NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 853 S 4.4956 8.3344 117.0992 57.9321 64.0193 173.1999 854 R 4.2868 9.0906 118.7718 57.6423 32.5656 174.6598 855 K 3.9065 8.3104 118.3943 59.3852 32.8628 177.8196 856 L 3.9275 7.8207 119.9824 58.2964 41.9851 178.8659 857 L 4.0008 7.9177 118.5987 57.6280 41.4510 179.4839 858 S 4.1621 8.3134 114.2340 61.0788 63.1707 176.3465 859 A 3.9509 7.9229 123.7198 54.9804 18.0377 179.4608 860 A 3.9716 8.2583 119.4086 54.9644 18.2903 179.8536 861 K 3.8469 7.7206 118.0702 59.8115 32.4464 178.8409 862 I 3.5761 8.0064 120.4598 64.6502 37.0026 178.0859 863 L 3.9348 8.0537 120.4836 58.1244 41.9827 178.8725 864 A 3.9772 8.2237 121.0313 55.0751 18.2845 179.0713 865 D 4.2776 8.9672 118.0809 57.6932 40.9944 178.9675 866 A 4.0027 8.0461 120.7905 55.6145 18.4138 179.7693 867 T 3.8292 8.1674 114.0745 66.7042 68.5136 176.7954 868 A 3.9988 8.0669 122.6575 55.1275 18.4234 179.8486 869 K 3.9969 8.6028 117.4381 59.7520 31.7611 179.2508 870 M 4.0407 8.6103 119.2275 58.4694 31.9623 178.3943 871 V 3.8075 7.7096 117.7638 63.9182 31.9295 177.7051 872 E 4.0868 8.5283 119.4440 59.4056 29.5776 178.2997 873 A 4.1467 8.2991 120.1465 55.5378 18.2152 179.2198 874 A 4.0700 7.2427 113.6094 50.9916 18.3058 178.9800 875 K 3.8201 8.5644 123.1912 57.5489 29.6027 176.9276 876 G 4.2790 8.8951 115.1299 45.9730 0.0000 173.8796 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 853 S 8.33 4.50 0.00 3.65 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 0.00 854 R 9.09 4.29 0.00 1.87 1.88 0.00 3.16 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 855 K 8.31 3.91 0.00 1.86 1.80 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.51 7.81 856 L 7.82 3.93 0.00 1.79 1.64 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 857 L 7.92 4.00 0.00 1.94 1.70 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 858 S 8.31 4.16 0.00 4.06 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 0.00 859 A 7.92 3.95 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 860 A 8.26 3.97 1.32 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 0.00 0.00 861 K 7.72 3.85 0.00 1.98 1.92 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.43 1.47 7.81 862 I 8.01 3.58 1.95 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 1.02 0.91 0.00 0.00 863 L 8.05 3.93 0.00 1.77 1.88 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 864 A 8.22 3.98 1.36 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 0.00 0.00 0.00 865 D 8.97 4.28 0.00 2.84 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 0.00 866 A 8.05 4.00 1.38 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 0.00 0.00 0.00 867 T 8.17 3.83 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 0.00 868 A 8.07 4.00 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 0.00 869 K 8.60 4.00 0.00 1.76 1.87 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.61 7.81 870 M 8.61 4.04 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 871 V 7.71 3.81 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 0.86 0.00 0.00 0.93 0.00 0.00 872 E 8.53 4.09 0.00 2.21 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 2.35 2.48 0.00 873 A 8.30 4.15 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 874 A 7.24 4.07 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 875 K 8.56 3.82 0.00 1.88 1.73 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.33 1.41 7.81 876 G 8.90 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 0.00 0.00 0.00 0.00