NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4826 0.0000 0.0000 62.3548 33.6358 174.9312 2 I 4.8524 8.2836 122.7873 59.1284 40.0756 173.0152 3 A 4.7861 9.5330 129.9602 49.9846 22.2262 174.4754 4 Q 4.9215 8.6655 122.4646 54.3867 31.5694 174.3762 5 I 4.4579 8.7911 128.0708 59.8821 39.8166 174.3425 6 H 5.2448 8.8085 124.5157 54.3595 29.7675 174.3918 7 I 4.6350 8.2375 116.5157 58.5672 41.2439 174.9433 8 L 4.6247 8.3331 123.1499 54.3487 42.2246 176.9605 9 E 4.4982 8.0972 120.7806 56.6399 29.9375 176.1181 10 G 3.6268 8.7765 108.6763 45.6164 0.0000 174.5831 11 R 4.4417 7.6477 119.3160 55.2715 31.5762 176.7542 12 S 4.5323 8.2481 116.0136 57.7880 65.5622 175.1901 13 D 4.3968 8.5168 121.6989 57.3592 40.4734 179.0219 14 E 3.9171 8.0706 118.7018 59.5793 29.5316 179.0361 15 Q 4.0171 7.7976 117.8719 59.1580 28.7973 179.3768 16 K 3.9776 7.9721 118.8083 59.1975 31.9100 179.1047 17 E 3.9953 8.1395 119.9038 59.3011 29.4669 179.0370 18 T 3.9186 7.9167 116.0756 66.1991 68.5619 176.4393 19 L 3.9197 8.1347 122.5748 58.4605 42.0884 179.1597 20 I 3.6930 7.7439 119.5471 64.2467 36.9849 178.5224 21 R 3.8863 7.7899 119.6167 59.3342 30.0482 178.2354 22 E 3.9504 8.4896 118.8204 59.6020 29.5242 179.6646 23 V 3.6268 7.9324 118.1403 66.0728 31.5641 178.2456 24 S 4.1614 7.9629 114.6041 61.4324 62.5531 176.6276 25 E 3.9007 8.3700 121.1420 59.2830 29.2255 178.9203 26 A 3.9757 7.9689 120.7895 55.3926 18.5116 179.7987 27 I 3.6244 7.8316 118.0090 64.5983 37.3369 178.6315 28 S 4.1682 7.9948 113.9623 61.2713 62.0549 176.1223 29 R 3.8437 8.6623 121.6712 59.6633 29.7117 178.5101 30 S 4.1105 8.0055 113.6106 61.3555 62.8942 175.5997 31 L 4.3656 7.7179 116.2815 53.7527 42.0107 175.6777 32 D 4.3404 7.4910 117.2135 55.2712 40.0240 172.8500 33 A 4.7725 7.5166 118.8157 48.8822 21.4510 175.8059 34 P 4.2768 0.0000 0.0000 62.6969 32.0109 176.9095 35 L 3.8927 8.9154 124.9143 58.4899 41.9234 178.7457 36 T 4.0782 7.8840 106.3079 63.3343 68.7247 174.6418 37 S 4.4475 8.0059 116.4652 58.8775 63.9076 174.4056 38 V 4.0797 7.5868 122.5698 62.7673 32.1368 175.3538 39 R 4.7037 8.9285 126.4098 54.3184 33.2416 174.6298 40 V 4.8613 8.4907 123.0563 61.0518 34.5307 174.4582 41 I 4.5462 8.9065 128.0656 59.6082 40.1567 174.2976 42 I 4.7477 8.3948 127.7783 60.0298 39.1436 175.3199 43 T 4.4966 8.6730 123.0188 61.7436 71.6996 173.1358 44 E 4.7664 8.7506 126.4243 56.0837 31.4668 175.5355 45 M 4.9262 8.7424 122.4918 53.1977 35.3129 175.6633 46 A 4.5057 8.5591 125.4102 51.7130 19.3358 178.6903 47 K 4.0797 8.5716 120.5882 59.1749 32.2535 178.3927 48 G 4.0558 8.0006 105.3299 45.6491 0.0000 173.4643 49 H 4.9670 8.6022 114.9277 54.9559 29.7019 173.5415 50 F 5.0830 8.1645 122.5714 56.2624 41.5482 173.6937 51 G 4.1661 8.3730 116.2589 43.5478 0.0000 172.2682 52 I 4.1174 8.0391 122.4054 60.0192 39.7843 176.0577 53 G 3.9269 9.5229 113.7429 46.5253 0.0000 173.9482 54 G 3.9255 8.7920 105.4726 44.9696 0.0000 173.7831 55 E 4.6712 7.6495 117.9961 53.6382 33.6143 175.1705 56 L 4.2967 8.5236 121.3826 55.2923 42.5661 178.5898 57 A 4.0413 8.8913 125.5914 55.0355 18.8050 180.2400 58 S 4.1257 8.2292 109.9513 61.6454 62.9493 175.4737 59 K 4.3856 7.5040 117.0002 56.0162 31.8738 177.3800 60 V 4.0237 7.4849 124.4859 61.9457 31.4424 174.8631 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 P 0.00 4.48 0.00 2.09 2.03 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 2 I 8.28 4.85 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 1.27 0.72 0.90 0.00 0.00 3 A 9.53 4.79 1.19 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 0.00 0.00 0.00 0.00 0.00 4 Q 8.67 4.92 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.64 0.00 0.00 0.00 0.00 0.00 2.10 2.24 0.00 5 I 8.79 4.46 1.83 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 1.21 0.56 0.88 0.00 0.00 6 H 8.81 5.24 0.00 2.90 3.09 0.00 5.84 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.24 4.63 1.82 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 1.18 0.83 0.86 0.00 0.00 8 L 8.33 4.62 0.00 1.53 1.64 1.02 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.10 4.50 0.00 1.96 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 0.00 2.31 2.11 0.00 10 G 8.78 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 0.00 0.00 0.00 11 R 7.65 4.44 0.00 1.78 1.85 0.00 3.25 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.85 0.00 12 S 8.25 4.53 0.00 3.99 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 13 D 8.52 4.40 0.00 2.78 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 14 E 8.07 3.92 0.00 2.05 1.99 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 2.40 2.46 0.00 15 Q 7.80 4.02 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 16 K 7.97 3.98 0.00 1.81 1.84 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.67 7.81 17 E 8.14 4.00 0.00 2.27 1.99 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 2.30 2.34 0.00 18 T 7.92 3.92 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 1.21 0.00 0.00 19 L 8.13 3.92 0.00 1.82 1.85 0.91 1.33 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 20 I 7.74 3.69 2.00 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 1.39 1.05 0.90 0.00 0.00 21 R 7.79 3.89 0.00 1.94 1.90 0.00 3.10 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 22 E 8.49 3.95 0.00 2.01 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 2.48 2.46 0.00 23 V 7.93 3.63 2.23 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 1.02 0.00 0.00 0.92 0.00 0.00 24 S 7.96 4.16 0.00 4.13 3.89 0.00 0.00 0.00 0.00 0.00 0.00 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 8.37 3.90 0.00 2.10 1.99 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 2.49 2.47 0.00 26 A 7.97 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.83 3.62 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 1.40 1.24 0.91 0.00 0.00 28 S 7.99 4.17 0.00 3.91 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 29 R 8.66 3.84 0.00 2.11 1.90 0.00 3.16 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 30 S 8.01 4.11 0.00 3.93 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 31 L 7.72 4.37 0.00 1.66 1.69 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.49 4.34 0.00 2.75 2.71 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 0.00 0.00 0.00 0.00 33 A 7.52 4.77 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 34 P 0.00 4.28 0.00 2.22 2.21 0.00 3.72 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 2.07 1.96 0.00 35 L 8.92 3.89 0.00 1.74 1.73 0.92 0.76 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 36 T 7.88 4.08 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 37 S 8.01 4.45 0.00 3.97 4.01 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 0.00 0.00 0.00 38 V 7.59 4.08 2.16 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 0.75 0.00 0.00 0.97 0.00 0.00 39 R 8.93 4.70 0.00 1.81 1.76 0.00 3.16 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 40 V 8.49 4.86 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 0.80 0.00 0.00 0.92 0.00 0.00 41 I 8.91 4.55 1.84 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 1.21 0.61 0.87 0.00 0.00 42 I 8.39 4.75 1.84 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 1.31 0.51 0.87 0.00 0.00 43 T 8.67 4.50 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 1.19 0.00 0.00 44 E 8.75 4.77 0.00 1.91 1.84 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 2.35 2.31 0.00 45 M 8.74 4.93 0.00 1.95 1.86 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.44 0.00 46 A 8.56 4.51 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 K 8.57 4.08 0.00 1.81 1.95 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.58 1.46 7.81 48 G 8.00 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 49 H 8.60 4.97 0.00 3.37 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.16 5.08 0.00 2.97 2.91 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 51 G 8.37 4.17 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 0.00 52 I 8.04 4.12 1.68 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.68 0.82 0.00 0.00 53 G 9.52 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 0.00 0.00 0.00 54 G 8.79 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 0.00 0.00 0.00 55 E 7.65 4.67 0.00 1.90 1.74 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 2.19 2.22 0.00 56 L 8.52 4.30 0.00 1.69 1.62 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.89 4.04 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 4.13 0.00 4.00 4.19 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 0.00 0.00 0.00 59 K 7.50 4.39 0.00 1.89 1.87 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.37 7.81 60 V 7.48 4.02 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 0.67 0.00 0.00 0.92 0.00 0.00