NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3733 8.1744 110.9436 61.1589 70.6483 173.4366 6 N 4.8392 7.8480 120.6975 53.0046 39.4366 172.8625 7 S 4.5235 8.8245 113.5256 57.5368 65.0796 173.2886 8 D 4.8348 8.5302 121.5385 54.9960 41.8617 175.3682 9 F 5.3755 7.8801 113.8671 55.6802 41.4694 173.8531 10 V 4.6030 8.9434 112.0911 59.5175 35.6206 174.8742 11 V 4.7962 8.6407 123.4064 61.2808 34.0169 174.3892 12 I 4.9330 9.0661 128.4993 59.3554 40.7561 174.0944 13 K 5.0574 9.0531 128.5892 54.2994 34.5602 174.9597 14 A 4.4621 8.7893 130.1225 52.1873 19.1447 177.5104 15 L 4.6815 9.0974 122.3068 54.6545 42.5759 176.0567 16 E 4.6827 7.6795 115.4232 54.8596 32.2681 174.4898 17 D 4.4625 8.3620 119.4819 55.6618 41.3701 176.9142 18 G 3.8738 8.4471 109.3770 45.7934 0.0000 174.0118 19 V 3.8925 7.5801 119.4597 63.0132 32.9620 174.3756 20 N 5.3544 9.2471 124.6055 51.4593 41.5523 173.5464 21 V 4.5123 8.6965 124.6461 61.4675 33.3722 174.1242 22 I 4.5005 8.8739 130.1037 59.3927 39.5988 175.1631 23 G 4.0695 8.7351 114.8653 44.9888 0.0000 172.5377 24 L 5.3774 8.7607 126.9077 53.3482 43.7839 176.4725 25 T 4.4195 8.8609 114.9047 61.7125 69.1108 174.3422 26 R 4.3679 7.9125 126.7923 57.0968 30.0757 174.9201 27 G 3.7641 8.7379 108.5071 44.2321 0.0000 173.9845 28 A 4.1367 8.6397 121.0683 53.9980 18.7693 177.4338 29 D 4.8297 7.2559 112.0723 52.9236 42.7536 176.0766 30 T 4.6954 8.3347 122.0975 61.7931 70.2065 172.8075 31 R 4.7166 8.9185 122.7670 54.0978 33.9346 173.9460 32 F 5.4263 8.6760 117.8704 57.5402 39.1662 175.7279 33 H 4.9691 8.9566 118.3340 56.6185 30.5827 174.1106 34 H 4.8135 7.5888 116.8201 54.9516 33.3382 172.1932 35 S 4.7944 8.0589 118.3729 56.4130 64.8620 172.4472 36 E 4.4070 9.0086 129.6034 55.0470 30.8872 174.7862 37 K 4.8343 8.6129 126.8810 55.3697 33.5243 175.9341 38 L 4.9530 8.9817 125.5455 53.0446 44.6164 176.1189 39 D 4.9367 9.1554 123.0336 52.8110 42.9482 175.9718 40 K 3.9548 9.0614 122.3578 58.4871 32.3691 176.3159 41 G 4.1147 8.9173 115.0924 45.4837 0.0000 173.8504 42 E 4.2220 8.2776 119.1281 56.3361 30.7222 176.2576 43 V 4.9474 8.3009 121.9895 61.0013 34.4755 174.2747 44 L 4.7360 9.1198 129.4140 53.2731 44.9226 174.8104 45 I 5.0351 8.5043 126.6623 59.6187 39.0586 174.8012 46 A 4.6973 8.9597 129.0789 50.1237 22.0701 175.3781 47 Q 4.8037 8.6135 120.7443 55.0309 30.4116 175.7266 48 F 4.6497 8.5723 120.3428 57.9697 38.6007 175.4129 49 T 4.6620 8.9218 111.0293 60.4068 71.7625 173.7626 50 E 4.1297 8.9655 121.0330 59.5774 29.7508 177.6391 51 H 4.5267 7.8213 112.9362 56.4889 29.7117 174.3464 52 T 5.4872 8.3907 116.4553 61.0169 70.9399 174.5253 53 S 4.9779 9.0107 120.1732 58.1521 65.0537 173.3586 54 A 5.1720 7.9108 121.5080 51.0599 22.6503 175.0628 55 I 4.8934 8.5485 120.7710 59.3867 40.4545 174.7137 56 K 4.5643 8.8605 128.5247 54.5175 34.6554 174.7915 57 V 4.7487 8.3770 126.5145 61.2510 33.6144 174.4940 58 R 4.5293 8.7086 127.4871 55.2034 32.4872 175.7036 59 G 4.0279 9.0115 109.5488 43.6587 0.0000 172.7527 60 K 4.5125 9.4753 121.1974 56.1816 33.0069 175.6259 61 A 5.0617 8.8333 127.8223 50.9912 23.4506 173.6849 62 Y 5.0488 9.3375 121.3687 55.9542 41.1999 174.5636 63 I 4.8260 8.4858 127.4038 59.4877 40.6818 174.3195 64 Q 5.0011 8.8231 126.1933 54.3466 31.6330 174.9806 65 T 4.8657 8.7396 113.0891 59.7710 72.5077 174.5779 66 R 3.7414 8.5488 120.5786 59.4697 29.9171 176.5540 67 H 4.7367 8.4986 112.5330 55.2501 29.6237 174.7491 68 G 3.7767 6.7235 106.9105 44.2425 0.0000 173.0032 69 V 4.8615 7.9277 113.7860 59.8771 35.2703 175.0845 70 I 4.5443 8.2896 122.0067 60.0324 41.9976 172.8718 71 E 5.3173 8.5963 126.0077 54.4291 32.1527 176.2581 72 S 4.5375 8.8480 119.4019 58.2426 64.9525 172.8997 73 E 4.8964 8.5282 119.5210 54.4729 32.8927 176.2499 74 G 3.7296 8.7234 111.4596 45.8480 0.0000 173.4114 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 5 T 8.17 4.37 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 6 N 7.85 4.84 0.00 2.77 2.82 0.00 0.00 7.12 6.75 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 7 S 8.82 4.52 0.00 4.12 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 8 D 8.53 4.83 0.00 2.75 2.72 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 9 F 7.88 5.38 0.00 2.93 2.94 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 10 V 8.94 4.60 2.02 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 0.62 0.00 0.00 0.85 0.00 0.00 11 V 8.64 4.80 2.11 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 1.17 0.00 0.00 1.14 0.00 0.00 12 I 9.07 4.93 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.53 0.90 0.00 0.00 13 K 9.05 5.06 0.00 1.93 1.84 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.40 7.81 14 A 8.79 4.46 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 15 L 9.10 4.68 0.00 1.63 1.72 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.68 4.68 0.00 2.03 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.33 0.00 17 D 8.36 4.46 0.00 2.69 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 18 G 8.45 3.87 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 0.00 0.00 0.00 19 V 7.58 3.89 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 0.93 0.00 0.00 1.04 0.00 0.00 20 N 9.25 5.35 0.00 2.58 2.59 0.00 0.00 6.38 7.23 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 21 V 8.70 4.51 2.03 0.00 0.00 0.00 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 0.89 0.00 0.00 22 I 8.87 4.50 1.36 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.26 -0.51 0.00 0.00 23 G 8.74 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 0.00 0.00 0.00 0.00 24 L 8.76 5.38 0.00 1.89 1.72 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.86 4.42 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 1.39 0.00 0.00 26 R 7.91 4.37 0.00 1.91 1.98 0.00 3.24 0.00 0.00 3.08 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.45 0.00 27 G 8.74 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 28 A 8.64 4.14 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 29 D 7.26 4.83 0.00 2.62 2.57 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 30 T 8.33 4.70 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 1.28 0.00 0.00 31 R 8.92 4.72 0.00 1.82 1.99 0.00 2.79 0.00 0.00 3.47 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 32 F 8.68 5.43 0.00 2.92 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 33 H 8.96 4.97 0.00 3.13 3.50 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.59 4.81 0.00 3.33 3.09 0.00 5.80 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.06 4.79 0.00 3.72 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.01 4.41 0.00 2.18 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 2.26 2.32 0.00 37 K 8.61 4.83 0.00 1.64 1.72 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.61 7.81 38 L 8.98 4.95 0.00 1.52 1.53 0.92 0.91 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 39 D 9.16 4.94 0.00 2.59 2.67 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 40 K 9.06 3.95 0.00 1.64 1.75 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.43 7.81 41 G 8.92 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 0.00 0.00 0.00 42 E 8.28 4.22 0.00 2.06 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 43 V 8.30 4.95 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.97 0.00 0.00 44 L 9.12 4.74 0.00 1.71 1.45 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.50 5.04 1.75 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.76 0.71 0.00 0.00 46 A 8.96 4.70 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 47 Q 8.61 4.80 0.00 1.95 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.93 0.00 0.00 0.00 0.00 0.00 2.45 2.38 0.00 48 F 8.57 4.65 0.00 3.03 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 49 T 8.92 4.66 4.30 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 1.30 0.00 0.00 50 E 8.97 4.13 0.00 1.93 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 1.98 2.25 0.00 51 H 7.82 4.53 0.00 3.22 3.20 0.00 5.80 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.39 5.49 4.35 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 0.00 0.00 0.00 1.33 0.00 0.00 53 S 9.01 4.98 0.00 3.86 4.10 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 54 A 7.91 5.17 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 55 I 8.55 4.89 1.86 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.68 0.87 0.00 0.00 56 K 8.86 4.56 0.00 1.81 1.50 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.36 7.81 57 V 8.38 4.75 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 0.86 0.00 0.00 0.89 0.00 0.00 58 R 8.71 4.53 0.00 1.76 1.80 0.00 3.17 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 59 G 9.01 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.48 4.51 0.00 1.90 1.72 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.42 7.81 61 A 8.83 5.06 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 62 Y 9.34 5.05 0.00 2.99 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 63 I 8.49 4.83 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.57 0.87 0.00 0.00 64 Q 8.82 5.00 0.00 1.89 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.09 1.88 0.00 65 T 8.74 4.87 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 1.15 0.00 0.00 66 R 8.55 3.74 0.00 1.58 1.71 0.00 3.14 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 67 H 8.50 4.74 0.00 3.18 3.26 0.00 5.70 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 6.72 3.78 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 0.00 0.00 0.00 69 V 7.93 4.86 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 0.70 0.00 0.00 1.00 0.00 0.00 70 I 8.29 4.54 1.84 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 1.22 0.95 0.86 0.00 0.00 71 E 8.60 5.32 0.00 1.90 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 72 S 8.85 4.54 0.00 3.97 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 73 E 8.53 4.90 0.00 1.83 1.85 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 2.21 2.29 0.00 74 G 8.72 3.73 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 0.00 0.00 0.00