NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 861 P 4.3848 0.0000 0.0000 62.1971 31.9053 178.3611 862 K 4.3492 8.5779 115.9794 55.0372 36.3221 174.4132 863 H 4.5746 8.7497 113.8495 57.0758 26.6886 176.6844 864 T 4.1497 7.3648 115.5811 64.0609 67.5477 176.0558 865 L 4.3340 7.8804 120.6379 57.0970 41.1118 178.7016 866 D 4.4475 7.9262 119.0789 56.7212 40.3630 177.5223 867 I 3.8652 7.3088 110.7386 61.1890 37.9172 176.3676 868 F 4.7215 7.9304 119.9222 57.5671 40.1585 175.7381 869 F 5.2501 7.2956 117.4413 55.8106 40.5867 174.7820 870 K 4.7542 8.5027 124.3007 53.2887 35.0216 174.3801 871 P 4.2387 0.0000 0.0000 62.9247 31.6745 176.1457 872 L 4.2811 8.3636 124.1234 54.8900 42.3477 176.7553 873 T 4.2085 8.2317 121.9347 64.0654 69.4815 173.6484 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 861 P 0.00 4.38 0.00 2.20 1.67 0.00 3.68 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 1.89 2.00 0.00 862 K 8.58 4.35 0.00 1.81 1.45 0.00 1.74 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.35 1.49 7.81 863 H 8.75 4.57 0.00 3.39 3.43 0.00 5.61 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 864 T 7.36 4.15 4.26 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 1.24 0.00 0.00 865 L 7.88 4.33 0.00 1.78 1.73 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 866 D 7.93 4.45 0.00 2.91 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 0.00 867 I 7.31 3.87 1.61 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 -0.16 0.80 0.00 0.00 868 F 7.93 4.72 0.00 2.62 2.38 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 0.00 869 F 7.30 5.25 0.00 3.22 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 0.00 870 K 8.50 4.75 0.00 1.76 1.73 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.45 7.81 871 P 0.00 4.24 0.00 2.05 2.02 0.00 3.70 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 2.05 2.11 0.00 872 L 8.36 4.28 0.00 1.59 1.59 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 873 T 8.23 4.21 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