NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 V 4.3270 8.1545 119.8146 61.3404 33.5323 174.9588 26 N 4.8485 9.6938 126.4122 48.9437 40.9697 168.3514 27 N 4.8241 9.7082 125.0172 52.6680 40.4149 173.6061 28 I 4.5369 8.3455 127.5985 59.6424 38.5630 176.1098 29 S 4.3721 8.7781 122.1079 58.5403 64.2228 174.1859 30 G 3.8591 8.7272 107.1610 46.0176 0.0000 173.6575 31 I 3.8425 7.5396 121.3621 61.3837 37.6071 176.2242 32 E 4.4465 8.8808 125.4052 58.3444 30.9620 175.9818 33 E 5.1885 7.7635 113.5632 55.3307 32.5109 174.7917 34 V 4.5098 8.6139 120.2902 61.2392 35.1578 174.0155 35 N 5.3128 8.6360 122.8509 51.7773 42.1361 173.5428 36 M 4.5055 8.8837 124.0648 53.5568 34.0827 175.1639 37 F 4.9334 8.7401 122.9039 57.2471 40.4114 175.5244 38 T 4.8449 8.7339 118.6799 61.3598 72.2433 174.2673 39 N 4.8442 8.7945 119.8308 53.5563 37.3415 175.3271 40 Q 4.5419 7.6007 114.9569 55.9895 29.4782 175.6608 41 G 3.9167 8.3373 104.8920 47.0114 0.0000 173.6387 42 T 5.1635 7.7217 113.8578 61.3502 73.4834 173.2611 43 V 4.6389 8.6393 122.8741 61.2450 34.9309 174.4747 44 I 4.3273 8.8107 130.0935 61.1585 38.0906 174.2388 45 H 5.4022 9.1536 128.3695 54.2385 32.4694 172.7672 46 F 5.1433 9.2476 124.4739 55.6716 41.6624 173.7688 47 N 4.8129 8.6403 122.2133 53.3184 40.1343 175.3989 48 N 4.2862 8.6514 122.7002 52.9704 36.1095 171.7021 49 P 4.7031 0.0000 0.0000 62.8250 33.7544 178.2128 50 K 4.3681 8.8872 124.4853 54.6749 33.2728 176.1441 51 V 4.8838 8.4044 124.4062 60.3536 34.4702 173.8491 52 Q 5.1971 9.3493 127.1784 54.1115 31.1155 174.7033 53 A 4.9875 9.3919 127.3136 50.7124 23.2622 175.5701 54 S 4.7277 8.5775 118.9431 57.3445 66.6563 175.4213 55 L 4.7950 8.0915 126.2372 52.2035 39.9418 174.0074 *57 A 4.0998 7.9935 125.0630 50.3218 21.0712 176.7275 58 N 4.1965 7.4837 111.3080 54.8968 36.8705 174.5125 59 T 4.7265 7.5502 112.8497 61.7804 72.5931 174.1206 60 F 5.1454 8.9988 123.9612 55.9043 42.6394 174.5027 61 T 4.5411 9.3080 120.2590 62.0387 70.5189 173.2695 62 I 4.7920 8.2949 127.5852 59.6762 39.2845 175.2018 63 T 4.5807 10.0695 121.7528 59.0016 70.4366 173.6102 64 G 4.5694 8.8069 118.1588 44.7718 0.0000 171.0381 65 H 4.0582 8.4664 119.7976 56.0809 30.1898 173.8831 66 A 4.2465 7.9392 128.4977 49.7854 20.8925 175.3973 67 E 4.5344 8.5598 120.1600 54.5831 32.7134 174.8503 68 T 4.8624 8.3924 117.4113 60.6993 68.5519 173.5373 69 K 4.7163 8.7468 128.7287 54.2539 35.6362 176.1653 70 Q 4.2766 9.0559 122.6519 55.6714 29.4968 177.2346 71 L 4.0041 8.9097 125.0154 58.8856 42.2022 179.6709 72 T 3.8825 7.9751 108.6898 64.7957 68.3090 175.8954 73 E 4.1492 8.0423 120.4657 58.5264 29.9125 177.3345 74 M 4.4076 8.0452 117.2735 55.2245 32.9147 175.8884 75 L 4.5830 7.2123 118.6109 53.6651 44.3345 175.5713 76 P 4.4853 0.0000 0.0000 65.3193 31.6340 178.6127 77 S 4.0937 8.1629 113.9342 61.5081 62.5881 176.0778 78 I 3.8759 7.7994 121.1440 63.2863 37.6748 177.6577 79 L 3.9268 8.2639 120.4824 57.8298 41.1881 178.4873 80 N 4.4507 7.8989 115.6792 55.5398 38.8685 175.1191 81 Q 4.5528 7.9065 117.0752 55.7057 29.6216 175.0055 82 L 4.3565 7.5466 118.0487 52.6102 44.5065 176.3120 83 G 3.8770 8.1916 110.0118 44.0540 0.0000 174.9955 84 A 4.0152 8.3985 121.8248 54.3153 18.5951 178.1788 85 D 4.7879 7.7333 113.0937 53.0759 40.7454 178.5980 86 S 4.0772 7.7658 116.9623 61.3673 62.4156 175.9640 87 L 4.2699 7.6464 120.2619 57.0525 41.8474 178.6459 88 T 4.0794 7.8922 111.8464 65.9682 68.4781 176.5806 89 S 4.3719 8.1521 123.7657 63.0875 62.4380 177.3619 90 L 4.4382 7.7550 126.2947 54.3351 40.7408 179.0293 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 25 V 8.15 4.33 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 26 N 9.69 4.85 0.00 2.36 2.67 0.00 0.00 6.24 6.04 0.00 0.00 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 N 9.71 4.82 0.00 2.71 2.75 0.00 0.00 7.10 7.94 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 28 I 8.35 4.54 1.91 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.92 0.95 0.00 0.00 29 S 8.78 4.37 0.00 3.98 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 30 G 8.73 3.86 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 0.00 0.00 0.00 31 I 7.54 3.84 1.99 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.39 0.89 0.00 0.00 32 E 8.88 4.45 0.00 1.90 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 2.53 2.25 0.00 33 E 7.76 5.19 0.00 2.01 1.91 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 2.21 2.32 0.00 34 V 8.61 4.51 1.77 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 0.74 0.00 0.00 0.75 0.00 0.00 35 N 8.64 5.31 0.00 2.43 1.87 0.00 0.00 6.83 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 36 M 8.88 4.51 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.47 0.00 37 F 8.74 4.93 0.00 2.94 3.01 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 T 8.73 4.84 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 39 N 8.79 4.84 0.00 2.85 2.93 0.00 0.00 5.88 7.39 0.00 0.00 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 Q 7.60 4.54 0.00 2.35 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.52 0.00 0.00 0.00 0.00 0.00 2.27 2.13 0.00 41 G 8.34 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 0.00 0.00 0.00 42 T 7.72 5.16 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 1.20 0.00 0.00 43 V 8.64 4.64 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 0.63 0.00 0.00 0.96 0.00 0.00 44 I 8.81 4.33 1.91 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 1.05 0.52 0.68 0.00 0.00 45 H 9.15 5.40 0.00 3.10 3.16 0.00 5.73 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 9.25 5.14 0.00 2.85 2.89 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 47 N 8.64 4.81 0.00 2.77 2.73 0.00 0.00 7.38 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 48 N 8.65 4.29 0.00 2.84 3.07 0.00 0.00 6.99 7.54 0.00 0.00 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 P 0.00 4.70 0.00 2.00 2.17 0.00 3.76 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 50 K 8.89 4.37 0.00 1.46 1.73 0.00 1.74 0.00 0.00 1.57 0.00 0.00 2.70 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.35 1.25 7.81 51 V 8.40 4.88 2.10 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 1.08 0.00 0.00 0.86 0.00 0.00 52 Q 9.35 5.20 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.42 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 53 A 9.39 4.99 0.95 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 0.00 0.00 54 S 8.58 4.73 0.00 3.37 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 55 L 8.09 4.80 0.00 1.29 1.56 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 *57 A 7.99 4.10 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 58 N 7.48 4.20 0.00 3.00 2.94 0.00 0.00 6.76 7.42 0.00 0.00 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 T 7.55 4.73 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 1.17 0.00 0.00 60 F 9.00 5.15 0.00 2.80 2.89 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 61 T 9.31 4.54 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 62 I 8.29 4.79 1.41 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.49 0.12 0.00 0.00 63 T 10.07 4.58 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 1.24 0.00 0.00 64 G 8.81 4.57 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 0.00 0.00 0.00 65 H 8.47 4.06 0.00 3.13 3.22 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 66 A 7.94 4.25 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.56 4.53 0.00 1.98 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 0.00 2.20 2.24 0.00 68 T 8.39 4.86 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 1.13 0.00 0.00 69 K 8.75 4.72 0.00 1.66 1.63 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.31 1.32 7.81 70 Q 9.06 4.28 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 71 L 8.91 4.00 0.00 1.88 1.73 0.97 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 72 T 7.98 3.88 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 73 E 8.04 4.15 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 74 M 8.05 4.41 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.45 0.00 75 L 7.21 4.58 0.00 1.71 1.60 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.49 0.00 2.26 2.30 0.00 3.71 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 2.06 2.01 0.00 77 S 8.16 4.09 0.00 4.09 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 78 I 7.80 3.88 2.11 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.77 0.99 0.00 0.00 79 L 8.26 3.93 0.00 1.80 1.69 0.94 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 80 N 7.90 4.45 0.00 2.73 2.86 0.00 0.00 7.08 8.30 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 81 Q 7.91 4.55 0.00 2.35 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.48 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 82 L 7.55 4.36 0.00 1.62 1.34 0.78 -0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 83 G 8.19 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 84 A 8.40 4.02 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 85 D 7.73 4.79 0.00 2.84 2.89 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 86 S 7.77 4.08 0.00 3.82 3.74 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 87 L 7.65 4.27 0.00 1.58 1.70 0.89 0.84 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 88 T 7.89 4.08 4.23 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 0.00 0.00 0.00 1.20 0.00 0.00 89 S 8.15 4.37 0.00 3.75 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 90 L 7.76 4.44 0.00 1.79 1.46 0.92 0.87 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 * Residues marked with a * may have inaccurate shift predictions.