NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 3.9923 8.0249 121.4317 61.0501 38.4948 174.6851 2 R 4.2473 7.8923 121.7176 54.0747 33.2790 174.7355 3 F 4.5310 8.8430 122.3589 56.7508 42.1965 175.9918 4 G 4.1393 8.5819 108.2530 46.5615 0.0000 174.4394 5 M 4.5048 7.7852 118.8071 54.6352 32.3251 176.5898 6 G 4.1353 8.3900 104.6681 46.4148 0.0000 175.6138 7 K 4.0895 7.7306 119.7584 58.1441 32.8835 177.6875 8 V 4.6083 7.4254 118.0262 60.7085 30.4359 173.0409 9 P 5.8500 0.0000 0.0000 61.9795 33.0810 175.9630 10 C 5.2830 8.5611 115.5166 52.8661 44.6394 172.0106 11 P 4.4853 0.0000 0.0000 62.2683 32.4590 175.2924 12 D 4.9745 7.7317 116.9856 54.7791 42.0083 175.4873 13 G 3.9737 8.5867 106.8404 44.0470 0.0000 172.8250 14 E 4.0507 8.5401 121.1247 55.9081 28.4136 177.2047 15 V 3.4780 8.3258 125.7047 61.4415 30.7702 177.4995 16 G 4.0103 8.3641 113.0329 46.4321 0.0000 171.2875 17 Y 4.8327 7.0134 115.0308 55.7667 40.4262 174.3778 18 T 4.3153 9.0388 118.7806 64.9285 69.1664 172.0441 19 C 5.4122 9.2765 119.8540 54.0285 44.1894 172.3524 20 D 4.9199 9.5656 119.3947 54.5007 41.6940 175.4723 21 C 4.3156 9.3241 128.3493 58.7435 37.8845 175.5290 22 G 3.8000 8.8175 115.1815 47.5171 0.0000 174.6696 23 E 4.5212 7.7655 118.8194 55.8829 32.9001 176.9148 24 K 4.3305 7.8493 117.2326 55.9813 33.1470 175.0662 25 I 4.9583 8.0012 120.7718 60.0799 38.9319 176.2988 26 C 4.8076 9.5150 124.6529 55.9171 43.2616 172.9711 27 L 5.0327 8.7472 121.5352 52.6930 44.6567 175.5360 28 Y 4.5329 8.5378 121.5147 59.8846 38.8653 177.3762 29 G 3.5701 8.5649 116.2659 45.2041 0.0000 173.2953 30 Q 4.3118 7.8501 120.9476 56.0275 31.1836 173.9670 31 S 5.5380 8.3706 109.1802 58.8064 66.6127 170.9757 32 C 5.0592 8.3837 113.7567 54.9002 44.8623 172.6983 33 N 5.2871 8.5620 116.5567 51.9659 39.2261 175.1178 34 D 4.1636 9.1242 118.4186 55.0259 41.4169 176.3928 35 G 3.7221 8.0994 112.5892 44.2096 0.0000 173.1846 36 Q 3.8541 8.0891 123.3663 56.2744 29.5164 172.2528 37 C 4.9332 8.4505 120.0402 54.8725 39.1387 172.9435 38 S 4.7473 9.4182 123.2467 57.1502 65.7070 172.8701 39 G 4.4374 8.1929 108.5351 43.6618 0.0000 172.4323 40 D 4.8804 8.0591 119.5251 51.3967 42.7048 175.2066 41 P 4.4584 0.0000 0.0000 61.9875 31.7776 175.5085 42 K 3.6308 8.0546 120.9566 57.2606 31.9499 175.3772 43 P 4.9131 0.0000 0.0000 61.3547 34.2847 175.8890 44 S 4.8170 8.5487 113.7838 58.5456 65.1004 173.0784 45 S 4.0477 9.0923 116.6462 60.4708 62.7521 173.7756 46 E 3.8707 8.3860 118.4752 58.7638 29.2276 177.4203 47 F 4.1208 7.7213 116.3199 56.7752 38.7710 174.8252 48 E 3.9506 8.9599 126.7684 56.4863 29.7593 176.7185 49 E 4.0053 8.6217 125.2029 56.8814 30.1465 175.5999 50 F 4.8786 7.4329 114.2683 56.6680 40.4379 173.6345 51 E 4.6137 8.5921 120.1993 55.0419 32.6602 175.2959 52 I 3.8054 8.6227 125.2259 61.1674 38.5071 174.3858 53 D 4.9141 8.1688 126.0639 52.5707 44.6282 174.6026 54 E 4.8018 7.6171 117.5825 58.4717 33.9226 176.1214 55 E 4.4257 8.7552 119.3859 57.5902 29.6237 176.2569 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 I 8.02 3.99 1.59 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.92 0.26 0.00 0.00 2 R 7.89 4.25 0.00 1.73 1.76 0.00 3.37 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.62 0.00 3 F 8.84 4.53 0.00 3.16 3.07 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 0.00 0.00 0.00 4 G 8.58 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.79 4.50 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.46 0.00 6 G 8.39 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.73 4.09 0.00 1.70 1.82 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.57 1.46 7.81 8 V 7.43 4.61 2.12 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 1.21 0.00 0.00 0.75 0.00 0.00 9 P 0.00 5.85 0.00 2.17 2.07 0.00 3.47 0.00 0.00 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.84 0.00 10 C 8.56 5.28 0.00 2.72 2.98 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 11 P 0.00 4.49 0.00 2.19 2.15 0.00 3.66 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 1.92 1.98 0.00 12 D 7.73 4.97 0.00 2.72 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.59 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 14 E 8.54 4.05 0.00 1.90 1.89 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 2.20 2.23 0.00 15 V 8.33 3.48 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 0.70 0.00 0.00 0.70 0.00 0.00 16 G 8.36 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.01 4.83 0.00 2.88 2.90 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 18 T 9.04 4.32 4.34 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 1.06 0.00 0.00 19 C 9.28 5.41 0.00 3.34 3.41 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 0.00 0.00 0.00 0.00 20 D 9.57 4.92 0.00 2.97 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 21 C 9.32 4.32 0.00 3.04 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.82 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 0.00 0.00 0.00 23 E 7.77 4.52 0.00 1.92 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 2.21 2.24 0.00 24 K 7.85 4.33 0.00 1.79 1.73 0.00 1.64 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.53 1.40 7.81 25 I 8.00 4.96 1.80 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.58 0.74 0.00 0.00 26 C 9.52 4.81 0.00 2.84 2.98 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 27 L 8.75 5.03 0.00 1.59 1.59 0.91 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 28 Y 8.54 4.53 0.00 2.96 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 29 G 8.56 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.85 4.31 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.56 0.00 0.00 0.00 0.00 0.00 2.45 2.30 0.00 31 S 8.37 5.54 0.00 3.87 3.86 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 32 C 8.38 5.06 0.00 3.20 3.16 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 0.00 0.00 0.00 0.00 33 N 8.56 5.29 0.00 2.58 2.74 0.00 0.00 7.15 7.94 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 34 D 9.12 4.16 0.00 2.88 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 35 G 8.10 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 36 Q 8.09 3.85 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 37 C 8.45 4.93 0.00 2.95 2.95 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 38 S 9.42 4.75 0.00 3.82 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.19 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.06 4.88 0.00 2.61 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.46 0.00 2.04 2.02 0.00 3.68 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 42 K 8.05 3.63 0.00 1.41 1.66 0.00 1.53 0.00 0.00 1.42 0.00 0.00 3.08 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.44 7.81 43 P 0.00 4.91 0.00 2.31 2.14 0.00 3.96 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.27 0.00 44 S 8.55 4.82 0.00 4.08 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 45 S 9.09 4.05 0.00 4.23 4.20 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 46 E 8.39 3.87 0.00 1.70 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 2.27 2.35 0.00 47 F 7.72 4.12 0.00 3.20 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 48 E 8.96 3.95 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 49 E 8.62 4.01 0.00 1.99 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 2.23 2.28 0.00 50 F 7.43 4.88 0.00 3.08 3.06 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 0.00 0.00 0.00 51 E 8.59 4.61 0.00 1.99 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 2.23 2.25 0.00 52 I 8.62 3.81 1.92 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 1.32 0.64 0.97 0.00 0.00 53 D 8.17 4.91 0.00 2.64 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.62 4.80 0.00 2.16 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 55 E 8.76 4.43 0.00 1.89 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.20 0.00