L 4.1230 7.7264 120.3657 57.7240 42.0865 179.0436 54 K 4.0591 8.0405 118.3620 59.2405 32.1232 178.9263 55 R 4.1630 7.9066 117.0204 58.0868 30.2133 178.4119 56 Q 4.0111 7.6269 119.0371 59.0527 29.0360 177.9305 57 I 3.8091 7.6463 120.3077 63.9930 37.0249 178.2585 58 A 3.9323 7.9107 121.2720 55.1339 18.4364 179.2221 59 R 3.8410 7.9026 117.1770 59.9563 29.9894 178.1998 60 L 3.9518 8.3406 118.5808 57.8239 41.6468 179.1981 61 L 3.9430 8.0829 118.5704 58.4607 41.7027 179.5703 62 T 3.8736 8.4838 115.6711 67.0105 68.3648 176.2646 63 V 3.6515 7.6898 119.0520 66.1336 31.3869 177.5385 64 L 3.8392 7.8880 119.1022 58.7076 41.9923 178.3102 65 N 4.3888 8.3574 117.1055 56.2190 38.7054 176.2256 66 E 3.9707 7.8649 118.4518 59.8347 29.6797 179.3152 67 K 4.1249 7.9992 117.9557 56.9298 32.8196 177.0552 68 R 4.4958 7.9117 118.5569 54.5299 30.6632 173.8751 69 R 4.4968 8.0038 128.1197 56.4862 34.6340 175.7829 70 Q 4.5381 7.9494 113.3587 52.3729 28.2343 173.8013 71 N 4.9175 7.7402 128.8726 54.8457 40.6435 173.8733 72 A 4.1741 8.0230 125.1265 52.9346 18.4096 177.0079 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 K 8.31 4.28 0.00 1.72 1.86 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.54 1.36 7.81 3 L 7.88 4.40 0.00 1.75 1.57 0.92 0.56 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 4 S 8.17 4.14 0.00 4.08 4.11 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 5 E 8.21 3.89 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 6 V 7.58 3.65 2.25 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 1.09 0.00 0.00 0.93 0.00 0.00 7 R 8.14 3.90 0.00 2.07 1.97 0.00 3.18 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 8 K 8.74 3.91 0.00 1.92 1.90 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.74 1.48 7.81 9 Q 9.02 3.89 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.71 0.00 10 L 8.25 3.97 0.00 1.83 1.71 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 11 E 7.81 3.89 0.00 2.11 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 0.00 2.34 2.40 0.00 12 E 8.23 4.05 0.00 2.14 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 2.33 2.36 0.00 13 A 7.65 4.07 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 7.82 3.92 0.00 1.95 2.05 0.00 3.11 0.00 0.00 3.27 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 15 K 8.49 4.70 0.00 1.78 1.81 0.00 1.54 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.47 1.33 7.81 16 L 8.19 4.46 0.00 1.81 1.69 0.95 0.86 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 17 S 8.77 4.59 0.00 4.05 4.40 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 18 P 0.00 4.14 0.00 2.18 2.14 0.00 3.60 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 19 V 7.79 3.75 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 1.07 0.00 0.00 0.93 0.00 0.00 20 E 8.00 3.99 0.00 2.17 1.99 0.00 0.00 0.00 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 2.36 0.00 21 L 8.17 3.95 0.00 1.98 1.71 0.94 0.87 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 22 E 8.84 3.95 0.00 2.09 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 2.49 2.53 0.00 23 K 8.32 3.94 0.00 1.94 1.96 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.44 7.81 24 L 8.24 4.68 0.00 1.81 1.82 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 25 V 8.17 3.53 2.25 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 0.94 0.00 0.00 0.95 0.00 0.00 26 R 7.87 3.80 0.00 2.07 2.17 0.00 3.15 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 27 E 8.18 3.92 0.00 2.36 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 2.32 2.39 0.00 28 K 7.98 4.22 0.00 1.80 1.86 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.69 7.81 29 K 7.89 4.05 0.00 2.05 1.84 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.58 7.81 30 R 7.80 3.86 0.00 1.88 2.01 0.00 3.07 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.55 0.00 31 E 8.61 4.17 0.00 2.00 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 0.00 2.30 2.17 0.00 32 L 7.56 3.96 0.00 2.00 1.80 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 33 M 7.82 4.02 0.00 2.20 2.04 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.41 0.00 34 E 8.08 3.76 0.00 2.17 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 2.21 2.35 0.00 35 L 7.62 4.03 0.00 1.83 1.74 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.26 3.83 0.00 2.29 2.12 0.00 3.16 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.95 0.00 37 F 8.23 4.11 0.00 3.13 3.17 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 38 Q 8.52 4.19 0.00 2.25 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 39 A 9.13 3.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.30 4.09 0.00 3.88 4.40 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 41 I 7.60 4.36 1.86 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.01 0.88 0.00 0.00 42 G 8.81 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 43 Q 8.11 4.05 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.61 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 44 L 7.07 3.96 0.00 1.72 1.62 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.63 4.47 0.00 3.94 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 46 Q 8.28 4.52 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.12 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 47 N 8.51 3.86 0.00 2.93 2.52 0.00 0.00 6.85 8.16 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 48 H 8.21 3.80 0.00 3.37 3.79 0.00 5.48 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 8.03 3.78 0.00 1.80 1.87 0.00 1.61 0.00 0.00 1.61 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.23 7.81 50 I 6.80 4.15 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.85 0.92 0.00 0.00 51 R 7.62 4.49 0.00 1.92 2.04 0.00 3.02 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 52 D 10.61 4.65 0.00 2.79 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 53 L 7.73 4.12 0.00 2.02 1.74 0.93 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.04 4.06 0.00 1.85 1.84 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.63 7.81 55 R 7.91 4.16 0.00 1.86 1.97 0.00 3.13 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 56 Q 7.63 4.01 0.00 2.29 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 57 I 7.65 3.81 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.69 0.91 0.00 0.00 58 A 7.91 3.93 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.90 3.84 0.00 2.16 2.09 0.00 3.11 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 1.64 1.71 0.00 60 L 8.34 3.95 0.00 1.89 1.70 0.92 0.61 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 61 L 8.08 3.94 0.00 2.03 1.74 0.92 0.65 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 62 T 8.48 3.87 4.52 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 0.00 0.00 1.21 0.00 0.00 63 V 7.69 3.65 2.25 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 1.08 0.00 0.00 1.02 0.00 0.00 64 L 7.89 3.84 0.00 1.67 1.97 0.96 0.97 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 65 N 8.36 4.39 0.00 3.10 2.83 0.00 0.00 6.88 7.21 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 66 E 7.86 3.97 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.45 0.00 67 K 8.00 4.12 0.00 1.91 1.94 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.23 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.49 1.66 7.81 68 R 7.91 4.50 0.00 1.81 1.85 0.00 3.30 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.77 0.00 69 R 8.00 4.50 0.00 1.74 1.90 0.00 3.16 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.44 0.00 70 Q 7.95 4.54 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.13 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 71 N 7.74 4.92 0.00 2.74 3.15 0.00 0.00 7.26 7.96 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 72 A 8.02 4.17 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