NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3328 8.1593 117.3728 62.5295 69.8003 173.4358 2 P 4.3012 0.0000 0.0000 62.0960 32.5847 174.1187 3 D 4.3027 8.8999 121.7607 55.6118 41.5228 176.5232 4 C 4.8436 8.9463 119.4237 57.6790 45.8601 174.1378 5 V 4.7135 7.3618 109.9980 59.9519 36.1833 173.8338 6 T 5.0051 8.8323 118.1560 61.0955 72.2697 173.9377 7 G 3.9316 7.9707 111.4068 46.2592 0.0000 171.7747 8 K 4.8198 8.2711 118.9197 55.2438 33.2954 178.2282 9 V 3.9273 8.2056 122.0644 61.9538 30.6857 175.1651 10 E 4.2817 8.7572 130.1068 59.2470 30.0837 176.1426 11 Y 4.9909 7.0786 114.7679 56.4775 41.0755 173.0557 12 T 5.0498 8.6275 109.5908 59.8910 72.6066 173.1695 13 K 4.4627 8.4287 123.1157 54.9484 35.6459 174.4246 14 Y 4.5009 8.8173 129.4379 57.7296 39.6843 174.3813 15 N 5.0339 8.3167 123.6224 51.3231 41.3967 175.6411 16 D 4.4716 8.8369 119.6883 56.7578 41.4908 176.2401 17 D 4.8138 7.9702 117.2935 53.1755 39.7730 176.0278 18 D 4.0002 7.8572 115.9607 56.0624 39.2571 173.9024 19 T 4.5209 7.4961 110.1270 60.9447 71.3593 173.0885 20 F 5.2068 8.8903 123.2008 56.8462 42.4385 173.5907 21 T 5.3015 8.7224 123.3280 62.2332 71.1216 174.1378 22 V 4.7613 8.6848 123.1803 59.9656 35.5463 173.7430 23 K 4.7799 8.3382 124.5796 54.6018 34.3315 174.9075 24 V 4.4883 8.0165 126.6040 61.6966 34.7946 175.1487 25 G 3.6443 8.7706 116.0228 47.3342 0.0000 173.5494 26 D 4.8098 8.6822 124.5166 52.7864 40.0798 176.1108 27 K 4.8354 7.7714 118.8620 54.9968 35.7655 174.5410 28 E 4.9932 9.1162 125.5146 54.7517 31.4066 174.6918 29 L 5.5820 8.9368 126.0630 53.0749 46.7923 175.2367 30 F 5.6678 9.1463 114.9358 55.5691 42.0053 173.6424 31 T 4.4148 8.7474 113.5417 60.2223 70.4406 173.8171 32 N 4.7655 8.7605 124.3808 53.1597 37.7076 174.9106 33 R 4.2702 7.7185 119.9364 55.5437 30.6420 177.4595 34 W 4.3366 8.9493 124.0938 59.7962 28.9606 177.9579 35 N 4.2614 8.5132 116.0660 56.7458 37.8896 176.6644 36 L 4.2769 7.8087 118.1019 56.4019 41.8339 179.1634 37 Q 2.9977 7.9818 119.4639 58.7842 28.7100 178.8418 38 S 4.2268 7.7916 113.8094 60.5397 63.3656 176.2088 39 L 3.8916 7.1686 123.9573 57.7236 41.4118 179.1832 40 L 4.3424 8.3696 119.3117 57.7988 41.5312 179.3148 41 L 4.1797 8.2045 120.3827 58.3215 42.1019 179.2601 42 S 4.1361 8.1214 114.6011 61.3145 62.8449 176.4598 43 A 4.1317 8.3053 123.7756 54.9039 17.6825 179.5798 44 Q 3.9516 8.1235 118.2588 59.5134 29.0181 178.3866 45 I 3.7480 7.9264 119.9628 64.2668 37.2039 177.0280 46 T 4.2666 7.8960 107.4326 60.8995 68.9352 174.8946 47 G 3.9369 7.8588 109.1394 46.9093 0.0000 174.1268 48 M 4.2844 7.7574 118.5687 55.5191 33.5779 175.7664 49 T 4.4336 8.1756 118.6842 62.9225 70.0344 174.5299 50 V 4.8559 8.6508 119.9873 59.8152 35.2794 174.9166 51 T 4.8885 8.2852 118.8748 61.9294 71.6244 173.0762 52 I 4.4644 8.2666 127.4175 59.5869 39.4164 174.7814 53 K 4.9129 8.4295 126.5449 55.0910 33.4786 175.7177 54 T 4.5957 8.0034 118.2544 61.2162 70.2061 173.5314 55 N 4.4383 9.0479 124.3567 54.9950 39.4012 175.8780 56 A 4.3939 7.6731 124.5154 50.9207 18.0309 177.0518 57 C 4.7233 7.5945 126.6967 54.6921 38.0274 171.3630 58 H 5.1040 7.0821 116.8823 53.3051 32.1160 173.0824 59 N 4.6968 8.6225 117.6283 55.0049 38.6610 176.0429 60 G 4.0844 9.3705 111.4594 45.2239 0.0000 173.8896 61 G 3.9329 7.4248 107.1892 45.1616 0.0000 173.7736 62 G 3.7110 8.4330 108.8551 45.1456 0.0000 172.9035 63 F 5.2136 8.1360 115.7951 55.4900 40.7358 174.3867 64 S 4.4809 8.8768 112.0428 57.4124 64.5170 173.2205 65 E 4.7329 8.2814 121.8588 54.8004 31.3157 175.0027 66 V 4.6459 8.3802 123.6689 60.9769 35.2216 174.3163 67 I 4.4074 8.2993 127.4167 59.4889 39.8977 174.3533 68 F 5.0559 8.9348 125.9627 56.0156 40.4848 176.1212 69 R 4.3492 8.7266 122.5042 56.2232 30.4760 176.0370 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 T 8.16 4.33 4.23 0.00 0.00 0.00 0.00 0.00 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 2 P 0.00 4.30 0.00 2.17 2.16 0.00 3.69 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 3 D 8.90 4.30 0.00 2.53 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 4 C 8.95 4.84 0.00 2.88 3.12 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 5 V 7.36 4.71 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 0.78 0.00 0.00 0.77 0.00 0.00 6 T 8.83 5.01 4.19 0.00 0.00 0.00 0.00 0.00 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 7 G 7.97 3.93 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 0.00 0.00 0.00 8 K 8.27 4.82 0.00 1.65 1.76 0.00 1.80 0.00 0.00 2.30 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.27 7.81 9 V 8.21 3.93 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 0.80 0.00 0.00 0.96 0.00 0.00 10 E 8.76 4.28 0.00 1.94 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.30 0.00 11 Y 7.08 4.99 0.00 3.04 3.01 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 12 T 8.63 5.05 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 1.40 0.00 0.00 13 K 8.43 4.46 0.00 1.78 1.63 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.39 7.81 14 Y 8.82 4.50 0.00 3.23 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 15 N 8.32 5.03 0.00 2.75 2.63 0.00 0.00 6.28 7.67 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 16 D 8.84 4.47 0.00 2.64 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 17 D 7.97 4.81 0.00 2.85 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 D 7.86 4.00 0.00 3.13 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 7.50 4.52 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 20 F 8.89 5.21 0.00 2.98 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 21 T 8.72 5.30 4.33 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 1.34 0.00 0.00 22 V 8.68 4.76 2.28 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 0.67 0.00 0.00 0.96 0.00 0.00 23 K 8.34 4.78 0.00 0.88 0.74 0.00 1.44 0.00 0.00 1.45 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.14 1.15 7.81 24 V 8.02 4.49 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 0.82 0.00 0.00 0.78 0.00 0.00 25 G 8.77 3.64 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 0.00 0.00 0.00 26 D 8.68 4.81 0.00 2.76 2.74 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 27 K 7.77 4.84 0.00 1.57 1.66 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.30 1.44 7.81 28 E 9.12 4.99 0.00 2.10 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 29 L 8.94 5.58 0.00 1.71 1.84 0.73 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 30 F 9.15 5.67 0.00 3.17 3.14 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 31 T 8.75 4.41 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 1.09 0.00 0.00 32 N 8.76 4.77 0.00 2.95 3.05 0.00 0.00 6.17 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 33 R 7.72 4.27 0.00 1.87 1.92 0.00 3.24 0.00 0.00 3.11 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.69 0.00 34 W 8.95 4.34 0.00 3.35 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 35 N 8.51 4.26 0.00 2.77 2.95 0.00 0.00 7.16 6.74 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 36 L 7.81 4.28 0.00 1.93 1.85 1.00 1.36 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 37 Q 7.98 3.00 0.00 1.97 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 1.54 2.13 0.00 38 S 7.79 4.23 0.00 4.00 4.05 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 0.00 0.00 0.00 39 L 7.17 3.89 0.00 1.84 1.34 0.93 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.37 4.34 0.00 2.03 2.08 1.42 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.20 4.18 0.00 2.02 1.72 1.15 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.12 4.14 0.00 4.10 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 43 A 8.31 4.13 1.63 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 0.00 0.00 44 Q 8.12 3.95 0.00 2.26 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.66 0.00 45 I 7.93 3.75 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.80 0.93 0.00 0.00 46 T 7.90 4.27 4.26 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 1.23 0.00 0.00 47 G 7.86 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 48 M 7.76 4.28 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.59 0.00 49 T 8.18 4.43 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 1.19 0.00 0.00 50 V 8.65 4.86 1.74 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 0.68 0.00 0.00 0.83 0.00 0.00 51 T 8.29 4.89 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 1.18 0.00 0.00 52 I 8.27 4.46 1.52 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.50 0.28 0.00 0.00 53 K 8.43 4.91 0.00 1.58 1.70 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.56 1.29 7.81 54 T 8.00 4.60 4.28 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 1.23 0.00 0.00 55 N 9.05 4.44 0.00 2.73 2.86 0.00 0.00 6.87 7.35 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 56 A 7.67 4.39 1.27 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 0.00 0.00 0.00 57 C 7.59 4.72 0.00 3.07 3.02 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 0.00 58 H 7.08 5.10 0.00 3.34 3.35 0.00 5.71 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.62 4.70 0.00 2.79 2.86 0.00 0.00 7.05 7.65 0.00 0.00 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 G 9.37 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 61 G 7.42 3.93 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 0.00 0.00 0.00 62 G 8.43 3.71 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 0.00 0.00 0.00 63 F 8.14 5.21 0.00 2.88 2.86 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 64 S 8.88 4.48 0.00 3.90 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 65 E 8.28 4.73 0.00 2.14 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 2.32 2.29 0.00 66 V 8.38 4.65 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 0.00 0.00 1.04 0.00 0.00 67 I 8.30 4.41 1.76 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 1.19 0.77 0.90 0.00 0.00 68 F 8.93 5.06 0.00 2.91 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 69 R 8.73 4.35 0.00 1.82 1.79 0.00 3.13 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00