NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 875 P 4.4500 0.0000 0.0000 63.1317 33.3730 174.7269 876 T 4.3433 8.8252 116.8665 61.3168 69.9672 169.0312 877 V 4.8356 8.3452 127.4276 61.3643 33.2744 174.6304 878 I 4.7232 8.8293 121.6067 59.1353 40.4829 174.5063 879 K 4.7475 8.8649 124.6650 54.8872 34.4736 175.0082 880 V 4.8398 8.8145 126.9382 61.3103 34.2315 174.3148 881 Q 4.7798 8.8770 125.9221 54.9838 33.4194 171.3163 882 N 4.1794 8.1444 123.6937 52.7147 36.9697 171.5153 *884 P 4.2478 0.0000 0.0000 61.7059 32.7479 176.8924 885 F 3.8385 9.1721 122.7073 61.0135 39.3360 175.3730 886 T 4.5418 7.8980 110.9438 59.9240 69.4247 174.0998 887 V 4.6022 8.0318 125.1125 59.0445 34.6929 174.6956 888 S 4.7966 8.9440 117.4775 56.8324 66.5093 175.4785 889 I 3.7456 8.1551 122.9821 64.4713 36.7583 178.0653 890 D 4.3870 8.1331 118.4695 57.6436 41.0360 178.2032 891 E 4.0568 8.3590 118.8644 59.2922 29.3904 179.5008 892 I 3.8272 7.6926 119.7732 64.4150 37.0107 178.4615 893 L 4.2966 8.4324 119.1668 57.7524 41.7065 178.7697 894 D 4.6384 8.4586 118.4416 57.1873 40.9577 177.8439 895 F 4.1710 8.3839 120.5929 61.1028 39.5031 176.1526 896 F 4.9526 8.2307 115.3729 56.3455 38.5698 173.8813 897 Y 4.2762 8.0364 121.2539 60.9261 38.4341 175.2140 898 G 3.6199 8.4706 117.8489 45.8427 0.0000 172.9716 899 Y 4.4869 8.3374 116.8136 56.5660 39.5914 176.0938 900 Q 4.4083 8.5000 120.4627 54.6879 27.6385 174.0305 901 V 3.2644 7.7679 125.3818 62.8100 32.6726 175.2325 902 I 3.8630 8.2047 129.7436 60.6229 37.9038 173.8337 903 P 4.4030 0.0000 0.0000 64.1404 31.4446 177.1543 904 G 3.9569 9.1087 110.9034 45.6602 0.0000 174.1527 905 S 4.2635 7.8245 113.3619 59.3649 63.6800 174.8841 906 V 3.7240 7.5652 122.1869 62.6821 32.0944 174.6530 907 C 4.8359 8.3848 120.8646 56.3254 32.3593 172.5843 908 L 4.7459 8.4512 123.3116 53.6677 42.7270 176.2592 909 K 4.4732 8.8009 123.1031 55.9549 33.6304 175.5251 910 Y 4.8203 8.5019 120.8739 56.0365 41.7301 175.3712 911 N 4.7599 8.5997 119.9260 51.6262 39.0444 175.4081 912 E 4.2120 8.6225 114.9726 58.0336 29.5131 177.5364 913 K 4.1953 8.5219 118.8266 56.5991 32.7305 175.7746 914 G 3.6012 8.2881 108.7307 45.0493 0.0000 170.8744 *916 P 3.6757 0.0000 0.0000 62.9409 32.4552 177.5266 917 T 4.1731 7.6203 108.3902 61.0459 69.1948 175.0973 918 G 3.7826 7.7958 109.9296 45.8368 0.0000 172.4376 919 E 5.0081 7.4437 118.1359 54.4201 32.6028 174.9973 920 A 4.9681 8.7440 125.6025 49.9495 23.0297 174.6530 *922 V 3.9333 8.3847 112.3262 63.3159 33.1620 175.8302 923 A 5.2589 8.3160 128.1114 50.3149 22.5110 175.2094 924 F 5.0066 9.0304 116.9518 55.7063 42.8822 176.3265 925 E 3.9954 9.3678 122.7235 58.7286 29.8435 178.1395 926 S 4.8558 7.7960 112.8841 56.2947 66.5918 175.0287 927 R 4.0135 8.4790 123.9716 59.7219 29.9698 178.6169 928 D 4.5724 8.0595 118.2370 56.9386 40.7808 178.5367 929 E 3.8651 8.5076 119.6066 59.2320 29.6362 178.7728 930 A 2.8544 8.0881 121.0349 55.2552 18.4345 179.5544 931 T 3.7013 8.2383 114.0502 66.9404 68.4990 176.6121 932 A 3.9925 8.0325 122.1166 55.0516 18.3449 179.4758 933 A 3.2542 7.7403 119.3198 54.9885 18.2268 180.0591 934 V 3.5508 7.5512 116.5786 66.2657 31.4251 178.4176 935 I 3.7256 7.2877 117.6960 64.4446 37.0140 177.9669 936 D 4.4901 8.2111 118.9762 56.9463 41.1322 178.0690 937 L 4.2276 8.0524 117.7734 53.6807 42.1362 176.2276 938 N 4.4089 7.2326 118.1384 55.3205 39.1520 174.2573 939 D 4.5659 8.9550 123.0852 54.5870 40.9800 173.8391 940 R 4.3419 7.9247 117.8863 55.7994 31.0679 173.5126 941 P 5.3167 0.0000 0.0000 61.5227 33.4960 175.0700 942 I 4.4916 8.0872 119.1503 60.4686 40.7731 175.5003 943 G 3.8540 8.4500 116.1671 47.1611 0.0000 174.1120 944 S 4.6271 8.7790 119.5063 57.7973 63.5324 173.6989 945 R 4.7347 7.7587 120.4634 54.4123 33.5685 174.8488 946 K 4.7328 8.6373 122.4427 56.0041 32.9212 176.7922 947 V 4.2965 8.7653 125.7142 60.5045 33.8557 175.0048 948 K 4.9753 8.5265 122.4492 55.0657 33.9993 175.4074 949 L 5.5156 9.6668 125.1963 53.0702 44.5444 176.1998 950 S 4.6612 9.0787 116.3728 56.4223 66.5940 174.0072 951 G 4.2931 8.7922 110.4589 45.1071 0.0000 171.0015 952 P 4.4086 0.0000 0.0000 63.9246 31.9194 176.5749 953 S 4.5928 8.8960 115.3801 58.7666 62.8710 170.2193 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 875 P 0.00 4.45 0.00 2.20 2.16 0.00 3.71 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 1.88 2.00 0.00 876 T 8.83 4.34 4.32 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 1.24 0.00 0.00 877 V 8.35 4.84 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 0.82 0.00 0.00 0.94 0.00 0.00 878 I 8.83 4.72 2.08 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.97 0.99 0.00 0.00 879 K 8.86 4.75 0.00 1.86 1.71 0.00 1.57 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.37 7.81 880 V 8.81 4.84 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 0.73 0.00 0.00 1.21 0.00 0.00 881 Q 8.88 4.78 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 5.68 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 882 N 8.14 4.18 0.00 2.92 2.85 0.00 0.00 7.14 7.57 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 *884 P 0.00 4.25 0.00 2.27 2.09 0.00 3.77 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.94 0.00 885 F 9.17 3.84 0.00 2.94 3.17 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 0.00 886 T 7.90 4.54 4.29 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 1.31 0.00 0.00 887 V 8.03 4.60 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 0.68 0.00 0.00 0.95 0.00 0.00 888 S 8.94 4.80 0.00 4.06 4.03 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 0.00 0.00 0.00 0.00 889 I 8.16 3.75 1.90 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 0.78 0.94 0.00 0.00 890 D 8.13 4.39 0.00 2.81 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 891 E 8.36 4.06 0.00 2.09 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 2.35 2.37 0.00 892 I 7.69 3.83 2.08 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 1.52 0.75 1.16 0.00 0.00 893 L 8.43 4.30 0.00 1.67 1.86 0.96 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 894 D 8.46 4.64 0.00 2.99 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 0.00 895 F 8.38 4.17 0.00 3.03 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 896 F 8.23 4.95 0.00 3.42 3.16 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 0.00 0.00 0.00 0.00 897 Y 8.04 4.28 0.00 3.22 3.03 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 0.00 0.00 0.00 0.00 898 G 8.47 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 0.00 0.00 0.00 899 Y 8.34 4.49 0.00 3.30 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 900 Q 8.50 4.41 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.93 0.00 0.00 0.00 0.00 0.00 2.30 2.51 0.00 901 V 7.77 3.26 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 0.50 0.00 0.00 0.39 0.00 0.00 902 I 8.20 3.86 1.75 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 1.22 0.48 0.86 0.00 0.00 903 P 0.00 4.40 0.00 2.05 2.04 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 904 G 9.11 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 905 S 7.82 4.26 0.00 3.90 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 0.00 906 V 7.57 3.72 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 0.84 0.00 0.00 0.89 0.00 0.00 907 C 8.38 4.84 0.00 3.11 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 908 L 8.45 4.75 0.00 1.49 1.30 0.89 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 909 K 8.80 4.47 0.00 1.79 1.61 0.00 1.48 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.45 7.81 910 Y 8.50 4.82 0.00 2.77 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 0.00 911 N 8.60 4.76 0.00 2.98 3.00 0.00 0.00 5.85 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 0.00 912 E 8.62 4.21 0.00 2.11 2.14 0.00 0.00 0.00 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 2.35 0.00 913 K 8.52 4.20 0.00 2.00 1.94 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.41 7.81 914 G 8.29 3.60 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 0.00 0.00 0.00 *916 P 0.00 3.68 0.00 1.46 1.44 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 1.64 0.00 917 T 7.62 4.17 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 0.00 918 G 7.80 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 919 E 7.44 5.01 0.00 1.93 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 0.00 2.17 2.33 0.00 920 A 8.74 4.97 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 *922 V 8.38 3.93 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.93 0.00 0.00 923 A 8.32 5.26 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 924 F 9.03 5.01 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 0.00 925 E 9.37 4.00 0.00 2.20 2.05 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 2.33 2.27 0.00 926 S 7.80 4.86 0.00 4.02 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 927 R 8.48 4.01 0.00 1.90 1.96 0.00 3.18 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 928 D 8.06 4.57 0.00 2.71 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 0.00 929 E 8.51 3.87 0.00 2.19 1.94 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 0.00 2.36 2.70 0.00 930 A 8.09 2.85 1.26 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 0.00 0.00 0.00 931 T 8.24 3.70 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 1.18 0.00 0.00 932 A 8.03 3.99 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 0.00 933 A 7.74 3.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 934 V 7.55 3.55 2.21 0.00 0.00 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 0.00 0.00 0.96 0.00 0.00 935 I 7.29 3.73 1.86 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 1.52 0.63 0.91 0.00 0.00 936 D 8.21 4.49 0.00 2.62 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 0.00 937 L 8.05 4.23 0.00 1.56 1.12 0.28 0.11 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 0.00 938 N 7.23 4.41 0.00 2.89 2.76 0.00 0.00 7.13 9.28 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 0.00 939 D 8.95 4.57 0.00 2.87 2.80 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 0.00 0.00 0.00 940 R 7.92 4.34 0.00 2.12 1.90 0.00 3.17 0.00 0.00 3.02 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.56 0.00 941 P 0.00 5.32 0.00 2.19 2.06 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 942 I 8.09 4.49 1.67 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.15 0.83 0.00 0.00 943 G 8.45 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 944 S 8.78 4.63 0.00 3.98 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 945 R 7.76 4.73 0.00 1.73 1.80 0.00 3.12 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 946 K 8.64 4.73 0.00 1.64 1.82 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.62 7.81 947 V 8.77 4.30 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 0.21 0.00 0.00 0.77 0.00 0.00 948 K 8.53 4.98 0.00 1.78 1.76 0.00 1.55 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.44 7.81 949 L 9.67 5.52 0.00 1.53 1.66 1.16 0.96 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 0.00 950 S 9.08 4.66 0.00 3.84 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 0.00 951 G 8.79 4.29 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 0.00 0.00 0.00 952 P 0.00 4.41 0.00 2.09 2.09 0.00 3.74 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 953 S 8.90 4.59 0.00 3.92 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.