NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 725 Q 4.0720 8.3449 119.6675 54.9531 30.9767 174.6893 726 F 4.8475 7.4824 116.2471 54.8629 41.3197 174.4709 727 L 4.2314 9.2774 124.7042 55.2266 42.9319 177.0878 728 S 4.4202 8.7932 116.7418 58.0845 64.6414 174.8638 729 G 3.9819 9.0140 105.9250 44.7859 0.0000 171.5845 730 Q 5.2204 8.8005 115.7371 54.1234 33.7269 174.2671 731 L 5.3975 9.3931 123.8139 53.5200 45.4986 174.9416 732 S 4.6940 9.1226 121.7379 57.0215 63.7073 172.7825 733 I 5.0495 8.8345 127.5425 59.3654 41.5695 174.1109 734 K 5.0960 8.9853 127.1446 53.6980 34.9113 174.6542 735 L 5.4332 8.5115 125.9860 53.0077 45.6748 175.1156 736 W 5.4148 9.1069 130.9808 56.2785 34.7696 172.6632 737 F 4.9104 8.2338 128.5630 56.4493 40.9040 174.5533 738 D 3.4780 7.6904 127.3173 52.0725 40.5131 176.8931 739 K 3.2719 7.7316 125.6228 58.5978 33.2214 178.7741 740 V 3.6634 7.5710 118.7205 64.7556 31.7798 176.7138 741 G 3.6526 7.9636 106.2141 45.4306 0.0000 172.7470 742 H 4.1807 7.4664 116.4553 55.9017 26.8791 174.1918 743 Q 5.0686 7.0731 116.0534 54.1007 33.7953 175.3200 744 L 5.0932 8.8271 124.9615 53.5817 44.4755 174.8808 745 I 4.8344 9.0435 127.9715 59.7918 39.4408 174.7572 746 V 4.8090 8.8682 127.6996 61.4246 34.1175 174.1255 747 T 4.7132 9.0378 125.4008 61.7061 71.4340 173.3467 748 I 3.9451 7.9650 127.6218 59.8150 38.4592 175.4903 749 L 4.2782 9.2338 131.8358 55.4127 41.8585 178.5897 750 G 4.4031 7.4644 102.7023 46.0379 0.0000 170.4623 751 A 5.8953 8.8024 120.8591 50.0218 22.8678 175.3096 752 K 4.6652 8.8668 117.8708 55.0238 36.8357 175.5860 753 D 4.5616 8.7472 116.7113 55.0801 38.3852 174.4460 754 L 4.1357 7.4822 117.8516 53.9072 42.2121 175.6958 755 P 4.3235 0.0000 0.0000 62.3182 31.9571 176.5195 756 S 4.2377 8.3667 117.6859 58.4232 63.5059 174.0776 757 R 4.2057 8.5183 121.2184 55.7741 30.4502 178.1102 758 E 3.8687 8.6514 119.0453 59.5951 29.4439 178.0466 759 D 4.5643 8.0231 115.5281 53.2806 39.5343 177.2427 760 G 3.9104 8.3869 109.1900 45.6645 0.0000 174.3428 761 R 4.3144 8.0671 119.2013 54.5085 31.2367 174.2399 762 P 4.9582 0.0000 0.0000 62.6301 33.2216 175.3015 763 R 4.5646 8.2860 118.5838 55.3509 32.7278 176.0412 764 N 5.9212 9.6085 118.4558 50.2612 38.7011 171.8881 765 P 5.5285 0.0000 0.0000 62.3868 33.9505 175.2153 766 Y 5.4118 8.9714 118.9802 55.6991 42.2322 173.6462 767 V 4.8560 8.4659 120.2718 60.9904 34.3534 174.0639 768 K 5.1553 9.3258 128.7911 54.7649 35.0380 174.6393 769 I 5.2193 9.0415 127.1371 59.8118 41.0082 173.7766 770 Y 5.1890 9.0503 124.3614 56.2274 40.7119 174.7018 771 F 5.1121 9.0259 127.4205 57.2647 39.7174 174.8018 772 L 4.6623 8.5681 127.3075 52.2834 44.4881 175.9264 773 P 4.4224 0.0000 0.0000 63.2274 32.9517 174.1275 774 D 4.1284 8.4237 118.9918 55.0715 37.3362 173.4885 775 R 4.0355 7.9504 124.0836 54.8987 28.4965 175.1756 776 S 4.8595 7.8099 116.6859 55.4078 67.0528 175.3023 777 D 4.3449 8.7700 119.5293 57.2282 41.0724 178.1039 778 K 3.9186 8.2367 119.0160 59.1157 32.3594 176.6355 779 N 5.0802 8.5771 114.2263 52.8535 38.8771 173.5779 780 K 4.7005 7.8993 120.4526 54.7770 34.0164 175.6697 781 R 4.4158 8.6705 124.6267 54.6530 34.8230 174.2207 782 R 5.1450 7.6931 118.9199 54.6404 34.1715 175.2596 783 T 4.4809 8.8291 113.7379 61.0569 69.8728 174.2584 784 K 4.2177 9.2361 122.4646 57.0005 32.6670 176.6420 785 T 5.0965 8.2680 117.0551 62.3244 69.8699 174.9556 786 V 4.0167 8.8260 127.4576 62.4008 33.0709 174.9556 787 K 4.5794 8.6715 126.8025 56.1204 32.8500 177.1488 788 K 3.8236 8.7830 124.2999 57.0655 29.5744 173.6860 789 T 4.6704 8.4418 114.2421 61.0567 71.9710 174.2290 790 L 4.7081 8.5964 122.1816 53.7803 43.4793 175.9253 791 E 5.4533 8.1996 119.2515 53.1429 28.4097 173.4843 792 P 4.1121 0.0000 0.0000 62.6691 33.4385 177.4193 793 K 4.4294 7.8533 120.2423 54.9689 34.1552 175.5045 794 W 4.4864 9.0819 125.0568 56.7174 30.5291 177.1322 795 N 4.1670 8.2021 115.0649 54.7640 36.2602 174.0244 796 Q 4.7401 7.8978 115.6026 54.3894 32.2927 176.3754 797 T 4.7608 8.4191 119.3550 61.8735 70.6458 173.6362 798 F 5.1063 8.9821 125.5891 55.9603 41.8165 174.9881 799 I 4.8223 8.0153 121.7567 59.8797 40.1025 174.2400 800 Y 4.7895 8.7610 125.6399 56.5685 39.8091 174.9223 801 S 5.1022 8.5051 116.7960 56.5766 65.4726 172.0620 802 P 4.8835 0.0000 0.0000 62.5212 32.4975 175.6564 803 V 4.7874 8.9906 121.3521 61.5039 34.5703 174.0136 804 H 5.0815 9.3056 123.5244 53.4029 31.7528 174.4231 805 R 2.0000 8.8016 124.1221 59.1507 29.4490 178.5517 806 R 3.9086 7.7185 113.4955 58.3538 29.7274 177.4352 807 E 4.3541 8.2250 118.9115 57.0795 29.9670 177.9938 808 F 4.4789 8.1666 119.1436 60.5720 38.7227 177.4065 809 R 4.1191 8.1325 115.9641 58.2214 30.0854 176.9507 810 E 4.6701 8.2255 116.2606 55.7136 30.2276 175.5782 811 R 4.8745 7.9044 117.3658 54.7405 34.4930 174.2119 812 M 5.1809 8.4759 118.0586 54.0700 35.4221 173.4648 813 L 5.0829 8.9671 121.1147 53.4173 43.9977 175.2376 814 E 4.7122 9.4854 126.9308 55.0572 31.0741 174.6410 815 I 5.1138 8.8195 129.7153 59.7954 39.5551 175.0864 816 T 5.0661 9.2131 117.6489 59.6802 72.2763 172.5881 817 L 5.0153 8.1356 125.4536 53.1768 45.0420 175.0954 818 W 5.2982 8.5314 123.8085 54.9281 34.0797 173.4860 819 D 5.1822 9.1514 123.5848 52.8792 42.3540 175.3752 820 Q 4.7078 9.3117 129.3542 55.8466 28.7351 174.9501 *828 S 4.6118 8.2744 121.7161 58.3398 64.8570 172.5894 829 E 4.8852 9.0168 120.4068 54.4577 32.8236 174.2882 830 F 3.9018 9.1885 129.3199 57.9235 39.8911 174.7312 831 L 4.1367 8.4635 124.9535 53.7179 42.5544 175.3870 832 G 3.6812 5.3800 104.3649 42.7685 0.0000 172.2430 833 E 5.1492 8.9505 120.6658 54.2477 33.4981 174.2476 834 I 4.6469 9.0854 126.4251 59.3304 40.5943 174.0651 835 L 5.0031 8.7022 128.7121 53.4677 44.1561 175.4214 836 I 4.4245 8.5823 128.6687 59.2378 39.0522 175.4433 837 E 4.3010 8.6992 127.8699 55.9526 30.1435 178.2357 838 L 3.7734 8.6951 124.5813 57.6585 41.8635 179.2959 839 E 4.1394 8.2089 118.4084 58.4994 29.7096 177.1386 840 T 4.5581 7.3947 105.3965 60.8696 69.2311 174.0005 841 A 4.2068 7.6138 124.6893 52.6010 18.9080 179.3407 842 L 4.3908 8.2025 121.0446 54.5293 40.1389 177.6212 843 L 4.6965 7.8270 128.5615 54.4390 41.4497 177.0103 844 D 4.8746 8.0305 114.3425 52.4331 40.2235 175.9357 845 D 4.5403 8.5079 117.0998 55.4457 40.3291 172.5791 846 E 4.8863 8.3477 115.6774 53.0021 32.6883 173.7642 847 P 4.6534 0.0000 0.0000 63.3472 32.3060 175.2444 848 H 4.8971 9.0200 118.4673 53.9422 33.5059 172.2806 849 W 5.1674 8.6142 120.5209 56.0744 30.5181 175.4171 850 Y 4.8465 9.1304 120.9028 55.9878 41.2336 175.0160 851 K 4.5313 8.8403 123.1696 56.1118 32.9995 176.8839 852 L 4.2473 8.6335 125.5654 54.6408 42.6722 177.3872 853 Q 4.2040 8.5112 121.0505 56.1304 29.2729 175.4413 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 725 Q 8.34 4.07 0.00 1.83 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.74 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 726 F 7.48 4.85 0.00 3.13 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 0.00 727 L 9.28 4.23 0.00 1.66 1.60 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 728 S 8.79 4.42 0.00 3.82 3.84 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 0.00 729 G 9.01 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 0.00 730 Q 8.80 5.22 0.00 1.92 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.70 0.00 0.00 0.00 0.00 0.00 2.30 2.22 0.00 731 L 9.39 5.40 0.00 1.88 1.65 1.24 1.14 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 0.00 732 S 9.12 4.69 0.00 2.72 3.07 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 0.00 733 I 8.83 5.05 1.97 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.59 0.84 0.00 0.00 734 K 8.99 5.10 0.00 1.73 1.58 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.78 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.25 7.81 735 L 8.51 5.43 0.00 1.88 1.56 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 736 W 9.11 5.41 0.00 3.52 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 737 F 8.23 4.91 0.00 2.95 2.87 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 0.00 738 D 7.69 3.48 0.00 1.76 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 0.00 0.00 0.00 739 K 7.73 3.27 0.00 1.91 1.83 0.00 1.63 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.28 1.33 7.81 740 V 7.57 3.66 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 0.77 0.00 0.00 0.88 0.00 0.00 741 G 7.96 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 742 H 7.47 4.18 0.00 3.39 3.38 0.00 5.77 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 743 Q 7.07 5.07 0.00 1.85 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.88 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 744 L 8.83 5.09 0.00 1.84 1.43 0.89 0.35 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 0.00 745 I 9.04 4.83 2.18 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.57 1.02 0.00 0.00 746 V 8.87 4.81 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 0.92 0.00 0.00 1.07 0.00 0.00 747 T 9.04 4.71 4.18 0.00 0.00 0.00 0.00 0.00 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 0.00 748 I 7.97 3.95 1.60 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 0.78 1.17 0.42 0.00 0.00 749 L 9.23 4.28 0.00 1.69 1.51 0.88 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 750 G 7.46 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 0.00 0.00 0.00 0.00 751 A 8.80 5.90 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 752 K 8.87 4.67 0.00 1.63 1.82 0.00 0.96 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.65 1.04 7.81 753 D 8.75 4.56 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 0.00 754 L 7.48 4.14 0.00 1.68 1.59 0.98 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 755 P 0.00 4.32 0.00 2.07 2.13 0.00 3.73 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 1.92 1.93 0.00 756 S 8.37 4.24 0.00 3.81 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 0.00 757 R 8.52 4.21 0.00 2.07 1.84 0.00 3.14 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 758 E 8.65 3.87 0.00 1.93 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 2.25 2.22 0.00 759 D 8.02 4.56 0.00 2.76 2.75 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 0.00 0.00 0.00 0.00 760 G 8.39 3.91 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 0.00 0.00 0.00 761 R 8.07 4.31 0.00 2.00 1.85 0.00 3.23 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 762 P 0.00 4.96 0.00 2.08 2.07 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 763 R 8.29 4.56 0.00 1.92 1.94 0.00 3.30 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 764 N 9.61 5.92 0.00 2.87 2.84 0.00 0.00 6.67 7.92 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 0.00 765 P 0.00 5.53 0.00 2.56 2.32 0.00 3.96 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 2.13 2.01 0.00 766 Y 8.97 5.41 0.00 3.21 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 767 V 8.47 4.86 1.58 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 1.01 0.00 0.00 0.25 0.00 0.00 768 K 9.33 5.16 0.00 2.12 1.97 0.00 1.57 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.31 1.39 7.81 769 I 9.04 5.22 2.07 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 1.37 0.93 1.16 0.00 0.00 770 Y 9.05 5.19 0.00 2.95 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 0.00 771 F 9.03 5.11 0.00 1.51 2.46 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 0.00 772 L 8.57 4.66 0.00 1.48 1.41 0.92 0.56 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 0.00 773 P 0.00 4.42 0.00 2.08 2.00 0.00 3.65 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.88 0.00 774 D 8.42 4.13 0.00 2.77 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 0.00 775 R 7.95 4.04 0.00 1.47 1.66 0.00 2.95 0.00 0.00 3.10 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.70 0.00 776 S 7.81 4.86 0.00 4.02 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 0.00 777 D 8.77 4.34 0.00 2.80 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 0.00 778 K 8.24 3.92 0.00 1.81 1.92 0.00 1.92 0.00 0.00 1.85 0.00 0.00 3.08 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.48 7.81 779 N 8.58 5.08 0.00 3.18 3.14 0.00 0.00 6.45 7.40 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 0.00 780 K 7.90 4.70 0.00 1.49 1.68 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.73 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.02 0.54 7.81 781 R 8.67 4.42 0.00 0.88 0.66 0.00 2.68 0.00 0.00 2.77 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.81 0.00 782 R 7.69 5.14 0.00 1.46 1.65 0.00 3.07 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.46 0.00 783 T 8.83 4.48 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 0.78 0.00 0.00 784 K 9.24 4.22 0.00 1.96 1.93 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.51 7.81 785 T 8.27 5.10 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 1.50 0.00 0.00 786 V 8.83 4.02 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 0.85 0.00 0.00 0.66 0.00 0.00 787 K 8.67 4.58 0.00 1.70 1.75 0.00 1.97 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.49 7.81 788 K 8.78 3.82 0.00 1.89 1.84 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.37 7.81 789 T 8.44 4.67 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 1.12 0.00 0.00 790 L 8.60 4.71 0.00 1.58 1.73 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 791 E 8.20 5.45 0.00 1.87 1.75 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 0.00 2.19 2.25 0.00 792 P 0.00 4.11 0.00 0.49 1.67 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.82 0.00 793 K 7.85 4.43 0.00 1.48 1.67 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.26 1.44 7.81 794 W 9.08 4.49 0.00 3.47 3.11 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 0.00 795 N 8.20 4.17 0.00 2.82 2.85 0.00 0.00 6.93 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 796 Q 7.90 4.74 0.00 1.89 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.64 0.00 797 T 8.42 4.76 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 1.21 0.00 0.00 798 F 8.98 5.11 0.00 2.64 2.33 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 0.00 799 I 8.02 4.82 1.84 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 1.37 0.62 0.92 0.00 0.00 800 Y 8.76 4.79 0.00 2.72 2.45 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 0.00 801 S 8.51 5.10 0.00 3.89 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 0.00 802 P 0.00 4.88 0.00 2.21 2.09 0.00 3.86 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.04 0.00 803 V 8.99 4.79 2.43 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 1.25 0.00 0.00 1.11 0.00 0.00 804 H 9.31 5.08 0.00 3.32 3.14 0.00 5.70 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 805 R 8.80 2.00 0.00 1.64 1.74 0.00 2.21 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.42 0.00 806 R 7.72 3.91 0.00 1.94 1.99 0.00 3.01 0.00 0.00 3.18 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 807 E 8.23 4.35 0.00 2.27 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 2.30 2.36 0.00 808 F 8.17 4.48 0.00 3.09 2.99 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 0.00 809 R 8.13 4.12 0.00 1.81 2.00 0.00 3.16 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 810 E 8.23 4.67 0.00 2.01 1.86 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 2.22 2.35 0.00 811 R 7.90 4.87 0.00 1.66 1.34 0.00 2.33 0.00 0.00 2.91 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 812 M 8.48 5.18 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.43 0.00 813 L 8.97 5.08 0.00 1.60 1.69 0.91 0.78 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 0.00 814 E 9.49 4.71 0.00 2.07 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 2.40 2.52 0.00 815 I 8.82 5.11 1.98 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.52 0.90 0.00 0.00 816 T 9.21 5.07 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 817 L 8.14 5.02 0.00 1.63 1.21 1.16 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 818 W 8.53 5.30 0.00 1.78 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 0.00 819 D 9.15 5.18 0.00 2.81 2.63 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 0.00 820 Q 9.31 4.71 0.00 2.62 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.26 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 *828 S 8.27 4.61 0.00 3.98 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 0.00 829 E 9.02 4.89 0.00 2.09 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 830 F 9.19 3.90 0.00 2.81 2.87 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 0.00 831 L 8.46 4.14 0.00 1.35 1.39 0.88 0.87 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 0.00 832 G 5.38 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 833 E 8.95 5.15 0.00 2.32 1.90 0.00 0.00 0.00 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 2.50 0.00 834 I 9.09 4.65 1.82 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.70 0.72 0.00 0.00 835 L 8.70 5.00 0.00 1.76 1.56 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 836 I 8.58 4.42 1.79 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 1.07 0.45 0.87 0.00 0.00 837 E 8.70 4.30 0.00 1.99 1.87 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 2.39 2.27 0.00 838 L 8.70 3.77 0.00 1.77 0.95 0.30 0.55 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 0.00 839 E 8.21 4.14 0.00 1.96 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 2.33 2.41 0.00 840 T 7.39 4.56 4.27 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 1.24 0.00 0.00 841 A 7.61 4.21 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 0.00 842 L 8.20 4.39 0.00 1.77 1.71 0.75 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 843 L 7.83 4.70 0.00 1.75 1.79 0.81 1.05 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 0.00 844 D 8.03 4.87 0.00 2.83 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 0.00 845 D 8.51 4.54 0.00 2.59 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 846 E 8.35 4.89 0.00 2.12 1.67 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 2.41 2.37 0.00 847 P 0.00 4.65 0.00 1.82 1.89 0.00 3.60 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.88 0.00 848 H 9.02 4.90 0.00 3.08 2.85 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 849 W 8.61 5.17 0.00 3.12 3.25 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 0.00 850 Y 9.13 4.85 0.00 3.01 2.88 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 0.00 851 K 8.84 4.53 0.00 1.70 1.78 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.51 7.81 852 L 8.63 4.25 0.00 1.62 1.48 0.88 0.61 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 0.00 853 Q 8.51 4.20 0.00 2.12 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.55 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 * Residues marked with a * may have inaccurate shift predictions.