NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 P 4.3957 0.0000 0.0000 61.7921 33.9205 176.3605 6 V 3.6324 7.6330 120.0801 61.5272 32.2779 173.5359 7 M 4.9197 9.4084 125.0678 53.6721 35.4259 176.8250 8 C 4.8182 8.9054 119.3479 55.0654 43.9998 172.6244 9 L 5.1638 8.9773 119.8433 53.0828 44.6811 177.0932 10 L 4.3529 8.7350 123.3413 54.0358 42.9232 175.5516 11 A 3.9615 8.3106 128.0340 52.4301 18.0552 176.3397 12 N 5.0267 8.0113 111.1661 51.2920 39.7041 174.5396 13 T 4.6340 8.4836 111.1962 60.1425 70.8004 173.0692 14 T 5.1156 8.3931 115.4402 60.3859 70.6608 173.7735 15 F 5.1844 8.4969 118.7134 54.4287 42.1606 171.7625 16 P 4.6147 0.0000 0.0000 63.0522 31.8964 177.5423 17 C 4.0680 8.5649 120.9147 60.3166 40.3788 176.7155 18 S 3.9619 8.1265 111.9696 60.2927 62.9041 174.1082 19 Q 4.5478 7.7224 120.6355 53.1844 28.1134 173.2720 20 P 4.2621 0.0000 0.0000 60.9499 32.7431 176.5403 21 P 3.9782 0.0000 0.0000 65.2206 31.6198 176.6906 22 C 4.3220 7.8488 113.2995 57.8750 42.1124 174.2154 23 T 3.9164 7.0855 114.5581 61.6552 67.2598 171.6746 24 P 4.5038 0.0000 0.0000 63.0109 32.8200 176.2821 25 C 4.2814 8.1825 113.6641 58.2497 32.0550 173.5016 26 C 4.2737 8.4142 120.1391 60.1422 40.0852 174.9617 27 Y 3.9397 7.9477 119.3311 60.4946 38.5192 177.1699 28 E 4.1029 8.1412 118.4749 59.3210 29.7552 179.0148 29 K 4.3478 7.5980 117.4028 57.9703 32.9892 177.8896 30 E 4.4519 7.9685 124.9264 53.1026 30.6063 174.7885 31 P 3.8250 0.0000 0.0000 65.0474 31.4887 178.1597 32 E 3.7990 7.9286 119.0551 59.2156 29.8628 178.4265 33 E 4.1120 8.0569 116.7103 59.1019 29.7501 179.0422 34 T 3.9084 7.4897 116.6009 66.7295 68.5407 176.6699 35 L 4.1299 7.5885 120.6136 57.8184 41.4315 179.8055 36 R 4.1060 7.9481 117.6887 59.3696 29.7597 178.7834 37 M 4.1215 8.0158 117.0382 58.7694 32.5672 178.0109 38 L 4.3100 8.0967 119.1477 57.9276 41.5599 179.3890 39 E 4.0413 8.3392 117.8706 59.2039 29.4683 178.4575 40 D 4.6400 7.8169 117.0145 55.3895 40.8999 176.7384 41 N 4.9790 7.5974 116.0146 52.9585 39.2166 176.9691 42 V 3.0134 7.7316 114.0852 64.4824 31.6971 177.6293 43 M 4.1621 7.8090 118.0304 57.6508 32.5848 177.2267 44 R 4.1320 7.4731 117.1259 55.4074 30.7557 176.1360 45 P 4.4206 0.0000 0.0000 65.2869 31.6630 177.3068 46 G 4.0688 7.9807 106.3305 45.8497 0.0000 174.8810 47 Y 3.9563 7.7911 121.9123 60.8062 38.7460 177.8501 48 Y 3.9668 7.9484 116.4144 60.5428 37.8419 178.1782 49 Q 4.0646 8.0076 119.2123 58.5773 28.9666 177.9173 50 L 4.2779 7.4693 122.9155 57.3062 41.6780 178.6930 51 L 3.7384 7.7559 120.7536 57.8838 41.6932 178.8404 52 Q 3.9212 7.6877 118.0597 59.1825 29.1552 177.6891 53 A 4.1429 7.5426 120.4294 55.2828 18.2864 179.5343 54 S 4.2991 8.3511 113.7470 60.8124 62.5992 175.6020 55 L 5.1758 7.3196 119.2887 53.7882 42.8408 175.9554 56 T 4.5648 7.4536 116.1087 61.9735 69.9065 173.6567 57 C 4.9785 8.1240 124.5285 56.6815 46.3699 173.6855 58 S 4.2274 7.8618 120.8558 58.8369 63.5542 174.0909 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 P 0.00 4.40 0.00 2.05 2.17 0.00 3.65 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 1.92 2.08 0.00 6 V 7.63 3.63 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 0.76 0.00 0.00 0.94 0.00 0.00 7 M 9.41 4.92 0.00 1.77 1.90 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.63 0.00 8 C 8.91 4.82 0.00 1.97 2.26 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 0.00 9 L 8.98 5.16 0.00 1.49 1.55 0.86 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.74 4.35 0.00 2.04 1.66 0.78 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.31 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.01 5.03 0.00 2.79 2.87 0.00 0.00 5.84 7.71 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 13 T 8.48 4.63 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 1.24 0.00 0.00 14 T 8.39 5.12 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 1.20 0.00 0.00 15 F 8.50 5.18 0.00 3.05 3.10 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 16 P 0.00 4.61 0.00 2.18 2.25 0.00 3.92 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.05 0.00 17 C 8.56 4.07 0.00 3.04 3.29 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 18 S 8.13 3.96 0.00 4.00 4.02 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 19 Q 7.72 4.55 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 20 P 0.00 4.26 0.00 2.06 2.20 0.00 3.70 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 21 P 0.00 3.98 0.00 2.03 2.01 0.00 2.81 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.48 0.00 22 C 7.85 4.32 0.00 3.05 3.17 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 23 T 7.09 3.92 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 24 P 0.00 4.50 0.00 2.22 2.02 0.00 3.95 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 25 C 8.18 4.28 0.00 3.20 3.33 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 26 C 8.41 4.27 0.00 3.18 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 27 Y 7.95 3.94 0.00 2.93 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 28 E 8.14 4.10 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 29 K 7.60 4.35 0.00 1.64 1.83 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.54 7.81 30 E 7.97 4.45 0.00 1.92 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 2.16 2.31 0.00 31 P 0.00 3.82 0.00 1.80 1.29 0.00 3.54 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.73 0.00 32 E 7.93 3.80 0.00 2.02 1.94 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 2.37 2.36 0.00 33 E 8.06 4.11 0.00 2.23 2.19 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 2.33 2.38 0.00 34 T 7.49 3.91 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 1.31 0.00 0.00 35 L 7.59 4.13 0.00 1.69 1.79 1.07 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 36 R 7.95 4.11 0.00 2.02 2.00 0.00 3.31 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.80 0.00 37 M 8.02 4.12 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.75 0.00 38 L 8.10 4.31 0.00 2.03 1.96 0.98 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.34 4.04 0.00 2.19 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 0.00 2.35 2.44 0.00 40 D 7.82 4.64 0.00 2.82 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 41 N 7.60 4.98 0.00 2.87 2.88 0.00 0.00 6.85 8.81 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 42 V 7.73 3.01 1.71 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 0.21 0.00 0.00 0.84 0.00 0.00 43 M 7.81 4.16 0.00 1.97 2.09 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 2.57 2.44 0.00 44 R 7.47 4.13 0.00 2.11 1.84 0.00 3.08 0.00 0.00 3.32 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 45 P 0.00 4.42 0.00 2.06 2.14 0.00 3.66 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 2.03 2.09 0.00 46 G 7.98 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 47 Y 7.79 3.96 0.00 3.26 2.79 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 0.00 0.00 0.00 48 Y 7.95 3.97 0.00 3.10 2.97 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 49 Q 8.01 4.06 0.00 2.31 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.93 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 50 L 7.47 4.28 0.00 1.67 1.67 1.18 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.76 3.74 0.00 1.04 1.38 0.85 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 7.69 3.92 0.00 2.27 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 53 A 7.54 4.14 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.35 4.30 0.00 3.88 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 55 L 7.32 5.18 0.00 1.68 1.61 0.85 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 56 T 7.45 4.56 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 57 C 8.12 4.98 0.00 3.01 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 58 S 7.86 4.23 0.00 3.84 3.67 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