NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9393 8.3544 109.7368 45.5377 0.0000 173.8680 2 S 4.2796 7.7750 110.8235 56.0543 63.5238 171.3752 3 R 4.0680 7.9425 119.9658 58.2697 29.2001 177.8632 4 V 3.5328 7.5782 115.3833 66.6219 31.7706 177.6176 5 K 3.6883 8.2882 117.8722 60.0939 31.5958 177.7722 6 A 4.0618 7.9957 121.8044 55.3269 18.4720 179.0035 7 L 4.1328 7.8827 117.6770 57.3548 41.6791 178.8481 8 E 3.7815 9.5938 119.3128 59.5222 29.5422 178.9914 9 E 4.2785 8.2520 118.6413 59.7193 29.5181 179.2778 10 K 4.0023 8.7953 119.6985 59.0955 32.4213 178.6373 11 V 4.0520 7.8815 118.0003 66.2817 31.3087 177.5597 12 K 3.9452 9.2426 119.7590 59.8348 31.9135 178.3250 13 A 4.0009 7.7549 120.7102 55.1732 17.7378 179.2251 14 L 3.8739 8.6385 118.1824 57.9365 41.2325 179.1386 15 E 3.1194 8.1597 119.1544 59.2210 29.4765 178.9400 16 E 3.8386 7.8344 118.5166 59.3054 29.7358 178.5060 17 K 3.8303 8.5343 119.2413 59.6750 31.9801 179.2601 18 V 3.3355 8.4715 118.1106 65.8928 31.2257 177.6491 19 K 4.0287 7.1902 117.3144 58.9270 32.3207 178.2337 20 A 4.1808 8.2116 120.3276 53.6679 18.4962 177.7666 21 L 3.9490 7.9337 118.9719 54.8838 41.8488 178.3717 22 G 3.7695 8.8627 113.9744 46.7036 0.0000 174.3902 23 G 3.8078 8.5766 108.9262 44.3481 0.0000 172.9425 24 G 4.1113 9.2270 106.4565 46.4611 0.0000 175.0008 25 G 4.3144 8.3917 108.9437 44.1509 0.0000 173.4566 26 R 4.8058 7.3996 129.5087 56.1008 32.5275 176.4234 27 I 4.0397 7.1215 111.4597 62.6612 37.9289 177.1321 28 E 3.9063 8.2054 120.1219 60.2764 29.6271 177.7768 29 E 3.7949 8.5075 117.9269 59.3260 29.3450 178.1654 30 L 4.0230 7.9531 118.3587 59.4014 40.2528 179.6172 31 K 3.9801 9.1376 118.3628 59.2227 32.1830 178.9790 32 K 4.1216 8.6239 118.9507 59.7021 32.0031 179.3884 33 K 3.9410 8.1095 117.9338 59.3904 32.0835 179.0500 34 W 4.2039 8.9456 129.0382 60.4814 30.6582 177.8272 35 E 3.7225 8.5091 118.8052 58.7522 28.7783 178.4591 36 E 4.1873 7.8842 116.6363 57.7456 30.0264 178.2441 37 L 4.0569 8.1630 121.4711 57.8791 42.5236 178.4110 38 K 3.3022 7.5629 119.4402 59.4243 31.7350 178.4896 39 K 3.9260 7.4862 118.6517 58.8441 31.9140 179.0412 40 K 3.9717 8.5759 119.8094 59.3354 31.9764 179.3141 41 I 3.7028 7.5908 117.9964 63.8310 36.9814 178.0961 42 E 4.0568 7.5772 118.8339 59.3261 29.6363 178.2673 43 E 4.3500 7.6907 116.0572 55.7061 29.9113 175.5041 44 L 3.8092 7.3561 118.9777 56.6574 41.6246 176.9887 45 G 4.1474 9.3372 116.3580 45.7421 0.0000 171.0895 46 G 3.9987 8.2955 107.5514 45.0479 0.0000 172.3676 47 G 3.9497 8.0686 115.2422 45.2345 0.0000 174.2148 48 G 4.0906 8.2852 105.9326 46.4467 0.0000 172.8924 49 E 4.5119 7.4466 117.6087 56.1236 30.0523 178.9684 50 V 3.5406 8.0580 121.3520 66.2799 31.1946 177.2122 51 K 3.9758 8.1456 117.6529 59.5842 31.5800 178.6969 52 K 3.9816 8.0920 118.3444 59.7618 32.4460 178.8777 53 V 3.4590 7.9342 116.8804 66.9983 31.2065 177.3004 54 E 3.7830 8.5702 116.3167 60.1520 29.4852 179.3441 55 E 3.9871 8.3648 118.5065 59.8535 29.4385 179.6501 56 E 3.9704 8.6726 119.5489 59.0992 29.9292 178.8546 57 V 3.6793 7.6465 117.3229 65.0421 31.5309 177.8515 58 K 3.8959 8.3980 120.3437 59.6440 32.3081 178.4362 59 K 3.8090 7.8410 119.6673 60.4188 31.3260 177.4637 60 L 4.2003 7.7914 119.6462 56.2196 41.4531 179.0096 61 E 4.0196 8.4090 117.9460 60.3385 29.7428 179.1988 62 E 4.0062 8.6007 118.6465 59.3630 29.2778 178.7711 63 E 3.8794 8.3789 118.0933 59.8845 29.7214 179.4200 64 I 3.6008 8.7177 118.4566 64.6368 37.2684 178.3722 65 K 4.0876 8.5223 118.5019 58.7069 31.8542 178.5967 66 K 4.2038 7.6539 119.0200 58.2285 32.5083 176.7929 67 L 4.2634 8.5924 124.2274 55.1256 41.7514 176.7694 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 G 8.35 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 0.00 0.00 0.00 2 S 7.77 4.28 0.00 3.86 3.80 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 3 R 7.94 4.07 0.00 2.07 1.96 0.00 3.19 0.00 0.00 3.26 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 4 V 7.58 3.53 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 1.10 0.00 0.00 0.98 0.00 0.00 5 K 8.29 3.69 0.00 1.90 1.76 0.00 1.69 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.61 7.81 6 A 8.00 4.06 1.36 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 0.00 0.00 0.00 7 L 7.88 4.13 0.00 1.93 1.66 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 8 E 9.59 3.78 0.00 2.15 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 2.35 2.43 0.00 9 E 8.25 4.28 0.00 2.29 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 2.36 2.53 0.00 10 K 8.80 4.00 0.00 1.87 1.83 0.00 1.68 0.00 0.00 1.60 0.00 0.00 3.03 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.48 1.53 7.81 11 V 7.88 4.05 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 0.82 0.00 0.00 0.96 0.00 0.00 12 K 9.24 3.95 0.00 1.83 2.10 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.58 7.81 13 A 7.75 4.00 1.40 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 0.00 0.00 14 L 8.64 3.87 0.00 1.86 1.38 1.09 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.16 3.12 0.00 2.21 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 0.00 2.28 2.66 0.00 16 E 7.83 3.84 0.00 1.97 1.91 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 2.27 2.47 0.00 17 K 8.53 3.83 0.00 1.96 1.75 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.45 7.81 18 V 8.47 3.34 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.44 0.00 0.00 19 K 7.19 4.03 0.00 1.88 1.90 0.00 1.83 0.00 0.00 1.68 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.40 7.81 20 A 8.21 4.18 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 21 L 7.93 3.95 0.00 1.66 1.58 0.85 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 22 G 8.86 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.58 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 24 G 9.23 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 0.00 0.00 0.00 25 G 8.39 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 0.00 0.00 0.00 0.00 26 R 7.40 4.81 0.00 1.80 1.95 0.00 3.36 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.33 0.00 27 I 7.12 4.04 1.81 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 1.49 0.83 0.91 0.00 0.00 28 E 8.21 3.91 0.00 1.98 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 2.32 2.43 0.00 29 E 8.51 3.79 0.00 2.08 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 2.40 2.40 0.00 30 L 7.95 4.02 0.00 1.98 1.96 0.89 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 31 K 9.14 3.98 0.00 1.92 2.01 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.30 1.47 7.81 32 K 8.62 4.12 0.00 1.89 1.89 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.60 7.81 33 K 8.11 3.94 0.00 1.87 1.91 0.00 1.87 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.57 1.54 7.81 34 W 8.95 4.20 0.00 3.41 3.28 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 35 E 8.51 3.72 0.00 2.37 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 2.26 2.46 0.00 36 E 7.88 4.19 0.00 1.92 1.98 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 2.29 2.42 0.00 37 L 8.16 4.06 0.00 1.70 1.87 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.56 3.30 0.00 0.94 1.21 0.00 1.39 0.00 0.00 1.37 0.00 0.00 2.13 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.18 1.09 7.81 39 K 7.49 3.93 0.00 2.04 1.85 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.42 7.81 40 K 8.58 3.97 0.00 1.92 1.79 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.59 7.81 41 I 7.59 3.70 1.79 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 1.59 0.47 0.88 0.00 0.00 42 E 7.58 4.06 0.00 2.16 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 43 E 7.69 4.35 0.00 1.88 1.93 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 2.30 2.32 0.00 44 L 7.36 3.81 0.00 1.77 1.66 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 45 G 9.34 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 46 G 8.30 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 47 G 8.07 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.29 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 0.00 0.00 0.00 49 E 7.45 4.51 0.00 2.18 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.23 0.00 50 V 8.06 3.54 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 1.15 0.00 0.00 0.92 0.00 0.00 51 K 8.15 3.98 0.00 1.83 1.88 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.58 7.81 52 K 8.09 3.98 0.00 1.90 1.85 0.00 1.63 0.00 0.00 1.63 0.00 0.00 3.14 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.48 7.81 53 V 7.93 3.46 2.20 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 0.88 0.00 0.00 0.92 0.00 0.00 54 E 8.57 3.78 0.00 2.04 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 2.35 2.55 0.00 55 E 8.36 3.99 0.00 2.27 2.05 0.00 0.00 0.00 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 2.36 0.00 56 E 8.67 3.97 0.00 2.23 1.98 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 2.31 2.38 0.00 57 V 7.65 3.68 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 1.04 0.00 0.00 1.00 0.00 0.00 58 K 8.40 3.90 0.00 1.97 1.89 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.48 7.81 59 K 7.84 3.81 0.00 1.85 1.87 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.54 7.81 60 L 7.79 4.20 0.00 1.94 1.64 1.21 0.86 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 61 E 8.41 4.02 0.00 2.16 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 2.58 0.00 62 E 8.60 4.01 0.00 2.16 1.94 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 2.34 2.33 0.00 63 E 8.38 3.88 0.00 2.33 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 2.31 2.42 0.00 64 I 8.72 3.60 1.88 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.68 0.86 0.00 0.00 65 K 8.52 4.09 0.00 1.98 1.87 0.00 1.69 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.59 7.81 66 K 7.65 4.20 0.00 1.90 1.84 0.00 1.83 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.61 7.81 67 L 8.59 4.26 0.00 1.70 1.56 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00