NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 685 D 4.6901 8.3649 120.5378 53.9734 42.6843 176.3823 686 E 4.0908 8.1486 121.4042 58.6384 29.7648 176.2814 687 Q 4.4960 8.6853 119.3724 56.6711 30.1027 177.3017 *689 Y 4.5169 8.0267 117.3120 58.2033 40.1820 177.6062 690 Q 4.0487 8.3744 120.5571 58.9965 29.1542 178.1466 691 R 3.9357 8.2139 119.8810 59.6908 30.0507 178.3139 692 C 4.2319 8.0680 115.8981 63.0025 28.2289 175.7110 693 C 4.2338 8.1820 118.2412 63.0908 27.5602 175.8304 694 N 4.4185 8.0766 116.5883 56.3401 38.3916 176.9766 695 L 4.1976 8.0276 121.1852 58.0882 42.2428 178.3587 696 F 4.2725 8.7844 121.1035 61.8940 39.3562 177.0439 697 E 4.3842 8.7218 117.3301 58.9102 28.9834 179.2125 698 K 4.0378 8.0147 117.9476 58.5963 32.1343 178.5298 699 F 4.0260 7.7924 116.5832 57.9495 40.6018 175.9842 700 F 4.7329 7.8439 116.1896 54.9071 39.5175 172.3915 701 P 4.7812 0.0000 0.0000 61.2748 32.5667 178.7019 702 S 4.2448 8.5661 113.9863 61.2720 63.0121 175.4576 703 S 4.3603 8.0958 113.1080 59.0596 62.9939 173.4780 704 S 4.7816 7.8201 116.3043 56.8098 64.1576 173.1758 705 Y 4.4599 8.1391 123.3926 57.7751 38.7327 175.9558 706 R 3.9509 6.7865 119.0493 56.4883 28.8423 175.8812 707 R 4.7341 8.1479 121.8376 53.4795 32.0713 175.2011 708 P 4.1484 0.0000 0.0000 62.3912 32.0288 176.4404 709 V 3.8547 8.1619 113.9641 60.8007 32.3000 177.6712 710 G 3.6256 8.8105 114.1602 48.5012 0.0000 174.4314 711 I 3.9687 7.5627 110.9883 61.7001 38.3668 176.1251 712 S 4.4895 7.4740 117.1026 57.8694 63.8869 175.5837 713 S 4.5633 8.7900 121.5228 57.7542 62.2131 176.8499 *715 V 3.9887 8.5283 115.6015 61.3646 32.8960 176.6415 716 E 3.9843 8.2694 118.8395 58.8585 29.5478 178.9748 717 A 4.2452 8.2024 118.7564 53.3406 18.5155 178.8381 *719 V 3.8547 7.8276 119.3614 63.9244 33.5416 177.5461 720 S 4.0824 8.3221 113.9036 61.4615 62.0785 176.0685 721 R 3.8257 8.2373 121.1440 59.4921 29.6864 178.3065 722 A 4.0447 7.9702 119.9717 55.1348 18.4216 179.7079 723 R 3.8559 8.2078 116.6310 59.4054 30.3214 179.0848 724 I 3.7099 7.7720 119.5252 64.7427 37.0946 178.1654 725 D 4.3563 8.3420 119.3404 57.3024 40.6077 178.7762 726 A 4.1005 8.4207 121.5738 55.2581 18.4312 179.8024 727 R 4.0907 8.2146 116.5884 59.7613 30.2153 179.4717 728 I 3.7938 7.7619 119.0908 64.4702 37.0929 178.3111 729 D 4.4265 8.5261 120.0526 57.0119 40.5507 178.6630 730 F 4.5894 8.5156 121.5580 61.3599 39.1579 176.8463 731 E 3.6463 8.0269 118.0597 59.1003 29.4824 178.5240 732 S 4.3146 8.0649 113.0810 59.3479 63.4855 175.2890 733 G 3.9797 7.6414 109.8035 44.9689 0.0000 174.3294 734 R 4.0414 7.8215 120.3234 58.1142 30.3152 176.4662 735 I 4.6840 7.6253 109.3430 58.3575 40.4805 175.6532 736 K 4.5493 8.2498 121.2015 55.0806 34.6154 178.2105 737 K 3.3370 8.5548 120.3977 60.3258 32.3693 179.0688 738 E 3.9872 8.0501 120.6127 58.3547 29.3357 178.8003 739 E 3.8263 8.0424 118.8400 59.1421 29.6113 178.0444 740 F 3.9730 7.9149 119.7669 61.7293 39.5606 176.7817 741 T 3.6943 8.0311 109.2873 64.7805 68.3415 175.8393 742 E 3.9875 8.0175 122.0388 58.8111 29.6650 179.5069 743 I 3.8247 7.6233 116.7572 62.0629 37.0056 177.9353 *745 K 4.1980 7.9935 121.5279 56.6179 34.0697 178.3574 746 I 3.7082 7.8264 119.5098 64.5282 36.8090 178.3014 747 C 4.1111 8.1126 117.5814 62.9114 27.9211 176.3227 748 S 4.1067 7.9342 116.2479 61.9063 62.4671 176.7791 749 T 3.8919 7.9367 118.4373 66.6464 68.1644 176.9659 750 I 3.7525 7.9787 121.9113 64.2735 36.5933 178.2972 751 E 3.9443 8.5251 119.9522 59.3830 28.8559 178.9891 752 E 3.9797 8.1923 119.3424 59.3245 29.4643 178.9326 753 L 3.7987 7.7548 118.0772 57.6281 41.6470 179.3521 754 R 4.0202 7.7226 117.6227 59.4884 30.2064 178.9924 755 R 4.1236 7.5540 115.2852 57.2099 30.4533 176.9787 756 Q 4.1366 6.7526 119.3446 56.0863 30.0417 175.4559 757 K 4.1888 8.5160 121.0400 56.7010 32.8590 175.8470 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 685 D 8.36 4.69 0.00 2.72 2.81 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 0.00 0.00 0.00 0.00 686 E 8.15 4.09 0.00 2.19 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 2.40 2.46 0.00 687 Q 8.69 4.50 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.49 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 *689 Y 8.03 4.52 0.00 3.18 2.98 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 0.00 0.00 0.00 690 Q 8.37 4.05 0.00 2.32 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 691 R 8.21 3.94 0.00 2.18 1.93 0.00 3.16 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 692 C 8.07 4.23 0.00 3.21 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 0.00 693 C 8.18 4.23 0.00 3.22 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 0.00 694 N 8.08 4.42 0.00 2.91 2.95 0.00 0.00 7.07 7.13 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 0.00 695 L 8.03 4.20 0.00 1.90 1.95 1.03 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 696 F 8.78 4.27 0.00 3.41 3.37 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 0.00 697 E 8.72 4.38 0.00 2.23 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 0.00 2.77 2.61 0.00 698 K 8.01 4.04 0.00 1.60 1.54 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.65 7.81 699 F 7.79 4.03 0.00 2.69 2.32 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 0.00 700 F 7.84 4.73 0.00 2.83 2.93 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 0.00 701 P 0.00 4.78 0.00 2.21 2.22 0.00 3.78 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.83 0.00 702 S 8.57 4.24 0.00 4.04 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 0.00 703 S 8.10 4.36 0.00 4.02 4.04 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 0.00 0.00 0.00 704 S 7.82 4.78 0.00 3.77 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 0.00 705 Y 8.14 4.46 0.00 3.13 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 0.00 706 R 6.79 3.95 0.00 1.54 1.91 0.00 2.94 0.00 0.00 3.04 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.08 0.00 707 R 8.15 4.73 0.00 1.84 1.87 0.00 3.50 0.00 0.00 3.54 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.61 0.00 708 P 0.00 4.15 0.00 1.89 0.49 0.00 3.70 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.79 0.00 709 V 8.16 3.85 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 0.95 0.00 0.00 710 G 8.81 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 0.00 711 I 7.56 3.97 1.86 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 1.29 0.64 0.90 0.00 0.00 712 S 7.47 4.49 0.00 3.83 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 0.00 713 S 8.79 4.56 0.00 4.02 3.57 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 *715 V 8.53 3.99 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 0.75 0.00 0.00 0.88 0.00 0.00 716 E 8.27 3.98 0.00 2.19 2.25 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 2.57 2.28 0.00 717 A 8.20 4.25 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *719 V 7.83 3.85 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 0.92 0.00 0.00 0.87 0.00 0.00 720 S 8.32 4.08 0.00 3.98 4.08 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 0.00 0.00 0.00 0.00 721 R 8.24 3.83 0.00 1.82 1.72 0.00 3.06 0.00 0.00 2.93 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.45 0.00 722 A 7.97 4.04 1.51 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 0.00 723 R 8.21 3.86 0.00 2.04 2.01 0.00 3.14 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 724 I 7.77 3.71 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.40 0.92 0.00 0.00 725 D 8.34 4.36 0.00 2.87 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 726 A 8.42 4.10 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 727 R 8.21 4.09 0.00 2.32 2.08 0.00 3.45 0.00 0.00 3.55 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.92 0.00 728 I 7.76 3.79 1.89 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 1.78 1.04 0.92 0.00 0.00 729 D 8.53 4.43 0.00 2.80 2.77 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 0.00 730 F 8.52 4.59 0.00 2.94 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 0.00 731 E 8.03 3.65 0.00 2.02 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 0.00 2.23 2.20 0.00 732 S 8.06 4.31 0.00 4.06 4.09 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 0.00 0.00 0.00 0.00 733 G 7.64 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 734 R 7.82 4.04 0.00 1.82 2.11 0.00 3.20 0.00 0.00 3.49 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 735 I 7.63 4.68 2.04 0.00 0.00 1.00 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 0.97 1.03 0.00 0.00 736 K 8.25 4.55 0.00 1.89 1.98 0.00 1.60 0.00 0.00 1.90 0.00 0.00 3.16 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.59 7.81 737 K 8.55 3.34 0.00 2.03 2.26 0.00 1.41 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.64 7.81 738 E 8.05 3.99 0.00 2.06 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 2.40 2.28 0.00 739 E 8.04 3.83 0.00 2.02 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 0.00 2.37 2.34 0.00 740 F 7.91 3.97 0.00 2.41 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 0.00 741 T 8.03 3.69 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 1.30 0.00 0.00 742 E 8.02 3.99 0.00 2.16 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 2.26 2.30 0.00 743 I 7.62 3.82 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 1.48 0.81 0.85 0.00 0.00 *745 K 7.99 4.20 0.00 1.86 1.84 0.00 1.60 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.58 1.35 7.81 746 I 7.83 3.71 1.83 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 1.49 0.68 0.90 0.00 0.00 747 C 8.11 4.11 0.00 2.91 2.93 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 0.00 748 S 7.93 4.11 0.00 3.97 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 0.00 749 T 7.94 3.89 4.38 0.00 0.00 0.00 0.00 0.00 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 0.00 750 I 7.98 3.75 1.96 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 1.50 0.65 0.87 0.00 0.00 751 E 8.53 3.94 0.00 2.07 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 2.32 2.52 0.00 752 E 8.19 3.98 0.00 2.14 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 0.00 2.29 2.34 0.00 753 L 7.75 3.80 0.00 1.82 1.70 0.91 0.73 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 0.00 754 R 7.72 4.02 0.00 1.99 1.97 0.00 3.14 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 755 R 7.55 4.12 0.00 1.82 1.98 0.00 3.40 0.00 0.00 3.14 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 756 Q 6.75 4.14 0.00 2.22 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 5.63 0.00 0.00 0.00 0.00 0.00 2.36 2.28 0.00 757 K 8.52 4.19 0.00 1.92 1.88 0.00 1.85 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.27 1.40 7.81 * Residues marked with a * may have inaccurate shift predictions.