NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9414 8.3549 109.7365 45.1120 0.0000 173.1492 2 S 4.1889 8.3177 115.0086 56.7789 63.3251 172.9635 3 S 4.5163 8.3274 116.5391 57.5787 66.4071 172.3791 4 G 3.8972 8.5043 112.4374 44.8958 0.0000 172.8674 5 S 4.0145 8.7433 110.6000 58.9153 63.9666 175.8884 6 S 4.4248 8.6026 122.5426 58.3257 62.9212 170.8960 7 G 3.8475 7.9877 116.9277 45.3272 0.0000 174.4046 8 C 4.4410 8.4530 127.7391 58.8261 31.1053 172.6401 9 C 4.5739 7.4733 116.9919 58.3235 29.6979 174.3678 10 L 4.1774 8.1303 121.5249 53.9781 41.8924 175.5767 11 P 4.5260 0.0000 0.0000 61.8474 31.9700 175.2730 12 P 4.5044 0.0000 0.0000 63.7706 31.3317 177.3084 13 A 4.0848 7.2458 123.5591 55.7462 18.4698 178.6839 14 T 4.4329 7.2816 108.8450 62.7276 72.5318 172.7729 15 H 4.4291 8.8343 126.7535 55.5853 30.5033 175.2482 16 R 4.0472 8.4706 125.9649 55.3949 30.5924 174.5776 17 P 4.2600 0.0000 0.0000 62.8994 32.0114 175.5880 18 H 4.8644 8.1192 117.2780 53.1313 30.3838 173.1396 19 P 4.4718 0.0000 0.0000 63.0910 31.9886 176.1523 20 T 4.1084 8.2429 113.6986 64.2336 67.9666 175.1423 21 S 4.4209 7.4074 110.7911 57.6705 65.1061 175.0203 22 I 4.4574 8.3702 128.9351 60.3104 38.0082 175.1830 23 C 4.7769 8.4742 123.7532 59.1960 32.1696 172.4967 24 D 4.7357 8.4189 119.2978 55.1951 41.9523 176.5986 25 N 4.4903 7.5936 116.6187 55.2649 39.1038 176.8004 26 F 3.8131 7.9521 120.0844 61.1401 39.5465 176.8533 27 S 4.1522 8.2031 113.8732 61.0753 62.2639 174.5388 28 A 4.3769 7.7759 121.5877 54.3219 20.0044 177.6002 29 Y 4.1875 8.0885 112.1259 62.2556 37.9931 177.7501 30 G 3.6945 7.5917 106.1939 44.6914 0.0000 173.7766 31 W 4.7077 7.6862 114.9119 54.6658 30.9070 174.6394 32 C 3.8595 8.3521 118.3358 56.9509 33.9058 172.8039 33 P 4.7483 0.0000 0.0000 64.2221 31.4626 176.5320 34 L 4.4880 7.7530 118.4417 53.6215 43.9264 177.5439 35 G 3.9712 7.9024 108.5021 45.7112 0.0000 174.0629 36 P 4.2174 0.0000 0.0000 65.5218 31.7344 178.1846 37 Q 4.0249 7.5862 116.5837 58.1724 27.7692 176.2966 38 C 3.7127 7.6652 118.1822 59.0658 31.8270 173.0695 39 P 4.3829 0.0000 0.0000 64.9511 31.4817 176.4994 40 Q 4.4630 7.1892 115.9082 54.3841 30.1584 175.2809 41 S 4.2522 8.5403 115.6634 58.5738 63.0485 173.0130 42 H 5.0693 8.1643 122.1747 53.5246 28.6543 170.6492 43 D 4.7058 8.3181 120.8319 52.2897 42.2770 176.1312 44 I 4.2803 8.2929 128.4627 60.3704 36.5439 176.0263 45 S 4.2386 8.3939 121.5329 61.3507 63.6493 175.4677 46 G 4.2480 8.0564 109.2916 45.7752 0.0000 170.7853 47 P 4.5480 0.0000 0.0000 62.7119 32.8412 176.3987 48 S 4.7859 8.2291 112.1638 56.3429 65.5972 173.0575 49 S 4.6048 8.8214 115.8857 56.4990 64.1087 174.2151 50 G 3.7589 9.0094 115.1390 45.5988 0.0000 173.4550 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 8.32 4.19 0.00 3.96 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 S 8.33 4.52 0.00 3.93 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 4 G 8.50 3.90 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 0.00 0.00 0.00 5 S 8.74 4.01 0.00 3.98 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 6 S 8.60 4.42 0.00 3.88 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 7 G 7.99 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 0.00 0.00 0.00 8 C 8.45 4.44 0.00 2.94 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 9 C 7.47 4.57 0.00 3.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.13 4.18 0.00 1.64 1.61 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.53 0.00 2.22 2.19 0.00 3.70 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 12 P 0.00 4.50 0.00 2.20 2.21 0.00 3.81 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 13 A 7.25 4.08 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 14 T 7.28 4.43 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 15 H 8.83 4.43 0.00 3.09 3.23 0.00 5.76 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 16 R 8.47 4.05 0.00 1.81 1.82 0.00 3.26 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 17 P 0.00 4.26 0.00 2.10 1.98 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.91 0.00 18 H 8.12 4.86 0.00 3.27 3.37 0.00 5.53 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 19 P 0.00 4.47 0.00 2.21 2.10 0.00 3.82 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 20 T 8.24 4.11 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 1.20 0.00 0.00 21 S 7.41 4.42 0.00 3.82 3.63 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 22 I 8.37 4.46 1.90 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 1.33 0.57 1.02 0.00 0.00 23 C 8.47 4.78 0.00 3.16 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.42 4.74 0.00 2.67 2.64 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 25 N 7.59 4.49 0.00 2.47 2.39 0.00 0.00 6.50 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 7.95 3.81 0.00 2.62 2.80 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 27 S 8.20 4.15 0.00 4.11 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 28 A 7.78 4.38 1.10 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 0.00 0.00 0.00 0.00 0.00 29 Y 8.09 4.19 0.00 3.07 3.24 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 30 G 7.59 3.69 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 0.00 0.00 0.00 0.00 31 W 7.69 4.71 0.00 3.51 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 32 C 8.35 3.86 0.00 2.90 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 P 0.00 4.75 0.00 2.21 2.19 0.00 3.25 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.68 0.00 34 L 7.75 4.49 0.00 1.68 1.78 0.89 1.05 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 35 G 7.90 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 36 P 0.00 4.22 0.00 2.17 2.18 0.00 3.81 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 1.99 2.00 0.00 37 Q 7.59 4.02 0.00 2.32 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.70 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 38 C 7.67 3.71 0.00 2.95 2.76 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 0.00 39 P 0.00 4.38 0.00 2.18 2.14 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 40 Q 7.19 4.46 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.99 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 41 S 8.54 4.25 0.00 3.80 3.69 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 0.00 42 H 8.16 5.07 0.00 2.54 2.04 0.00 5.75 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.32 4.71 0.00 2.61 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.29 4.28 1.97 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.21 0.96 0.00 0.00 45 S 8.39 4.24 0.00 3.88 3.92 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 0.00 0.00 0.00 46 G 8.06 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 0.00 0.00 0.00 0.00 47 P 0.00 4.55 0.00 2.17 2.08 0.00 3.70 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 48 S 8.23 4.79 0.00 3.94 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.82 4.60 0.00 3.80 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 G 9.01 3.76 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 0.00 0.00 0.00 0.00