NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 775 D 4.5795 8.2227 120.1908 54.1731 42.6366 176.8048 776 E 3.8843 8.9066 122.0486 58.0461 30.3455 175.7078 777 R 3.8260 8.0483 118.8437 59.2113 30.6925 177.3551 778 L 3.9062 7.9257 119.6691 58.2926 42.0753 178.5439 779 S 4.0755 8.5466 113.2266 61.3951 62.2234 176.1278 780 K 3.9607 8.0650 122.1302 59.5081 31.9797 178.7473 781 I 3.7221 8.0405 120.3414 64.5249 36.9997 178.3671 782 I 3.8081 8.0590 120.8008 64.7459 36.9036 178.7496 783 S 5.0188 8.1157 117.1462 61.4670 62.6448 176.7141 784 M 4.1068 8.3407 121.7297 58.1445 31.6394 178.5788 785 F 4.2860 8.3759 121.0950 61.3710 39.5514 177.3150 786 Q 3.8659 8.4247 117.7144 58.7490 28.4589 178.5534 787 A 3.9702 8.2568 122.0954 55.3604 18.2910 179.3937 788 H 4.0341 7.9904 114.6632 58.9961 28.6923 178.1050 789 I 3.5356 7.3361 121.5247 64.4395 36.9126 178.6893 790 R 4.0064 8.5260 119.3447 59.0786 29.7467 179.4457 791 G 3.5223 8.4854 105.9309 47.8552 0.0000 174.8653 792 Y 4.0290 8.2856 122.8732 60.4563 38.7655 178.2963 793 L 4.1612 8.2875 119.6802 58.1148 41.6560 179.7670 794 I 3.7811 7.7853 119.5812 64.5171 36.8282 178.8247 795 R 3.9072 8.1459 118.2073 58.8700 29.8545 178.7541 796 K 4.0440 8.0614 118.9408 59.3349 32.5717 178.4511 797 A 4.1834 8.0906 120.2383 53.9743 18.2049 178.6638 798 Y 4.0578 7.6178 119.0591 60.8385 38.7549 178.2012 799 K 3.7398 8.1287 119.7979 59.3956 32.2430 178.4227 800 K 3.8920 7.9302 119.3454 59.4488 32.2250 178.6392 801 L 3.9646 7.8594 119.3225 57.7673 41.3779 179.5566 802 Q 3.7982 7.9429 118.1016 58.9953 28.5764 178.5323 803 D 4.3101 8.2091 120.1104 57.5721 40.7771 178.9811 804 Q 3.9573 8.4704 118.9242 58.7485 28.5590 178.7208 805 R 3.6925 8.0183 119.9951 59.2832 30.0160 178.6935 806 I 3.7555 7.6208 119.6105 64.1907 37.1109 178.5683 807 G 3.5687 8.1060 106.6070 47.8946 0.0000 175.5017 808 L 3.9743 8.6163 124.2621 57.6218 41.9553 179.2003 809 S 4.0890 8.2799 115.4380 61.4584 62.7342 176.7131 810 V 3.5431 7.8963 120.8804 66.0535 31.2719 177.9357 811 I 3.6471 7.7895 119.3495 64.6181 37.0648 178.2942 812 Q 3.9916 8.4210 119.0403 59.0200 28.5185 179.1622 813 R 3.8527 8.1526 119.5853 59.7185 30.2057 178.4243 814 N 4.3897 8.3763 116.2203 56.0442 38.4371 177.6895 815 I 3.8640 7.8481 121.6030 64.3606 37.2066 178.5728 816 R 3.9740 7.9920 118.8089 59.2570 29.8563 179.0938 817 K 3.8856 8.2506 118.3526 59.3739 32.0453 179.1407 818 W 4.1125 8.3410 128.4509 60.3461 30.3834 178.0726 819 L 3.5437 8.1697 118.5181 57.5716 41.4617 179.3017 820 V 3.6681 8.1192 118.5572 65.8408 31.4433 177.6450 821 L 3.8617 7.8862 120.1301 58.4288 41.6447 179.2238 822 R 4.0678 7.6169 116.3522 58.6526 29.9418 177.7403 823 N 4.9080 7.5856 113.4365 51.5550 39.1735 174.4684 824 W 4.7640 8.0466 133.0230 56.6200 31.5035 176.6198 825 Q 3.8734 9.0283 125.5489 59.2493 27.9817 179.3441 826 W 3.8384 6.7457 118.9992 59.2015 28.8073 178.2243 827 W 4.3541 7.9285 127.9653 60.1932 30.3284 178.1677 828 K 3.9633 8.3402 118.8556 59.2413 31.5369 179.0604 829 L 3.8160 8.1483 120.9625 58.2359 42.1334 178.2829 830 Y 4.1047 8.2096 119.7956 60.8916 38.4595 178.2965 831 S 3.6003 7.6529 115.1050 61.4161 62.9649 176.6891 832 K 4.0167 7.6197 119.8383 58.9224 32.0249 179.1085 833 V 3.7483 7.3529 118.1296 64.8877 31.4749 177.8470 834 K 3.6076 7.3904 118.4786 59.3081 31.7410 177.0250 835 P 4.3912 0.0000 0.0000 65.0908 31.2476 177.4229 836 L 4.4098 7.5756 115.4402 54.6118 41.9198 176.5583 837 L 4.2086 8.2007 125.2396 54.9197 41.6990 176.4664 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 775 D 8.22 4.58 0.00 2.73 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 776 E 8.91 3.88 0.00 2.12 1.93 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 2.38 2.37 0.00 777 R 8.05 3.83 0.00 1.92 1.90 0.00 3.25 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 778 L 7.93 3.91 0.00 1.83 1.79 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 779 S 8.55 4.08 0.00 3.95 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 0.00 780 K 8.06 3.96 0.00 1.98 1.93 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.45 1.49 7.81 781 I 8.04 3.72 2.03 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 1.54 0.92 0.92 0.00 0.00 782 I 8.06 3.81 2.05 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 1.54 0.72 0.98 0.00 0.00 783 S 8.12 5.02 0.00 4.04 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 0.00 784 M 8.34 4.11 0.00 2.12 2.32 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.57 0.00 785 F 8.38 4.29 0.00 3.16 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 0.00 786 Q 8.42 3.87 0.00 2.31 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 787 A 8.26 3.97 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 0.00 788 H 7.99 4.03 0.00 3.22 3.16 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 789 I 7.34 3.54 1.86 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.07 0.76 0.00 0.00 790 R 8.53 4.01 0.00 1.92 1.97 0.00 3.11 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 791 G 8.49 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 792 Y 8.29 4.03 0.00 3.13 3.02 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 0.00 793 L 8.29 4.16 0.00 1.77 1.76 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 794 I 7.79 3.78 2.04 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 1.54 0.57 0.92 0.00 0.00 795 R 8.15 3.91 0.00 1.72 1.90 0.00 3.06 0.00 0.00 3.05 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 796 K 8.06 4.04 0.00 1.78 2.16 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.17 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.55 7.81 797 A 8.09 4.18 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 798 Y 7.62 4.06 0.00 2.99 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 0.00 799 K 8.13 3.74 0.00 1.92 1.79 0.00 1.60 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.53 7.81 800 K 7.93 3.89 0.00 1.85 1.93 0.00 1.77 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.51 7.81 801 L 7.86 3.96 0.00 1.79 1.58 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 802 Q 7.94 3.80 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 1.86 1.73 0.00 803 D 8.21 4.31 0.00 2.76 2.67 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 0.00 804 Q 8.47 3.96 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 805 R 8.02 3.69 0.00 1.84 2.03 0.00 3.04 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 806 I 7.62 3.76 2.06 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.48 0.88 0.00 0.00 807 G 8.11 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 0.00 0.00 0.00 808 L 8.62 3.97 0.00 1.70 1.66 0.91 0.30 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 0.00 809 S 8.28 4.09 0.00 4.08 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 0.00 810 V 7.90 3.54 2.22 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 1.08 0.00 0.00 0.93 0.00 0.00 811 I 7.79 3.65 1.99 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 1.49 0.42 0.89 0.00 0.00 812 Q 8.42 3.99 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 813 R 8.15 3.85 0.00 1.96 2.12 0.00 3.07 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 814 N 8.38 4.39 0.00 2.84 2.82 0.00 0.00 7.11 7.06 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 0.00 815 I 7.85 3.86 1.93 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 1.47 0.70 1.10 0.00 0.00 816 R 7.99 3.97 0.00 2.14 1.98 0.00 3.15 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 1.67 1.77 0.00 817 K 8.25 3.89 0.00 1.96 1.84 0.00 1.60 0.00 0.00 1.50 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.57 7.81 818 W 8.34 4.11 0.00 3.36 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.17 3.54 0.00 1.79 1.64 0.98 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 820 V 8.12 3.67 2.13 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 0.89 0.00 0.00 0.95 0.00 0.00 821 L 7.89 3.86 0.00 1.64 1.53 0.69 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 822 R 7.62 4.07 0.00 1.63 1.78 0.00 2.53 0.00 0.00 2.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.87 0.00 823 N 7.59 4.91 0.00 2.74 2.87 0.00 0.00 6.95 7.43 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 0.00 824 W 8.05 4.76 0.00 3.43 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 825 Q 9.03 3.87 0.00 1.71 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.26 0.00 826 W 6.75 3.84 0.00 1.78 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 0.00 0.00 0.00 827 W 7.93 4.35 0.00 4.01 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 828 K 8.34 3.96 0.00 1.96 1.81 0.00 1.85 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.75 7.81 829 L 8.15 3.82 0.00 1.53 1.80 0.84 0.75 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 0.00 830 Y 8.21 4.10 0.00 2.99 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 0.00 831 S 7.65 3.60 0.00 3.77 3.71 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 0.00 832 K 7.62 4.02 0.00 1.66 1.79 0.00 1.64 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.45 7.81 833 V 7.35 3.75 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 0.99 0.00 0.00 0.95 0.00 0.00 834 K 7.39 3.61 0.00 1.73 1.66 0.00 1.25 0.00 0.00 1.41 0.00 0.00 2.79 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.00 0.68 7.81 835 P 0.00 4.39 0.00 1.95 2.10 0.00 3.65 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.12 0.00 836 L 7.58 4.41 0.00 1.65 1.66 0.89 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 837 L 8.20 4.21 0.00 1.60 1.56 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00