NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.3129 8.0176 110.9387 61.4597 69.7504 173.9041 4 S 4.2474 8.3178 112.6176 58.4656 62.7297 174.4885 5 A 4.0716 7.5588 125.2464 54.6804 19.3048 180.2170 6 S 4.7611 7.9779 109.3781 57.9737 63.8512 175.9959 7 G 3.7963 7.9008 109.5540 48.2914 0.0000 174.0224 8 P 4.2939 0.0000 0.0000 65.5183 31.2848 178.2183 9 E 4.1256 8.1691 117.1709 59.0853 29.6572 177.8241 10 H 4.1037 8.4518 118.5335 59.3964 29.9461 177.0650 11 E 4.0179 8.7698 120.6972 59.3711 29.3106 179.1537 12 F 4.0870 8.2301 120.4352 61.1898 39.4123 177.3513 13 V 3.4328 8.2154 118.1936 65.9970 31.4802 177.8132 14 S 4.0110 8.0493 112.8585 61.3954 62.1668 176.3831 15 K 3.9147 8.0500 121.0445 59.3341 31.8036 179.1149 16 F 3.7386 7.8741 120.9144 61.0862 38.9971 176.8826 17 L 4.0053 7.9658 118.9533 58.3779 42.0309 178.8227 18 T 3.9492 7.7231 115.3618 66.6268 68.3595 176.3993 19 L 3.8255 7.8933 122.0001 58.0355 41.8729 178.6312 20 A 3.9251 7.7275 119.2728 53.7163 18.3388 177.9025 21 T 4.5362 7.1251 105.1591 60.9966 69.7370 174.9278 22 L 4.0641 7.6306 123.6340 57.5590 41.7475 177.5165 23 T 4.5890 7.3205 105.8779 58.9377 71.2748 173.3158 24 E 3.9491 8.5511 123.7659 55.5087 29.9773 174.9950 25 P 4.2749 0.0000 0.0000 62.5953 32.1304 175.9252 26 K 3.8293 8.8016 123.4539 59.1552 32.0212 176.6485 27 L 4.3037 7.4971 117.8095 52.0813 42.7740 174.7754 28 P 4.5621 0.0000 0.0000 61.9282 32.2610 177.2030 29 K 3.8455 8.7368 118.8669 59.7495 31.9103 178.2205 30 S 4.4473 7.9645 109.9810 58.4919 63.5127 173.5389 31 Y 4.1739 8.0070 124.2315 58.0335 38.9051 175.2769 32 T 4.0970 7.3927 116.2092 59.1170 71.0616 173.4855 33 K 3.7268 8.0568 128.2406 55.1694 32.9327 174.5835 34 P 4.2092 0.0000 0.0000 62.6529 31.7738 177.1634 35 L 4.2643 8.5685 124.5095 57.6483 42.2823 178.9616 36 K 3.9604 8.1080 116.9726 58.8990 32.0046 177.0442 37 D 4.7027 8.1849 116.4357 53.7895 41.4455 176.5495 38 V 3.7542 7.3278 121.0221 62.9792 31.7103 175.2458 39 T 4.3800 8.4707 121.5209 62.8358 68.7484 173.0939 40 N 4.9375 7.7201 115.8460 52.2087 39.9740 173.5868 41 L 4.6252 8.3727 115.5622 54.2050 42.9401 178.9041 42 G 3.7690 7.9333 106.7412 46.7717 0.0000 174.1979 43 V 4.3510 8.0936 123.1878 59.9309 33.4135 173.9133 44 P 4.3399 0.0000 0.0000 62.7932 31.7747 176.2377 45 L 4.4389 8.1702 122.1966 52.8889 42.8387 175.0013 46 P 4.4626 0.0000 0.0000 62.7767 31.9221 176.3314 47 T 4.0827 8.1069 116.3805 63.3771 67.6824 174.7596 48 L 4.2872 8.2656 125.2844 54.2227 42.5494 178.4980 49 K 4.0397 8.0042 121.3003 59.0154 32.2864 177.3007 50 Y 4.4718 6.3879 115.6092 56.9713 38.5867 175.7021 51 K 4.3098 8.5964 123.6230 56.3587 33.0535 175.5210 52 Y 4.7146 8.4374 122.1734 55.9250 40.6350 175.1796 53 K 4.3289 7.4483 125.1170 55.4833 35.6196 175.7374 54 Q 4.1072 8.1669 118.0061 55.0823 30.1116 174.5713 55 N 4.7418 8.2294 120.4655 52.1518 40.2808 176.0243 56 R 4.1978 8.1501 117.0234 56.6277 30.9672 175.8371 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 3 T 8.02 4.31 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 4 S 8.32 4.25 0.00 4.11 4.12 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 A 7.56 4.07 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.98 4.76 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 7 G 7.90 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 8 P 0.00 4.29 0.00 2.19 2.16 0.00 3.53 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 9 E 8.17 4.13 0.00 2.06 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 2.46 2.36 0.00 10 H 8.45 4.10 0.00 3.34 3.47 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.77 4.02 0.00 2.29 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 2.40 2.53 0.00 12 F 8.23 4.09 0.00 3.25 3.25 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 13 V 8.22 3.43 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 0.99 0.00 0.00 1.08 0.00 0.00 14 S 8.05 4.01 0.00 3.92 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 15 K 8.05 3.91 0.00 1.83 1.77 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.52 7.81 16 F 7.87 3.74 0.00 2.41 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 17 L 7.97 4.01 0.00 1.78 1.83 0.96 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.72 3.95 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 19 L 7.89 3.83 0.00 1.61 1.55 0.82 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 20 A 7.73 3.93 1.07 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 0.00 0.00 21 T 7.13 4.54 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 1.22 0.00 0.00 22 L 7.63 4.06 0.00 1.73 1.74 0.88 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 23 T 7.32 4.59 4.21 0.00 0.00 0.00 0.00 0.00 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 24 E 8.55 3.95 0.00 1.93 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 2.28 2.32 0.00 25 P 0.00 4.27 0.00 2.20 1.97 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 26 K 8.80 3.83 0.00 1.65 1.79 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.42 7.81 27 L 7.50 4.30 0.00 1.57 1.33 0.80 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.56 0.00 2.26 2.20 0.00 3.69 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.04 0.00 29 K 8.74 3.85 0.00 1.79 1.96 0.00 1.75 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.48 7.81 30 S 7.96 4.45 0.00 4.00 3.99 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 0.00 0.00 0.00 31 Y 8.01 4.17 0.00 2.95 3.05 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 32 T 7.39 4.10 4.07 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 1.16 0.00 0.00 33 K 8.06 3.73 0.00 1.72 1.71 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.55 7.81 34 P 0.00 4.21 0.00 2.32 1.94 0.00 3.63 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.03 0.00 35 L 8.57 4.26 0.00 1.68 1.65 0.90 0.47 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 36 K 8.11 3.96 0.00 1.77 1.86 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.46 7.81 37 D 8.18 4.70 0.00 2.70 2.70 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 0.00 0.00 0.00 38 V 7.33 3.75 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.92 0.00 0.00 39 T 8.47 4.38 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 1.22 0.00 0.00 40 N 7.72 4.94 0.00 2.82 2.74 0.00 0.00 5.89 7.79 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 41 L 8.37 4.63 0.00 1.63 1.68 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 42 G 7.93 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 43 V 8.09 4.35 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 0.87 0.00 0.00 0.93 0.00 0.00 44 P 0.00 4.34 0.00 2.08 1.97 0.00 3.72 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 2.02 2.11 0.00 45 L 8.17 4.44 0.00 1.63 1.59 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.46 0.00 2.17 2.05 0.00 3.77 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 1.99 0.00 47 T 8.11 4.08 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 1.19 0.00 0.00 48 L 8.27 4.29 0.00 1.80 1.75 1.05 1.07 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 49 K 8.00 4.04 0.00 0.83 1.52 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.11 1.18 7.81 50 Y 6.39 4.47 0.00 3.07 2.92 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 51 K 8.60 4.31 0.00 1.80 1.79 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.47 7.81 52 Y 8.44 4.71 0.00 2.91 2.87 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 0.00 0.00 0.00 53 K 7.45 4.33 0.00 1.58 1.56 0.00 1.70 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.41 7.81 54 Q 8.17 4.11 0.00 1.91 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.96 0.00 0.00 0.00 0.00 0.00 2.22 2.19 0.00 55 N 8.23 4.74 0.00 2.65 2.72 0.00 0.00 6.95 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 56 R 8.15 4.20 0.00 1.73 1.75 0.00 3.23 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00