NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.2969 8.3645 123.5825 52.3069 19.4795 178.4167 1 N 4.5599 9.2010 114.7459 51.6825 38.4082 175.3863 2 Q 4.3964 8.3636 123.9757 56.1063 30.9670 174.7334 3 A 4.7455 8.6037 128.2991 51.2661 21.1677 175.8134 4 S 5.1603 8.9981 116.0133 56.2510 67.4670 173.4633 5 V 4.3254 8.3893 121.6291 62.8475 32.3323 174.9684 6 V 4.8382 8.7129 127.5254 60.6033 35.0306 174.3152 7 A 4.4964 8.8671 129.5772 52.3248 18.4937 177.7117 8 N 4.6230 9.2811 122.8088 55.8736 39.6606 174.4406 9 Q 4.6406 7.6931 114.3974 54.4393 32.0930 173.9776 10 L 4.2200 8.5075 121.9817 55.5152 43.0193 175.9906 11 I 4.4063 8.7166 127.5313 58.8657 38.8400 173.6625 12 P 4.6115 0.0000 0.0000 62.0871 32.0369 176.3298 13 I 3.6581 8.4557 122.0652 62.2656 38.5771 174.8804 14 N 4.3283 8.5584 123.1901 54.9845 36.9937 174.3384 15 T 4.8065 7.4946 111.5931 61.3030 72.7530 174.0377 16 A 4.5712 8.5764 126.8181 51.8986 19.5535 177.2051 17 L 4.2931 9.2350 122.9594 54.8677 43.0674 176.5594 18 T 4.8745 8.3185 112.8475 59.5303 72.1166 175.2377 19 L 4.0901 8.4926 121.5669 57.7281 41.9234 180.1809 20 V 3.6704 7.7857 110.7202 63.6727 31.8700 176.7869 21 A 4.2857 7.9137 121.1577 53.0328 18.9568 176.1926 22 M 5.2769 7.6412 115.0490 53.3867 34.8628 175.3420 23 R 4.7269 9.0031 120.6446 54.3237 33.3054 174.2587 24 S 5.2147 8.2310 112.5041 56.8315 65.2678 172.6328 25 E 4.6796 8.7196 124.6228 55.1391 33.6040 174.4744 26 V 4.3014 8.4307 126.1211 62.4976 31.6190 175.3810 27 V 4.6212 8.2950 120.4252 59.5233 35.4614 175.2800 28 T 4.6048 8.0784 110.4410 59.1204 71.0827 172.3817 29 P 4.4450 0.0000 0.0000 62.0156 32.1556 176.0747 30 V 3.8777 8.1800 120.0794 62.8736 32.6856 176.1062 31 G 4.4013 8.3117 115.0344 45.3788 0.0000 172.6919 32 I 3.9386 8.4519 123.5544 60.8104 38.3382 174.3642 33 P 4.7411 0.0000 0.0000 62.8049 31.9077 177.2708 34 A 3.9397 8.8203 126.0345 55.5450 17.9947 179.8879 35 E 4.0244 8.2207 115.6471 59.3386 29.8222 178.1179 36 D 4.7168 8.2792 117.5208 54.5061 40.5450 177.9440 37 I 3.6983 7.7379 122.7292 64.2493 36.9366 176.1381 38 P 4.3028 0.0000 0.0000 65.7050 31.2280 178.2516 39 R 4.0643 7.8884 115.8908 59.4725 30.3870 178.2035 40 L 4.1760 8.1658 118.5335 56.0524 41.6057 177.5502 41 V 3.8354 6.6618 117.4180 64.7708 31.6577 176.4507 42 S 4.2403 9.2445 122.2944 58.8717 62.1892 169.8781 43 M 4.4150 7.9765 120.5642 55.2050 33.1789 175.4603 44 Q 5.0041 8.5002 120.4007 54.7624 31.4846 175.5956 45 V 4.4343 8.3087 115.9443 61.0598 33.2717 176.2573 46 N 4.9021 8.9912 120.4380 52.6950 38.3862 174.1947 47 R 4.7495 7.5327 113.7266 55.0352 32.3127 174.4129 48 A 4.2973 8.6129 122.4937 52.2506 19.3740 177.2333 49 V 4.2085 8.9298 122.8425 60.3093 33.4802 173.4664 50 P 4.6805 0.0000 0.0000 61.8738 32.7317 175.9748 51 L 3.9720 8.4521 123.4597 57.1344 42.1870 177.6591 52 G 3.9414 9.0871 113.6993 45.8056 0.0000 173.3565 53 T 4.3429 7.6022 117.0079 62.9328 70.1237 174.2814 54 T 4.4711 8.3482 122.3618 63.1415 69.4681 174.3560 55 L 4.0632 8.9070 127.7494 55.2066 42.6270 176.5935 56 M 4.7286 8.4588 123.5106 52.8381 34.2674 175.2584 57 P 4.1159 0.0000 0.0000 65.8873 31.5859 178.2777 58 D 4.5856 8.0113 114.7913 55.2065 39.6724 176.6288 59 M 4.5592 8.0249 119.1533 55.2564 32.7054 175.6093 60 V 4.6302 7.3070 119.8866 60.4051 33.3109 174.7405 61 K 4.1116 8.7033 128.0995 57.7292 32.1599 177.6272 62 G 3.9468 9.0360 112.5451 45.1954 0.0000 172.4194 63 Y 4.2108 7.5436 121.5208 56.9257 39.2709 174.5146 64 A 4.3361 7.7251 128.6487 50.2236 22.3492 175.3642 65 A 4.0155 8.1919 123.3961 52.1053 19.3011 176.8172 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 0 A 8.36 4.30 1.13 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 0.00 0.00 0.00 1 N 9.20 4.56 0.00 2.84 2.69 0.00 0.00 6.50 6.57 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 2 Q 8.36 4.40 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 3 A 8.60 4.75 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 4 S 9.00 5.16 0.00 3.68 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 5 V 8.39 4.33 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 0.94 0.00 0.00 0.91 0.00 0.00 6 V 8.71 4.84 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 1.08 0.00 0.00 0.92 0.00 0.00 7 A 8.87 4.50 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 8 N 9.28 4.62 0.00 2.69 2.98 0.00 0.00 7.04 7.08 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 9 Q 7.69 4.64 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.68 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 10 L 8.51 4.22 0.00 1.67 1.61 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.72 4.41 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.52 0.90 0.00 0.00 12 P 0.00 4.61 0.00 1.93 1.98 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 13 I 8.46 3.66 1.87 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 1.34 0.81 0.91 0.00 0.00 14 N 8.56 4.33 0.00 2.90 2.86 0.00 0.00 6.75 7.16 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 15 T 7.49 4.81 4.39 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 1.21 0.00 0.00 16 A 8.58 4.57 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.24 4.29 0.00 1.79 1.60 0.94 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.32 4.87 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 1.21 0.00 0.00 19 L 8.49 4.09 0.00 1.73 1.76 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.79 3.67 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 0.68 0.00 0.00 0.99 0.00 0.00 21 A 7.91 4.29 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 0.00 0.00 0.00 0.00 0.00 22 M 7.64 5.28 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.42 0.00 23 R 9.00 4.73 0.00 1.82 2.04 0.00 2.70 0.00 0.00 3.09 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.52 0.00 24 S 8.23 5.21 0.00 3.85 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 25 E 8.72 4.68 0.00 2.06 1.70 0.00 0.00 0.00 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 26 V 8.43 4.30 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 0.83 0.00 0.00 0.93 0.00 0.00 27 V 8.30 4.62 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 0.82 0.00 0.00 0.92 0.00 0.00 28 T 8.08 4.60 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 1.21 0.00 0.00 29 P 0.00 4.44 0.00 2.06 2.03 0.00 3.67 0.00 0.00 3.58 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 30 V 8.18 3.88 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 0.78 0.00 0.00 0.93 0.00 0.00 31 G 8.31 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 0.00 0.00 0.00 32 I 8.45 3.94 1.71 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 0.83 0.71 0.77 0.00 0.00 33 P 0.00 4.74 0.00 2.11 2.13 0.00 3.71 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.14 0.00 34 A 8.82 3.94 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 35 E 8.22 4.02 0.00 1.95 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 2.33 2.48 0.00 36 D 8.28 4.72 0.00 2.91 2.81 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 37 I 7.74 3.70 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.33 0.91 0.00 0.00 38 P 0.00 4.30 0.00 2.03 2.13 0.00 3.78 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 39 R 7.89 4.06 0.00 1.84 2.31 0.00 3.28 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.75 0.00 40 L 8.17 4.18 0.00 1.90 1.69 0.82 0.54 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 41 V 6.66 3.84 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 0.76 0.00 0.00 1.02 0.00 0.00 42 S 9.24 4.24 0.00 4.05 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 43 M 7.98 4.42 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.56 0.00 44 Q 8.50 5.00 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.04 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 45 V 8.31 4.43 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 0.75 0.00 0.00 1.03 0.00 0.00 46 N 8.99 4.90 0.00 2.82 3.03 0.00 0.00 6.72 8.36 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 47 R 7.53 4.75 0.00 1.79 1.89 0.00 3.20 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 48 A 8.61 4.30 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 49 V 8.93 4.21 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 0.99 0.00 0.00 0.91 0.00 0.00 50 P 0.00 4.68 0.00 2.10 1.95 0.00 3.66 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 51 L 8.45 3.97 0.00 1.57 1.59 0.90 1.05 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 52 G 9.09 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 53 T 7.60 4.34 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 54 T 8.35 4.47 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 55 L 8.91 4.06 0.00 1.51 1.48 0.84 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 56 M 8.46 4.73 0.00 2.11 1.96 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.63 0.00 57 P 0.00 4.12 0.00 2.27 2.42 0.00 3.60 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 2.20 2.18 0.00 58 D 8.01 4.59 0.00 2.80 2.82 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 0.00 0.00 0.00 59 M 8.02 4.56 0.00 2.09 2.19 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 2.55 2.41 0.00 60 V 7.31 4.63 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 1.07 0.00 0.00 0.78 0.00 0.00 61 K 8.70 4.11 0.00 1.89 1.76 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.40 7.81 62 G 9.04 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 63 Y 7.54 4.21 0.00 2.88 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 64 A 7.73 4.34 1.05 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 0.00 0.00 65 A 8.19 4.02 1.17 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 0.00 0.00