#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iv8 n GLY 706 N 0.00 -1.15 3.63 -0.02 0.00 -1.26 -4.86 105.19 101.53 2iv8 n GLY 706 Ca 0.00 -1.69 -0.37 0.00 0.00 0.00 0.00 46.02 43.96 2iv8 n GLY 706 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2iv8 s TYR 707 N -1.65 3.28 -0.07 1.61 5.04 -1.26 -5.00 117.35 119.29 2iv8 s TYR 707 Ca 0.18 0.24 0.04 0.00 -2.44 0.00 0.00 57.07 55.10 2iv8 s TYR 707 Cb -0.00 -2.36 -0.00 0.00 0.35 0.00 0.00 41.96 39.95 2iv8 s TYR 707 CO 0.13 -0.04 -0.22 0.08 -1.34 0.00 0.00 175.55 174.15 2iv8 s VAL 708 N 1.41 1.85 0.35 3.14 1.01 -1.26 -4.91 120.40 121.98 2iv8 s VAL 708 Ca 0.09 -0.92 -0.27 0.00 0.00 0.00 0.00 61.98 60.88 2iv8 s VAL 708 Cb -0.15 -1.59 -0.09 0.00 0.00 0.00 0.00 36.38 34.55 2iv8 s VAL 708 CO 0.07 0.52 1.21 0.00 0.00 0.00 0.00 175.10 176.90 2iv8 s ALA 709 N 0.18 3.33 1.05 5.51 0.00 -1.26 -5.00 121.76 125.57 2iv8 s ALA 709 Ca -0.11 1.07 -0.11 0.00 0.00 0.00 0.00 51.96 52.80 2iv8 s ALA 709 Cb -0.15 -3.41 0.22 0.00 0.00 0.00 0.00 23.12 19.78 2iv8 s ALA 709 CO 0.06 -0.51 1.09 -2.14 0.00 0.00 0.00 175.76 174.25 2iv8 s PRO 710 N -1.95 -0.05 0.25 0.00 0.02 -1.26 -4.79 135.00 127.23 2iv8 s PRO 710 Ca 0.52 1.22 -0.30 0.00 0.02 0.00 0.00 61.00 62.45 2iv8 s PRO 710 Cb -0.35 -1.63 -0.11 0.00 0.02 0.00 0.00 34.50 32.44 2iv8 s PRO 710 CO 0.45 -3.25 1.54 0.15 -0.33 0.00 0.00 177.00 175.56 2iv8 s LYS 711 N -4.53 4.19 0.07 5.54 1.02 -1.25 -4.67 119.74 120.10 2iv8 s LYS 711 Ca 0.68 2.45 0.08 0.00 0.02 0.00 0.00 55.97 59.20 2iv8 s LYS 711 Cb -0.24 -3.08 -0.03 0.00 -0.52 0.00 0.00 37.83 33.96 2iv8 s LYS 711 CO 0.62 -0.56 -0.22 0.00 -0.92 0.00 0.00 175.35 174.27 2iv8 s ALA 712 N 0.25 1.84 -0.95 5.17 0.00 0.22 -4.75 121.76 123.54 2iv8 s ALA 712 Ca 0.64 -1.15 -0.24 0.00 0.00 0.00 0.00 51.96 51.20 2iv8 s ALA 712 Cb -0.45 -0.33 -0.00 0.00 0.00 0.00 0.00 23.12 22.34 2iv8 s ALA 712 CO 0.43 0.40 1.72 0.08 0.00 0.00 0.00 175.76 178.39 2iv8 s VAL 713 N -0.92 3.66 0.31 0.00 1.01 -1.26 0.40 120.40 123.60 2iv8 s VAL 713 Ca 0.08 -0.54 0.04 0.00 0.00 0.00 0.00 61.98 61.56 2iv8 s VAL 713 Cb -0.09 -4.49 0.09 0.00 0.00 0.00 0.00 36.38 31.89 2iv8 s VAL 713 CO 0.03 -1.40 1.78 -0.50 0.00 0.00 0.00 175.10 175.00 2iv8 h TRP 714 N 10.62 0.47 -1.81 5.22 6.55 -1.01 -3.42 115.95 132.58 2iv8 h TRP 714 Ca 0.14 -0.08 -0.20 0.00 0.95 0.00 0.00 58.89 59.70 2iv8 h TRP 714 Cb 1.01 -0.12 -0.29 0.00 -0.86 0.00 0.00 29.16 28.89 2iv8 h TRP 714 CO 1.25 0.61 -0.53 -1.17 -1.05 0.00 0.00 178.44 177.54 2iv8 s LEU 715 N -8.71 -0.68 0.15 -4.49 2.96 -1.19 -4.30 118.68 102.41 2iv8 s LEU 715 Ca -0.07 -0.27 -0.22 0.00 -0.22 0.00 0.00 54.13 53.35 2iv8 s LEU 715 Cb 0.14 1.03 -0.08 0.00 0.50 0.00 0.00 46.19 47.79 2iv8 s LEU 715 CO 0.78 -0.34 0.70 -2.16 -1.32 0.00 0.00 176.35 174.00 2iv8 s PRO 716 N 2.52 4.38 0.14 0.98 0.04 -1.26 -1.23 135.00 140.58 2iv8 s PRO 716 Ca 0.10 0.96 -0.01 0.00 0.04 0.00 0.00 61.00 62.09 2iv8 s PRO 716 Cb -0.13 -3.16 0.31 0.00 0.04 0.00 0.00 34.50 31.55 2iv8 s PRO 716 CO -0.27 0.55 0.74 0.00 0.04 0.00 0.00 177.00 178.07 2iv8 n ALA 717 N 1.42 0.19 0.09 8.56 0.00 -1.20 -0.18 120.51 129.40 2iv8 n ALA 717 Ca -0.06 0.52 0.05 0.00 0.00 0.00 0.00 53.44 53.94 2iv8 n ALA 717 Cb 0.50 -0.35 0.25 0.00 0.00 0.00 0.00 19.45 19.85 2iv8 n ALA 717 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2iv8 n VAL 718 N -4.63 1.15 -0.02 0.00 0.31 -1.26 -1.35 118.33 112.53 2iv8 n VAL 718 Ca 0.10 0.63 0.01 0.00 -0.01 0.00 0.00 64.34 65.07 2iv8 n VAL 718 Cb 0.31 -1.63 -0.06 0.00 -0.91 0.00 0.00 33.84 31.56 2iv8 n VAL 718 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2iv8 n LYS 719 N -1.80 1.28 -0.66 5.55 5.02 0.75 -4.71 118.16 123.59 2iv8 n LYS 719 Ca -0.01 -0.04 0.06 0.00 -2.02 0.00 0.00 58.31 56.30 2iv8 n LYS 719 Cb 0.15 -1.18 0.18 0.00 -0.02 0.00 0.00 35.03 34.16 2iv8 n LYS 719 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2iv8 n ALA 720 N -1.96 3.37 -3.06 7.82 0.00 -0.46 -4.99 120.51 121.22 2iv8 n ALA 720 Ca -0.05 -3.10 -0.15 0.00 0.00 0.00 0.00 53.44 50.13 2iv8 n ALA 720 Cb 0.41 -0.40 0.04 0.00 0.00 0.00 0.00 19.45 19.50 2iv8 n ALA 720 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2iv8 n LYS 721 N -0.94 -4.56 0.00 0.00 5.02 -0.90 -2.49 118.16 114.28 2iv8 n LYS 721 Ca 0.17 0.56 0.00 0.00 -2.02 0.00 0.00 58.31 57.02 2iv8 n LYS 721 Cb 0.74 -4.75 0.00 0.00 -0.02 0.00 0.00 35.03 31.00 2iv8 n LYS 721 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2iv8 n GLY 722 N -1.42 3.36 3.66 0.72 0.00 -0.92 -4.62 105.19 105.98 2iv8 n GLY 722 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 2iv8 n GLY 722 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2iv8 s LEU 723 N 0.00 4.12 0.03 0.99 2.96 -1.04 0.79 118.68 126.53 2iv8 s LEU 723 Ca 0.00 1.51 0.09 0.00 -0.22 0.00 0.00 54.13 55.51 2iv8 s LEU 723 Cb 0.00 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.12 2iv8 s LEU 723 CO 0.00 -0.75 -0.26 -0.70 -1.32 0.00 0.00 176.35 173.33 2iv8 s GLU 724 N 3.42 1.82 -0.07 1.98 2.12 0.14 -3.23 118.70 124.87 2iv8 s GLU 724 Ca 0.50 -1.04 0.01 0.00 0.36 0.00 0.00 54.97 54.80 2iv8 s GLU 724 Cb -0.18 -1.93 0.02 0.00 0.26 0.00 0.00 34.13 32.29 2iv8 s GLU 724 CO 0.12 0.51 -0.09 0.42 -0.54 0.00 0.00 175.26 175.67 2iv8 s ILE 725 N -0.75 0.95 -0.01 -3.70 1.01 -0.36 -1.80 121.20 116.54 2iv8 s ILE 725 Ca 0.11 -0.33 0.02 0.00 0.00 0.00 0.00 60.65 60.45 2iv8 s ILE 725 Cb -0.10 -0.92 -0.03 0.00 0.01 0.00 0.00 42.46 41.41 2iv8 s ILE 725 CO 0.01 0.33 -0.04 -0.44 0.00 0.00 0.00 174.94 174.80 2iv8 s SER 726 N 1.06 4.80 0.18 3.58 0.01 -1.00 -0.35 113.70 121.99 2iv8 s SER 726 Ca -0.08 -0.08 -0.09 0.00 1.31 0.00 0.00 55.95 57.02 2iv8 s SER 726 Cb -0.14 -1.18 -0.01 0.00 0.21 0.00 0.00 66.02 64.89 2iv8 s SER 726 CO -0.01 0.30 0.29 -0.83 0.41 0.00 0.00 173.24 173.40 2iv8 s GLY 727 N -1.36 0.59 -0.30 3.44 0.00 0.16 -1.68 107.32 108.18 2iv8 s GLY 727 Ca 0.17 -0.97 -0.25 0.00 0.00 0.00 0.00 44.72 43.67 2iv8 s GLY 727 CO 0.07 -0.87 1.47 -1.08 0.00 0.00 0.00 173.10 172.70 2iv8 s THR 728 N -3.99 0.00 0.05 0.90 -1.32 -1.00 0.69 115.64 110.96 2iv8 s THR 728 Ca 0.20 0.00 -0.00 0.00 -1.21 0.00 0.00 61.69 60.68 2iv8 s THR 728 Cb 0.03 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.98 2iv8 s THR 728 CO 0.03 0.00 0.19 -0.36 -2.21 0.00 0.00 174.62 172.26 2iv8 s PHE 729 N 0.06 3.49 0.05 9.09 0.40 -1.26 -0.78 117.98 129.02 2iv8 s PHE 729 Ca 0.07 0.25 0.05 0.00 -0.60 0.00 0.00 56.93 56.70 2iv8 s PHE 729 Cb -0.05 -1.75 -0.02 0.00 0.51 0.00 0.00 43.02 41.70 2iv8 s PHE 729 CO -0.16 0.59 -0.15 0.95 0.70 0.00 0.00 175.22 177.15 2iv8 s THR 730 N -1.47 1.19 -0.18 0.64 -4.23 0.15 -4.55 115.64 107.19 2iv8 s THR 730 Ca 0.33 -1.13 -0.02 0.00 -1.18 0.00 0.00 61.69 59.69 2iv8 s THR 730 Cb -0.13 -1.09 -0.01 0.00 1.34 0.00 0.00 72.50 72.61 2iv8 s THR 730 CO 0.26 -0.05 -0.08 -2.28 -0.54 0.00 0.00 174.62 171.93 2iv8 s HIS 731 N -0.98 2.91 -0.02 3.99 2.46 -1.26 -0.29 115.29 122.11 2iv8 s HIS 731 Ca 0.01 -0.76 0.01 0.00 0.47 0.00 0.00 55.06 54.79 2iv8 s HIS 731 Cb -0.09 -1.98 0.01 0.00 -0.13 0.00 0.00 32.58 30.40 2iv8 s HIS 731 CO 0.02 -0.36 -0.02 1.03 -2.47 0.00 0.00 174.74 172.93 2iv8 s ARG 732 N 0.89 0.40 -0.45 2.88 0.52 -0.81 -4.67 118.95 117.72 2iv8 s ARG 732 Ca -0.02 -0.05 -0.09 0.00 -0.52 0.00 0.00 55.73 55.05 2iv8 s ARG 732 Cb -0.15 -0.47 0.01 0.00 0.52 0.00 0.00 34.95 34.86 2iv8 s ARG 732 CO 0.01 -0.03 0.27 0.00 0.02 0.00 0.00 175.30 175.57 2iv8 n GLN 733 N 3.62 -0.68 -3.39 3.54 10.64 -1.26 -0.06 117.38 129.79 2iv8 n GLN 733 Ca -0.21 -0.04 -0.25 0.00 -1.83 0.00 0.00 57.00 54.67 2iv8 n GLN 733 Cb 0.54 -0.67 0.01 0.00 -0.86 0.00 0.00 30.24 29.27 2iv8 n GLN 733 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2iv8 n GLY 734 N -1.25 -0.63 3.45 2.61 0.00 -1.26 -4.96 105.19 103.15 2iv8 n GLY 734 Ca -0.08 0.67 -0.07 0.00 0.00 0.00 0.00 46.02 46.54 2iv8 n GLY 734 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2iv8 s HIS 735 N -2.22 -0.93 0.22 1.61 4.02 0.91 -5.02 115.29 113.89 2iv8 s HIS 735 Ca 0.12 1.79 -0.08 0.00 1.02 0.00 0.00 55.06 57.91 2iv8 s HIS 735 Cb -0.01 0.49 -0.07 0.00 -1.02 0.00 0.00 32.58 31.97 2iv8 s HIS 735 CO 0.74 -0.49 0.52 0.42 1.02 0.00 0.00 174.74 176.95 2iv8 s ILE 736 N 2.03 4.98 -0.04 0.60 1.01 -1.26 -1.93 121.20 126.59 2iv8 s ILE 736 Ca -0.07 0.35 -0.03 0.00 0.00 0.00 0.00 60.65 60.89 2iv8 s ILE 736 Cb -0.09 -3.63 0.02 0.00 0.01 0.00 0.00 42.46 38.76 2iv8 s ILE 736 CO -0.16 -0.09 0.11 -0.31 0.00 0.00 0.00 174.94 174.49 2iv8 s TYR 737 N -1.83 -0.12 -0.51 3.97 1.51 0.61 -2.27 117.35 118.71 2iv8 s TYR 737 Ca 0.46 0.31 -0.19 0.00 -1.01 0.00 0.00 57.07 56.64 2iv8 s TYR 737 Cb -0.11 0.00 0.06 0.00 -0.11 0.00 0.00 41.96 41.80 2iv8 s TYR 737 CO 0.23 -0.08 0.61 1.41 -1.11 0.00 0.00 175.55 176.61 2iv8 s MET 738 N 0.31 3.11 -0.55 -0.62 -2.45 0.42 0.32 119.30 119.84 2iv8 s MET 738 Ca -0.02 -0.94 -0.26 0.00 -1.25 0.00 0.00 55.69 53.22 2iv8 s MET 738 Cb -0.03 -4.11 0.04 0.00 1.25 0.00 0.00 34.83 31.97 2iv8 s MET 738 CO -0.01 -1.22 1.03 -1.21 1.05 0.00 0.00 175.02 174.65 2iv8 s GLU 739 N 2.56 3.42 0.49 4.11 0.41 0.04 0.64 118.70 130.35 2iv8 s GLU 739 Ca 0.14 -0.04 0.06 0.00 -0.41 0.00 0.00 54.97 54.72 2iv8 s GLU 739 Cb -0.20 -4.03 0.00 0.00 -1.78 0.00 0.00 34.13 28.13 2iv8 s GLU 739 CO 0.11 -1.52 0.32 -1.64 -0.49 0.00 0.00 175.26 172.04 2iv8 s MET 740 N 4.27 2.30 -0.21 1.61 -1.94 -0.97 -2.38 119.30 121.97 2iv8 s MET 740 Ca 0.35 -1.90 -0.05 0.00 -1.71 0.00 0.00 55.69 52.38 2iv8 s MET 740 Cb -0.11 -2.09 0.11 0.00 2.01 0.00 0.00 34.83 34.75 2iv8 s MET 740 CO 0.22 -0.40 0.41 1.21 -0.01 0.00 0.00 175.02 176.45 2iv8 s ASN 741 N -4.14 -0.12 0.11 3.03 3.84 -0.67 -2.25 114.94 114.74 2iv8 s ASN 741 Ca 0.37 0.74 -0.13 0.00 0.21 0.00 0.00 52.86 54.05 2iv8 s ASN 741 Cb -0.01 1.29 -0.06 0.00 -0.55 0.00 0.00 41.25 41.92 2iv8 s ASN 741 CO 0.22 -0.25 0.48 -0.36 -2.79 0.00 0.00 177.10 174.39 2iv8 s PHE 742 N 2.60 3.61 -0.12 0.43 0.40 0.92 -2.36 117.98 123.46 2iv8 s PHE 742 Ca 0.04 0.95 -0.05 0.00 -0.60 0.00 0.00 56.93 57.26 2iv8 s PHE 742 Cb -0.13 -2.28 0.06 0.00 0.51 0.00 0.00 43.02 41.18 2iv8 s PHE 742 CO -0.14 0.49 0.26 0.99 0.70 0.00 0.00 175.22 177.52 2iv8 s THR 743 N -1.40 -0.24 -0.57 0.64 2.01 -0.74 -0.68 115.64 114.66 2iv8 s THR 743 Ca 0.34 0.21 -0.17 0.00 0.31 0.00 0.00 61.69 62.39 2iv8 s THR 743 Cb -0.15 -0.43 0.13 0.00 0.01 0.00 0.00 72.50 72.06 2iv8 s THR 743 CO 0.18 0.09 0.57 0.21 -0.69 0.00 0.00 174.62 174.98 2iv8 s ASN 744 N 1.87 6.22 0.00 3.53 2.47 -1.18 0.23 114.94 128.08 2iv8 s ASN 744 Ca -0.04 -1.76 0.23 0.00 0.42 0.00 0.00 52.86 51.71 2iv8 s ASN 744 Cb -0.11 -2.23 0.60 0.00 -1.45 0.00 0.00 41.25 38.05 2iv8 s ASN 744 CO -0.09 -0.91 1.48 0.29 -3.72 0.00 0.00 177.10 174.15 2iv8 n LYS 745 N 5.45 2.07 -0.04 0.43 5.02 0.24 0.80 118.16 132.12 2iv8 n LYS 745 Ca -0.11 -1.60 0.00 0.00 -2.02 0.00 0.00 58.31 54.58 2iv8 n LYS 745 Cb 0.41 -1.45 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 2iv8 n LYS 745 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2iv8 n ALA 746 N 0.84 0.00 -0.57 7.82 0.00 -1.24 -4.88 120.51 122.48 2iv8 n ALA 746 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2iv8 n ALA 746 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 2iv8 n ALA 746 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2iv8 n LEU 747 N 0.00 0.35 0.00 0.00 4.77 -1.26 -4.60 117.00 116.27 2iv8 n LEU 747 Ca 0.00 -0.37 -0.18 0.00 -0.03 0.00 0.00 56.01 55.44 2iv8 n LEU 747 Cb 0.00 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.20 2iv8 n LEU 747 CO 0.00 0.09 0.49 0.00 -1.33 0.00 0.00 177.39 176.63 2iv8 n GLN 748 N -0.03 -0.40 -4.19 3.23 3.00 -1.26 -4.92 117.38 112.81 2iv8 n GLN 748 Ca 0.00 -1.57 -0.23 0.00 -0.01 0.00 0.00 57.00 55.19 2iv8 n GLN 748 Cb 0.14 -0.69 -0.07 0.00 0.00 0.00 0.00 30.24 29.62 2iv8 n GLN 748 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.06 173.68 2iv8 s HIS 749 N -2.48 2.69 -0.17 1.08 -3.43 -1.26 -3.81 115.29 107.91 2iv8 s HIS 749 Ca 0.47 -0.34 0.00 0.00 -0.80 0.00 0.00 55.06 54.39 2iv8 s HIS 749 Cb -0.02 -1.49 0.04 0.00 -1.43 0.00 0.00 32.58 29.68 2iv8 s HIS 749 CO 0.32 0.44 -0.09 -1.64 -2.00 0.00 0.00 174.74 171.77 2iv8 s MET 750 N -3.78 1.81 0.20 -0.38 -1.94 -0.31 -4.88 119.30 110.02 2iv8 s MET 750 Ca 0.35 -0.60 0.00 0.00 -1.71 0.00 0.00 55.69 53.74 2iv8 s MET 750 Cb -0.03 -2.11 0.00 0.00 2.01 0.00 0.00 34.83 34.70 2iv8 s MET 750 CO 0.21 -0.37 0.00 0.25 -0.01 0.00 0.00 175.02 175.10 2iv8 n THR 751 N 4.80 0.00 -3.49 2.05 -2.24 -1.26 0.14 114.28 114.27 2iv8 n THR 751 Ca -0.14 -0.94 -0.23 0.00 -2.27 0.00 0.00 64.05 60.48 2iv8 n THR 751 Cb 0.48 0.18 0.06 0.00 -2.10 0.00 0.00 70.33 68.95 2iv8 n THR 751 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2iv8 n ASP 752 N -1.12 -5.20 -4.64 3.42 8.00 -1.26 -1.65 116.55 114.10 2iv8 n ASP 752 Ca -0.08 -0.85 -0.36 0.00 0.71 0.00 0.00 54.79 54.21 2iv8 n ASP 752 Cb 0.25 -4.31 -0.10 0.00 -0.02 0.00 0.00 41.12 36.95 2iv8 n ASP 752 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2iv8 s PHE 753 N -3.46 3.29 0.04 1.24 0.08 -1.26 -3.09 117.98 114.83 2iv8 s PHE 753 Ca 0.39 0.17 -0.00 0.00 0.12 0.00 0.00 56.93 57.60 2iv8 s PHE 753 Cb -0.09 -2.25 -0.03 0.00 -0.57 0.00 0.00 43.02 40.07 2iv8 s PHE 753 CO 0.80 0.05 -0.03 0.00 -0.10 0.00 0.00 175.22 175.93 2iv8 s ALA 754 N 1.03 0.43 -0.03 5.36 0.00 -1.00 -4.71 121.76 122.84 2iv8 s ALA 754 Ca 0.07 -1.02 0.04 0.00 0.00 0.00 0.00 51.96 51.05 2iv8 s ALA 754 Cb -0.14 0.22 -0.01 0.00 0.00 0.00 0.00 23.12 23.20 2iv8 s ALA 754 CO 0.04 -0.28 -0.15 -1.50 0.00 0.00 0.00 175.76 173.87 2iv8 s ILE 755 N -3.07 1.20 0.03 0.00 2.07 -1.26 0.36 121.20 120.53 2iv8 s ILE 755 Ca -0.00 -0.62 0.05 0.00 -1.41 0.00 0.00 60.65 58.68 2iv8 s ILE 755 Cb 0.02 -1.02 -0.02 0.00 0.13 0.00 0.00 42.46 41.57 2iv8 s ILE 755 CO -0.07 0.35 -0.16 -1.58 -1.91 0.00 0.00 174.94 171.57 2iv8 s GLN 756 N -0.11 1.14 -0.07 3.50 0.74 0.59 -4.93 119.66 120.52 2iv8 s GLN 756 Ca 0.01 -0.75 0.01 0.00 0.05 0.00 0.00 55.36 54.67 2iv8 s GLN 756 Cb -0.08 -1.16 -0.03 0.00 1.10 0.00 0.00 33.01 32.83 2iv8 s GLN 756 CO 0.01 0.30 -0.07 -0.06 -0.55 0.00 0.00 175.29 174.91 2iv8 s PHE 757 N -0.71 2.92 0.78 1.67 0.40 -1.26 -0.41 117.98 121.37 2iv8 s PHE 757 Ca 0.04 -0.00 -0.11 0.00 -0.60 0.00 0.00 56.93 56.26 2iv8 s PHE 757 Cb -0.08 -1.71 0.06 0.00 0.51 0.00 0.00 43.02 41.80 2iv8 s PHE 757 CO 0.01 0.31 1.09 1.21 0.70 0.00 0.00 175.22 178.54 2iv8 s ASN 758 N -0.77 4.65 0.57 1.36 2.47 -0.48 -4.97 114.94 117.78 2iv8 s ASN 758 Ca 0.12 1.35 -0.21 0.00 0.42 0.00 0.00 52.86 54.54 2iv8 s ASN 758 Cb -0.11 -2.11 -0.04 0.00 -1.45 0.00 0.00 41.25 37.54 2iv8 s ASN 758 CO 0.01 -1.88 1.26 0.29 -3.72 0.00 0.00 177.10 173.07 2iv8 n LYS 759 N -3.38 1.42 -1.19 0.43 5.02 -1.26 -4.85 118.16 114.35 2iv8 n LYS 759 Ca 0.07 0.53 0.00 0.00 -2.02 0.00 0.00 58.31 56.89 2iv8 n LYS 759 Cb 0.56 -2.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.10 2iv8 n LYS 759 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2iv8 n ASN 760 N -1.07 0.00 -0.73 4.39 0.23 -1.26 -4.71 115.26 112.12 2iv8 n ASN 760 Ca 0.12 -0.70 0.13 0.00 -0.53 0.00 0.00 54.58 53.60 2iv8 n ASN 760 Cb 0.45 0.00 0.29 0.00 -2.08 0.00 0.00 39.78 38.45 2iv8 n ASN 760 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2iv8 n SER 761 N -1.68 2.29 -1.76 0.53 3.41 -1.14 0.30 113.62 115.56 2iv8 n SER 761 Ca 0.00 -1.75 0.00 0.00 -0.26 0.00 0.00 58.87 56.86 2iv8 n SER 761 Cb 0.00 0.01 0.06 0.00 -0.26 0.00 0.00 64.21 64.02 2iv8 n SER 761 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2iv8 n PHE 762 N 0.77 0.62 -2.45 7.33 3.72 -1.26 -4.90 117.46 121.29 2iv8 n PHE 762 Ca 0.16 -1.29 -0.11 0.00 -0.05 0.00 0.00 57.45 56.16 2iv8 n PHE 762 Cb 0.48 -0.21 -0.01 0.00 -0.94 0.00 0.00 39.48 38.81 2iv8 n PHE 762 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2iv8 n GLY 763 N -0.20 -0.50 3.69 1.37 0.00 -1.24 -4.72 105.19 103.59 2iv8 n GLY 763 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2iv8 n GLY 763 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2iv8 s VAL 764 N -2.57 4.50 0.01 1.61 1.01 -1.26 -0.61 120.40 123.09 2iv8 s VAL 764 Ca 0.00 1.79 -0.07 0.00 0.00 0.00 0.00 61.98 63.71 2iv8 s VAL 764 Cb -0.00 -4.15 -0.00 0.00 0.00 0.00 0.00 36.38 32.22 2iv8 s VAL 764 CO 0.00 -0.00 0.13 0.27 0.00 0.00 0.00 175.10 175.50 2iv8 s ILE 765 N 2.15 0.10 0.47 2.22 -5.25 -0.29 -4.78 121.20 115.82 2iv8 s ILE 765 Ca 0.52 -0.81 -0.25 0.00 -0.99 0.00 0.00 60.65 59.13 2iv8 s ILE 765 Cb -0.22 -0.57 -0.08 0.00 2.95 0.00 0.00 42.46 44.55 2iv8 s ILE 765 CO 0.20 -0.44 1.41 -2.84 -1.79 0.00 0.00 174.94 171.47 2iv8 s PRO 766 N -1.77 3.60 -0.01 0.37 0.02 -1.26 -0.57 135.00 135.38 2iv8 s PRO 766 Ca -0.12 2.36 0.09 0.00 0.02 0.00 0.00 61.00 63.36 2iv8 s PRO 766 Cb -0.06 -2.58 -0.12 0.00 0.02 0.00 0.00 34.50 31.76 2iv8 s PRO 766 CO -0.00 -0.87 0.29 -1.13 -0.33 0.00 0.00 177.00 174.96 2iv8 n SER 767 N -0.34 1.63 -4.38 2.53 3.41 -0.50 -4.78 113.62 111.20 2iv8 n SER 767 Ca 0.06 -0.36 -0.20 0.00 -0.26 0.00 0.00 58.87 58.11 2iv8 n SER 767 Cb 0.43 1.20 -0.10 0.00 -0.26 0.00 0.00 64.21 65.48 2iv8 n SER 767 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2iv8 s THR 768 N -2.23 1.95 0.27 6.66 -4.23 -1.26 -5.05 115.64 111.75 2iv8 s THR 768 Ca 0.00 -2.27 -0.29 0.00 -1.18 0.00 0.00 61.69 57.96 2iv8 s THR 768 Cb 0.06 -2.12 -0.14 0.00 1.34 0.00 0.00 72.50 71.64 2iv8 s THR 768 CO 0.37 -0.54 1.02 -2.65 -0.54 0.00 0.00 174.62 172.28 2iv8 n PRO 769 N -0.45 1.29 -1.59 3.99 -0.02 -1.26 -4.93 135.00 132.03 2iv8 n PRO 769 Ca -0.07 0.45 -0.45 0.00 -2.02 0.00 0.00 63.50 61.42 2iv8 n PRO 769 Cb 0.60 -1.83 -0.02 0.00 -0.02 0.00 0.00 33.50 32.24 2iv8 n PRO 769 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2iv8 n LEU 770 N 1.37 1.79 -4.40 2.45 7.94 -1.26 -4.86 117.00 120.03 2iv8 n LEU 770 Ca 0.11 1.18 -0.45 0.00 -1.11 0.00 0.00 56.01 55.74 2iv8 n LEU 770 Cb 0.31 -1.29 -0.02 0.00 0.53 0.00 0.00 43.42 42.95 2iv8 n LEU 770 CO 0.60 -1.40 0.80 0.00 -1.11 0.00 0.00 177.39 176.28 2iv8 s ALA 771 N -1.06 3.73 -0.29 1.96 0.00 -1.26 -4.91 121.76 119.93 2iv8 s ALA 771 Ca 0.59 -3.06 0.04 0.00 0.00 0.00 0.00 51.96 49.53 2iv8 s ALA 771 Cb -0.70 -3.84 0.20 0.00 0.00 0.00 0.00 23.12 18.77 2iv8 s ALA 771 CO 0.60 -2.68 0.60 0.42 0.00 0.00 0.00 175.76 174.70 2iv8 s ILE 772 N 1.52 -0.99 -0.15 0.00 1.01 -1.26 -4.85 121.20 116.49 2iv8 s ILE 772 Ca 0.28 0.00 0.14 0.00 0.00 0.00 0.00 60.65 61.07 2iv8 s ILE 772 Cb -0.07 -0.99 -0.20 0.00 0.01 0.00 0.00 42.46 41.22 2iv8 s ILE 772 CO -0.09 0.00 0.06 1.41 0.00 0.00 0.00 174.94 176.33 2iv8 n HIS 773 N 5.42 0.00 -3.24 3.97 8.25 -1.26 -4.81 115.22 123.54 2iv8 n HIS 773 Ca 0.03 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.17 2iv8 n HIS 773 Cb 0.53 -0.77 -0.06 0.00 1.12 0.00 0.00 29.99 30.82 2iv8 n HIS 773 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2iv8 s THR 774 N -2.40 4.77 0.32 1.59 2.01 -1.26 -5.05 115.64 115.62 2iv8 s THR 774 Ca -0.08 0.79 -0.26 0.00 0.31 0.00 0.00 61.69 62.45 2iv8 s THR 774 Cb 0.05 -3.63 -0.14 0.00 0.01 0.00 0.00 72.50 68.79 2iv8 s THR 774 CO 0.65 -0.11 0.79 -2.65 -0.69 0.00 0.00 174.62 172.60 2iv8 n PRO 775 N -0.20 0.87 -3.37 4.92 -0.02 -1.26 -4.80 135.00 131.15 2iv8 n PRO 775 Ca 0.02 0.31 -0.38 0.00 -2.02 0.00 0.00 63.50 61.43 2iv8 n PRO 775 Cb 0.53 -1.60 -0.07 0.00 -0.02 0.00 0.00 33.50 32.34 2iv8 n PRO 775 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2iv8 s LEU 776 N 1.23 4.19 0.05 2.45 2.96 0.36 -4.88 118.68 125.05 2iv8 s LEU 776 Ca 0.61 0.61 -0.18 0.00 -0.22 0.00 0.00 54.13 54.95 2iv8 s LEU 776 Cb -0.71 -2.57 -0.06 0.00 0.50 0.00 0.00 46.19 43.35 2iv8 s LEU 776 CO 0.58 -0.06 0.53 -0.04 -1.32 0.00 0.00 176.35 176.05 2iv8 s MET 777 N 1.12 4.14 -0.20 1.98 -1.94 -1.26 -1.16 119.30 121.98 2iv8 s MET 777 Ca 0.21 0.65 -0.17 0.00 -1.71 0.00 0.00 55.69 54.67 2iv8 s MET 777 Cb -0.15 -3.24 -0.08 0.00 2.01 0.00 0.00 34.83 33.37 2iv8 s MET 777 CO 0.08 0.63 0.81 -2.30 -0.01 0.00 0.00 175.02 174.23 2iv8 n PRO 778 N 1.84 0.00 0.00 2.03 -0.02 -1.25 -0.78 135.00 136.82 2iv8 n PRO 778 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 2iv8 n PRO 778 Cb 0.51 -0.59 0.00 0.00 -0.02 0.00 0.00 33.50 33.40 2iv8 n PRO 778 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2iv8 n ASN 779 N 2.76 0.00 -4.68 2.55 3.02 0.24 -5.02 115.26 114.14 2iv8 n ASN 779 Ca 0.20 0.00 -0.47 0.00 -0.03 0.00 0.00 54.58 54.29 2iv8 n ASN 779 Cb -0.02 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.11 2iv8 n ASN 779 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2iv8 n GLN 780 N -1.38 2.24 -4.76 3.52 6.02 0.04 -4.74 117.38 118.32 2iv8 n GLN 780 Ca 0.00 0.81 -0.33 0.00 -0.01 0.00 0.00 57.00 57.48 2iv8 n GLN 780 Cb 0.00 -2.64 -0.14 0.00 1.02 0.00 0.00 30.24 28.48 2iv8 n GLN 780 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2iv8 s SER 781 N 2.64 4.08 0.02 1.08 0.15 -1.26 -3.11 113.70 117.30 2iv8 s SER 781 Ca 0.86 -0.29 0.01 0.00 0.70 0.00 0.00 55.95 57.23 2iv8 s SER 781 Cb -0.66 -1.54 -0.01 0.00 -1.71 0.00 0.00 66.02 62.09 2iv8 s SER 781 CO 0.44 0.19 -0.05 0.27 1.20 0.00 0.00 173.24 175.29 2iv8 s ILE 782 N 0.22 0.38 -0.07 6.45 -4.36 0.14 -4.97 121.20 118.99 2iv8 s ILE 782 Ca -0.08 -0.69 -0.25 0.00 -0.26 0.00 0.00 60.65 59.38 2iv8 s ILE 782 Cb -0.15 -0.42 -0.03 0.00 1.25 0.00 0.00 42.46 43.11 2iv8 s ILE 782 CO 0.05 -0.21 0.76 -1.81 0.24 0.00 0.00 174.94 173.96 2iv8 s ASP 783 N -0.97 7.03 0.19 4.36 1.01 -1.26 -0.05 116.67 126.98 2iv8 s ASP 783 Ca -0.06 1.25 0.06 0.00 0.71 0.00 0.00 52.55 54.50 2iv8 s ASP 783 Cb -0.07 -2.44 -0.04 0.00 1.01 0.00 0.00 42.92 41.39 2iv8 s ASP 783 CO -0.00 -0.18 0.16 -0.69 0.21 0.00 0.00 175.17 174.67 2iv8 s VAL 784 N 1.04 4.50 -0.17 -1.27 1.01 -0.95 -4.97 120.40 119.60 2iv8 s VAL 784 Ca 0.40 -1.16 -0.01 0.00 0.00 0.00 0.00 61.98 61.20 2iv8 s VAL 784 Cb -0.18 -3.34 0.05 0.00 0.00 0.00 0.00 36.38 32.91 2iv8 s VAL 784 CO 0.19 -0.18 -0.02 -0.44 0.00 0.00 0.00 175.10 174.65 2iv8 s SER 785 N -3.32 2.76 -0.46 3.32 0.01 -1.26 -2.28 113.70 112.47 2iv8 s SER 785 Ca 0.32 -0.67 -0.15 0.00 1.31 0.00 0.00 55.95 56.75 2iv8 s SER 785 Cb -0.09 -0.78 0.07 0.00 0.21 0.00 0.00 66.02 65.43 2iv8 s SER 785 CO 0.24 -0.22 0.38 -0.22 0.41 0.00 0.00 173.24 173.83 2iv8 s LEU 786 N 1.73 5.56 0.40 2.44 2.96 0.21 -4.77 118.68 127.21 2iv8 s LEU 786 Ca 0.00 -1.29 -0.26 0.00 -0.22 0.00 0.00 54.13 52.36 2iv8 s LEU 786 Cb -0.16 -2.18 -0.09 0.00 0.50 0.00 0.00 46.19 44.27 2iv8 s LEU 786 CO -0.07 -0.62 1.32 -2.16 -1.32 0.00 0.00 176.35 173.49 2iv8 s PRO 787 N 1.64 3.98 0.12 0.98 0.04 -1.26 -0.43 135.00 140.07 2iv8 s PRO 787 Ca 0.04 2.19 0.04 0.00 0.04 0.00 0.00 61.00 63.31 2iv8 s PRO 787 Cb -0.24 -2.78 -0.04 0.00 0.04 0.00 0.00 34.50 31.48 2iv8 s PRO 787 CO 0.07 -0.49 -0.10 -0.51 0.04 0.00 0.00 177.00 176.01 2iv8 s LEU 788 N -2.39 2.49 0.00 -3.56 1.43 -0.96 -1.40 118.68 114.28 2iv8 s LEU 788 Ca 0.56 -0.94 0.05 0.00 -1.03 0.00 0.00 54.13 52.77 2iv8 s LEU 788 Cb -0.39 -0.28 -0.02 0.00 0.03 0.00 0.00 46.19 45.53 2iv8 s LEU 788 CO 0.50 -0.33 0.16 -0.46 0.23 0.00 0.00 176.35 176.45 2iv8 n ASN 789 N 0.09 0.36 -0.85 2.29 0.23 0.26 -4.00 115.26 113.63 2iv8 n ASN 789 Ca -0.13 -2.71 0.01 0.00 -0.53 0.00 0.00 54.58 51.22 2iv8 n ASN 789 Cb 0.60 1.05 0.20 0.00 -2.08 0.00 0.00 39.78 39.55 2iv8 n ASN 789 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 2iv8 n THR 790 N -0.62 2.36 0.54 5.53 -2.24 -1.26 -1.14 114.28 117.46 2iv8 n THR 790 Ca 0.00 -2.90 0.04 0.00 -2.27 0.00 0.00 64.05 58.92 2iv8 n THR 790 Cb 0.48 -0.28 0.16 0.00 -2.10 0.00 0.00 70.33 68.59 2iv8 n THR 790 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2iv8 n LEU 791 N -1.12 2.47 0.00 3.22 4.77 -1.24 -4.62 117.00 120.48 2iv8 n LEU 791 Ca 0.26 -1.24 -0.20 0.00 -0.03 0.00 0.00 56.01 54.80 2iv8 n LEU 791 Cb 0.86 -0.41 0.14 0.00 -2.33 0.00 0.00 43.42 41.68 2iv8 n LEU 791 CO 0.08 0.43 0.56 0.61 -1.33 0.00 0.00 177.39 177.74 2iv8 n GLY 792 N 0.63 -1.57 3.83 -0.72 0.00 0.22 -5.06 105.19 102.51 2iv8 n GLY 792 Ca 0.12 -1.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.18 2iv8 n GLY 792 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2iv8 s PRO 793 N -4.91 1.58 -0.01 1.61 0.04 -1.26 -4.62 135.00 127.44 2iv8 s PRO 793 Ca 0.50 0.27 0.01 0.00 0.04 0.00 0.00 61.00 61.82 2iv8 s PRO 793 Cb -0.02 -1.89 -0.00 0.00 0.04 0.00 0.00 34.50 32.63 2iv8 s PRO 793 CO 0.36 -1.89 -0.04 0.08 0.04 0.00 0.00 177.00 175.54 2iv8 s VAL 794 N -3.37 0.37 -0.17 -0.36 1.01 -1.26 -3.71 120.40 112.91 2iv8 s VAL 794 Ca 0.63 -0.18 -0.15 0.00 0.00 0.00 0.00 61.98 62.27 2iv8 s VAL 794 Cb -0.13 -0.33 0.04 0.00 0.00 0.00 0.00 36.38 35.96 2iv8 s VAL 794 CO 0.52 0.12 0.45 -0.04 0.00 0.00 0.00 175.10 176.15 2iv8 s MET 795 N 0.02 0.52 -0.19 2.72 -1.94 0.15 -4.82 119.30 115.75 2iv8 s MET 795 Ca 0.00 0.64 -0.28 0.00 -1.71 0.00 0.00 55.69 54.34 2iv8 s MET 795 Cb -0.03 0.25 -0.05 0.00 2.01 0.00 0.00 34.83 37.00 2iv8 s MET 795 CO -0.00 -0.07 2.20 1.17 -0.01 0.00 0.00 175.02 178.31 2iv8 n LYS 796 N 2.89 2.05 -3.33 2.03 4.81 -1.26 -2.89 118.16 122.46 2iv8 n LYS 796 Ca -0.14 0.58 -0.27 0.00 -0.87 0.00 0.00 58.31 57.62 2iv8 n LYS 796 Cb 0.57 -3.22 -0.02 0.00 0.02 0.00 0.00 35.03 32.37 2iv8 n LYS 796 CO 0.00 0.00 0.00 1.41 1.17 0.00 0.00 177.40 179.98 2iv8 s MET 797 N 6.19 3.58 -0.04 1.64 -2.45 -1.26 -4.95 119.30 122.00 2iv8 s MET 797 Ca 1.00 -0.09 -0.01 0.00 -1.25 0.00 0.00 55.69 55.34 2iv8 s MET 797 Cb -0.34 -2.65 0.03 0.00 1.25 0.00 0.00 34.83 33.12 2iv8 s MET 797 CO 0.36 0.18 0.02 -2.00 1.05 0.00 0.00 175.02 174.63 2iv8 s GLU 798 N -3.81 0.21 0.90 4.11 2.56 -1.26 -3.17 118.70 118.25 2iv8 s GLU 798 Ca 0.43 0.19 -0.13 0.00 0.00 0.00 0.00 54.97 55.46 2iv8 s GLU 798 Cb -0.10 -0.58 0.05 0.00 2.00 0.00 0.00 34.13 35.49 2iv8 s GLU 798 CO 0.32 -0.24 0.62 -2.30 -0.56 0.00 0.00 175.26 173.11 2iv8 n PRO 799 N 4.76 -0.18 0.10 4.30 -0.02 -1.26 -4.94 135.00 137.76 2iv8 n PRO 799 Ca -0.14 -0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.44 2iv8 n PRO 799 Cb 0.50 -2.00 0.58 0.00 -0.02 0.00 0.00 33.50 32.57 2iv8 n PRO 799 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2iv8 h LEU 800 N -1.37 0.16 -3.66 2.45 5.85 -1.96 -2.62 115.31 114.16 2iv8 h LEU 800 Ca -0.44 -0.00 -0.31 0.00 0.84 0.00 0.00 57.88 57.97 2iv8 h LEU 800 Cb 1.29 -0.04 -0.19 0.00 0.37 0.00 0.00 40.66 42.10 2iv8 h LEU 800 CO 0.38 0.11 0.27 -0.46 -0.34 0.00 0.00 178.44 178.40 2iv8 n ASN 801 N -4.48 3.39 -4.82 1.25 6.94 -1.26 -4.28 115.26 111.99 2iv8 n ASN 801 Ca 0.03 -3.59 -0.38 0.00 -0.02 0.00 0.00 54.58 50.61 2iv8 n ASN 801 Cb 0.23 -0.73 -0.06 0.00 -2.36 0.00 0.00 39.78 36.86 2iv8 n ASN 801 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 2iv8 s ASN 802 N -1.80 6.98 -0.24 0.53 2.47 -0.99 0.01 114.94 121.89 2iv8 s ASN 802 Ca 0.51 1.16 0.01 0.00 0.42 0.00 0.00 52.86 54.96 2iv8 s ASN 802 Cb 0.44 -2.32 0.04 0.00 -1.45 0.00 0.00 41.25 37.96 2iv8 s ASN 802 CO 0.07 0.29 -0.11 -0.22 -3.72 0.00 0.00 177.10 173.41 2iv8 s LEU 803 N -1.09 3.13 0.09 3.21 2.96 0.13 -4.81 118.68 122.30 2iv8 s LEU 803 Ca 0.27 -1.09 -0.29 0.00 -0.22 0.00 0.00 54.13 52.80 2iv8 s LEU 803 Cb -0.18 -1.58 -0.06 0.00 0.50 0.00 0.00 46.19 44.87 2iv8 s LEU 803 CO 0.17 -0.14 0.91 -1.10 -1.32 0.00 0.00 176.35 174.87 2iv8 s GLN 804 N 1.21 4.64 -0.04 1.98 -0.21 -1.26 -2.67 119.66 123.32 2iv8 s GLN 804 Ca -0.03 1.35 -0.01 0.00 0.02 0.00 0.00 55.36 56.69 2iv8 s GLN 804 Cb -0.18 -3.37 0.03 0.00 1.00 0.00 0.00 33.01 30.49 2iv8 s GLN 804 CO -0.06 0.23 0.02 0.08 -2.12 0.00 0.00 175.29 173.44 2iv8 s VAL 805 N -0.02 0.07 -0.28 1.09 1.01 -1.06 -1.38 120.40 119.83 2iv8 s VAL 805 Ca 0.45 0.22 -0.18 0.00 0.00 0.00 0.00 61.98 62.47 2iv8 s VAL 805 Cb -0.23 -0.24 -0.02 0.00 0.00 0.00 0.00 36.38 35.90 2iv8 s VAL 805 CO 0.28 0.16 0.51 0.00 0.00 0.00 0.00 175.10 176.05 2iv8 s ALA 806 N 1.52 3.56 -0.04 5.51 0.00 0.45 -2.84 121.76 129.92 2iv8 s ALA 806 Ca -0.03 -0.71 0.01 0.00 0.00 0.00 0.00 51.96 51.23 2iv8 s ALA 806 Cb -0.13 -2.91 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 2iv8 s ALA 806 CO -0.03 -0.85 -0.04 0.08 0.00 0.00 0.00 175.76 174.92 2iv8 s VAL 807 N 2.33 3.89 0.14 0.00 1.01 -1.00 0.22 120.40 126.98 2iv8 s VAL 807 Ca 0.20 -0.54 0.05 0.00 0.00 0.00 0.00 61.98 61.70 2iv8 s VAL 807 Cb -0.16 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 2iv8 s VAL 807 CO 0.10 0.50 -0.12 -0.75 0.00 0.00 0.00 175.10 174.84 2iv8 s LYS 808 N -1.13 1.03 0.00 2.72 2.20 0.16 -0.54 119.74 124.18 2iv8 s LYS 808 Ca 0.15 -1.35 0.00 0.00 -0.36 0.00 0.00 55.97 54.41 2iv8 s LYS 808 Cb -0.11 -0.72 0.00 0.00 -1.51 0.00 0.00 37.83 35.49 2iv8 s LYS 808 CO 0.05 0.11 0.00 0.27 -0.36 0.00 0.00 175.35 175.42 2iv8 n ASN 809 N 0.12 0.00 0.22 1.43 0.23 -0.69 -2.37 115.26 114.20 2iv8 n ASN 809 Ca -0.12 -0.35 0.06 0.00 -0.53 0.00 0.00 54.58 53.63 2iv8 n ASN 809 Cb 0.59 0.00 0.49 0.00 -2.08 0.00 0.00 39.78 38.78 2iv8 n ASN 809 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 2iv8 h ASN 810 N 0.00 0.00 0.13 0.53 -1.07 -1.35 -3.35 115.58 110.46 2iv8 h ASN 810 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 56.30 56.36 2iv8 h ASN 810 Cb 0.00 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.25 2iv8 h ASN 810 CO 0.00 0.23 -0.06 0.40 0.07 0.00 0.00 177.43 178.07 2iv8 h ILE 811 N 0.00 0.00 -0.25 6.14 2.04 -1.90 -3.50 117.51 120.05 2iv8 h ILE 811 Ca -0.00 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.12 2iv8 h ILE 811 Cb 0.44 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.52 2iv8 h ILE 811 CO 0.03 0.00 0.00 -0.67 0.00 0.00 0.00 178.15 177.51 2iv8 n ASP 812 N -4.50 0.00 -4.05 1.72 -0.08 -1.26 -5.17 116.55 103.22 2iv8 n ASP 812 Ca -0.02 0.00 -0.23 0.00 -1.51 0.00 0.00 54.79 53.03 2iv8 n ASP 812 Cb 0.07 0.00 -0.16 0.00 2.34 0.00 0.00 41.12 43.37 2iv8 n ASP 812 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2iv8 s VAL 813 N -1.49 1.03 -0.09 5.18 1.01 -1.26 -1.70 120.40 123.08 2iv8 s VAL 813 Ca 0.00 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.49 2iv8 s VAL 813 Cb 0.00 -0.90 0.02 0.00 0.00 0.00 0.00 36.38 35.50 2iv8 s VAL 813 CO 0.00 0.31 -0.09 -0.36 0.00 0.00 0.00 175.10 174.96 2iv8 s PHE 814 N 0.13 1.41 -0.06 5.22 0.08 0.30 -4.99 117.98 120.06 2iv8 s PHE 814 Ca -0.03 -0.62 -0.03 0.00 0.12 0.00 0.00 56.93 56.37 2iv8 s PHE 814 Cb -0.10 -1.12 -0.04 0.00 -0.57 0.00 0.00 43.02 41.19 2iv8 s PHE 814 CO 0.01 -0.40 0.10 0.71 -0.10 0.00 0.00 175.22 175.54 2iv8 s TYR 815 N 1.26 3.40 0.17 0.36 4.12 -1.26 -2.38 117.35 123.02 2iv8 s TYR 815 Ca -0.04 0.33 -0.17 0.00 0.02 0.00 0.00 57.07 57.22 2iv8 s TYR 815 Cb -0.14 -1.83 0.03 0.00 -1.52 0.00 0.00 41.96 38.50 2iv8 s TYR 815 CO -0.03 0.61 0.48 -0.59 0.02 0.00 0.00 175.55 176.04 2iv8 s PHE 816 N -1.09 -0.13 0.02 2.71 -0.12 -1.13 -5.02 117.98 113.21 2iv8 s PHE 816 Ca 0.19 -0.20 0.02 0.00 -0.05 0.00 0.00 56.93 56.90 2iv8 s PHE 816 Cb -0.12 0.33 -0.01 0.00 -0.63 0.00 0.00 43.02 42.59 2iv8 s PHE 816 CO 0.09 -0.84 -0.08 -1.12 -0.05 0.00 0.00 175.22 173.22 2iv8 s SER 817 N -2.85 0.92 0.04 1.98 0.01 -1.26 -2.57 113.70 109.97 2iv8 s SER 817 Ca 0.07 -0.29 0.02 0.00 1.31 0.00 0.00 55.95 57.06 2iv8 s SER 817 Cb 0.00 -0.05 -0.02 0.00 0.21 0.00 0.00 66.02 66.15 2iv8 s SER 817 CO -0.06 -0.01 -0.07 0.00 0.41 0.00 0.00 173.24 173.51 2iv8 s LEU 819 N -1.51 4.18 -0.05 0.00 1.43 -1.26 0.19 118.68 121.65 2iv8 s LEU 819 Ca -0.10 0.21 -0.30 0.00 -1.03 0.00 0.00 54.13 52.92 2iv8 s LEU 819 Cb -0.10 -2.12 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 2iv8 s LEU 819 CO 0.00 0.13 1.38 -0.63 0.23 0.00 0.00 176.35 177.46 2iv8 s ILE 820 N 0.64 3.89 0.03 -0.59 1.01 0.10 -4.96 121.20 121.31 2iv8 s ILE 820 Ca 0.09 1.20 -0.30 0.00 0.00 0.00 0.00 60.65 61.64 2iv8 s ILE 820 Cb -0.12 -3.77 -0.05 0.00 0.01 0.00 0.00 42.46 38.53 2iv8 s ILE 820 CO 0.01 -0.04 1.17 -2.84 0.00 0.00 0.00 174.94 173.24 2iv8 s PRO 821 N 2.84 4.44 0.57 2.79 0.02 -1.26 -4.85 135.00 139.55 2iv8 s PRO 821 Ca 0.62 1.70 0.33 0.00 0.02 0.00 0.00 61.00 63.67 2iv8 s PRO 821 Cb -0.29 -3.41 1.75 0.00 0.02 0.00 0.00 34.50 32.57 2iv8 s PRO 821 CO 0.24 -0.26 2.17 -0.07 -0.33 0.00 0.00 177.00 178.74 2iv8 h LEU 822 N 7.08 0.00 -1.22 -5.54 3.38 -1.93 -3.00 115.31 114.08 2iv8 h LEU 822 Ca -0.40 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.65 2iv8 h LEU 822 Cb 1.20 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.89 2iv8 h LEU 822 CO 0.82 0.05 0.56 -0.55 0.09 0.00 0.00 178.44 179.41 2iv8 h ASN 823 N 0.00 0.80 0.00 -0.43 -1.07 -1.94 0.69 115.58 113.63 2iv8 h ASN 823 Ca -0.00 0.02 0.00 0.00 0.07 0.00 0.00 56.30 56.39 2iv8 h ASN 823 Cb 0.22 -0.15 0.00 0.00 -2.07 0.00 0.00 38.32 36.31 2iv8 h ASN 823 CO 0.01 0.49 0.00 1.33 0.07 0.00 0.00 177.43 179.32 2iv8 n VAL 824 N -4.51 0.00 -0.07 6.14 0.24 -1.13 -1.23 118.33 117.77 2iv8 n VAL 824 Ca 0.14 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.55 2iv8 n VAL 824 Cb 0.27 -0.73 0.26 0.00 -1.47 0.00 0.00 33.84 32.17 2iv8 n VAL 824 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2iv8 n LEU 825 N -0.97 3.62 -4.63 1.34 4.77 0.24 -4.76 117.00 116.61 2iv8 n LEU 825 Ca 0.11 -1.78 -0.43 0.00 -0.03 0.00 0.00 56.01 53.88 2iv8 n LEU 825 Cb 0.05 -0.36 -0.03 0.00 -2.33 0.00 0.00 43.42 40.76 2iv8 n LEU 825 CO 0.08 0.85 0.89 -0.36 -1.33 0.00 0.00 177.39 177.52 2iv8 s PHE 826 N -1.18 3.16 1.24 -1.77 0.08 -0.36 -1.21 117.98 117.92 2iv8 s PHE 826 Ca 0.41 1.11 -0.18 0.00 0.12 0.00 0.00 56.93 58.40 2iv8 s PHE 826 Cb 0.23 -3.61 0.30 0.00 -0.57 0.00 0.00 43.02 39.37 2iv8 s PHE 826 CO 0.30 -0.73 1.02 0.14 -0.10 0.00 0.00 175.22 175.86 2iv8 s VAL 827 N 3.52 1.65 -0.01 -0.44 -7.23 -0.30 -4.92 120.40 112.66 2iv8 s VAL 827 Ca 0.43 0.00 -0.05 0.00 -1.81 0.00 0.00 61.98 60.55 2iv8 s VAL 827 Cb -0.12 -2.24 -0.28 0.00 0.56 0.00 0.00 36.38 34.30 2iv8 s VAL 827 CO 0.15 0.00 0.81 -0.33 -0.31 0.00 0.00 175.10 175.42 2iv8 h GLU 828 N -2.78 0.28 -2.02 4.82 5.08 -1.95 -3.37 114.58 114.64 2iv8 h GLU 828 Ca -0.51 -0.48 -0.18 0.00 -1.00 0.00 0.00 59.36 57.19 2iv8 h GLU 828 Cb 1.33 0.18 -0.07 0.00 0.50 0.00 0.00 28.75 30.69 2iv8 h GLU 828 CO 0.41 1.15 -0.37 -0.25 -1.00 0.00 0.00 179.01 178.95 2iv8 n ASP 829 N -3.48 5.16 -1.86 1.42 8.00 -1.26 -4.47 116.55 120.05 2iv8 n ASP 829 Ca -0.18 -2.46 0.05 0.00 0.71 0.00 0.00 54.79 52.91 2iv8 n ASP 829 Cb 1.05 -1.39 0.39 0.00 -0.02 0.00 0.00 41.12 41.15 2iv8 n ASP 829 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2iv8 n GLY 830 N 2.49 3.16 3.51 0.44 0.00 -1.26 -4.94 105.19 108.59 2iv8 n GLY 830 Ca 0.42 -0.95 -0.39 0.00 0.00 0.00 0.00 46.02 45.10 2iv8 n GLY 830 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2iv8 s LYS 831 N -2.82 3.55 0.16 1.61 2.20 -1.26 -3.73 119.74 119.45 2iv8 s LYS 831 Ca 0.54 -0.59 -0.30 0.00 -0.36 0.00 0.00 55.97 55.26 2iv8 s LYS 831 Cb 0.42 -3.67 -0.08 0.00 -1.51 0.00 0.00 37.83 32.99 2iv8 s LYS 831 CO 0.15 -0.37 1.21 1.41 -0.36 0.00 0.00 175.35 177.40 2iv8 s MET 832 N 1.69 4.47 0.18 4.03 1.75 -1.26 -4.91 119.30 125.25 2iv8 s MET 832 Ca 0.06 1.87 -0.33 0.00 -1.25 0.00 0.00 55.69 56.04 2iv8 s MET 832 Cb -0.17 -3.26 -0.15 0.00 2.84 0.00 0.00 34.83 34.10 2iv8 s MET 832 CO 0.09 -0.14 1.37 0.39 -0.65 0.00 0.00 175.02 176.08 2iv8 n GLU 833 N 2.87 1.70 -0.22 4.11 1.02 -1.26 -4.75 120.64 124.10 2iv8 n GLU 833 Ca 0.06 0.61 0.03 0.00 -0.02 0.00 0.00 57.16 57.83 2iv8 n GLU 833 Cb 0.45 -2.25 0.14 0.00 -0.02 0.00 0.00 31.44 29.77 2iv8 n GLU 833 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2iv8 h ARG 834 N 4.42 0.29 -1.00 3.49 2.43 -1.98 0.60 114.38 122.63 2iv8 h ARG 834 Ca -0.45 -0.02 0.15 0.00 -0.81 0.00 0.00 59.98 58.85 2iv8 h ARG 834 Cb 1.30 -0.07 -0.09 0.00 -0.42 0.00 0.00 29.97 30.69 2iv8 h ARG 834 CO 0.77 0.19 0.62 -0.56 -1.51 0.00 0.00 179.97 179.49 2iv8 h GLN 835 N 0.30 0.86 0.00 0.20 3.07 -2.01 -2.04 115.11 115.50 2iv8 h GLN 835 Ca 0.36 -0.05 -0.07 0.00 0.09 0.00 0.00 58.65 58.98 2iv8 h GLN 835 Cb 0.57 -0.19 -0.01 0.00 0.08 0.00 0.00 27.48 27.92 2iv8 h GLN 835 CO -0.44 0.57 -0.35 0.28 0.09 0.00 0.00 178.83 178.99 2iv8 h VAL 836 N 0.89 0.64 0.11 1.86 2.07 -0.21 -2.20 116.25 119.41 2iv8 h VAL 836 Ca 0.53 -1.74 -0.26 0.00 0.82 0.00 0.00 66.70 66.04 2iv8 h VAL 836 Cb 0.66 2.19 0.00 0.00 -1.52 0.00 0.00 31.29 32.62 2iv8 h VAL 836 CO -0.31 0.34 -1.19 0.15 0.02 0.00 0.00 177.57 176.59 2iv8 h PHE 837 N 0.00 0.48 0.27 1.57 3.04 -0.43 -2.92 116.94 118.94 2iv8 h PHE 837 Ca -0.00 -0.34 -0.01 0.00 3.98 0.00 0.00 57.97 61.60 2iv8 h PHE 837 Cb 1.16 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 39.65 2iv8 h PHE 837 CO 0.00 1.24 -0.13 -0.07 -2.02 0.00 0.00 178.31 177.34 2iv8 h LEU 838 N 0.09 -0.30 -0.70 0.59 -0.00 -1.20 -1.35 115.31 112.43 2iv8 h LEU 838 Ca -0.12 -0.06 0.14 0.00 -0.00 0.00 0.00 57.88 57.83 2iv8 h LEU 838 Cb 1.90 0.08 -0.13 0.00 -0.00 0.00 0.00 40.66 42.51 2iv8 h LEU 838 CO 0.19 0.18 -0.19 0.00 -0.00 0.00 0.00 178.44 178.62 2iv8 h ALA 839 N -0.96 0.44 -0.75 1.53 0.00 -1.57 0.40 119.26 118.34 2iv8 h ALA 839 Ca -0.04 0.27 0.09 0.00 0.00 0.00 0.00 54.91 55.23 2iv8 h ALA 839 Cb 0.35 0.55 -0.07 0.00 0.00 0.00 0.00 17.79 18.62 2iv8 h ALA 839 CO 0.06 -0.43 0.41 1.15 0.00 0.00 0.00 179.25 180.44 2iv8 h THR 840 N -0.01 0.90 -0.43 0.00 2.02 -1.58 -2.03 112.91 111.78 2iv8 h THR 840 Ca 0.33 -0.24 -0.04 0.00 0.77 0.00 0.00 66.41 67.23 2iv8 h THR 840 Cb 0.52 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.04 2iv8 h THR 840 CO -0.73 0.13 0.08 -0.25 0.37 0.00 0.00 175.52 175.12 2iv8 h TRP 841 N 0.70 0.67 0.05 3.16 2.91 0.97 -2.38 115.95 122.03 2iv8 h TRP 841 Ca 0.36 -0.06 -0.31 0.00 1.13 0.00 0.00 58.89 60.01 2iv8 h TRP 841 Cb 0.33 -0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 28.75 2iv8 h TRP 841 CO -0.08 0.59 -1.73 0.87 -1.03 0.00 0.00 178.44 177.06 2iv8 h LYS 842 N 0.63 0.11 0.00 2.65 1.57 -1.37 -3.36 116.57 116.81 2iv8 h LYS 842 Ca 0.14 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2iv8 h LYS 842 Cb 0.28 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2iv8 h LYS 842 CO 0.00 0.81 0.00 -3.47 -0.57 0.00 0.00 179.45 176.22 2iv8 n ASP 843 N -3.24 0.00 -4.60 0.86 2.03 -0.77 -4.63 116.55 106.19 2iv8 n ASP 843 Ca -0.20 0.79 -0.57 0.00 0.52 0.00 0.00 54.79 55.33 2iv8 n ASP 843 Cb 1.04 -0.29 -0.08 0.00 -0.72 0.00 0.00 41.12 41.07 2iv8 n ASP 843 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2iv8 n ILE 844 N -1.96 0.22 -2.42 5.18 5.41 -0.93 -4.85 119.36 120.00 2iv8 n ILE 844 Ca 0.00 -0.09 -0.41 0.00 1.00 0.00 0.00 62.75 63.25 2iv8 n ILE 844 Cb 0.00 -1.17 -0.04 0.00 -0.71 0.00 0.00 39.64 37.72 2iv8 n ILE 844 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2iv8 s PRO 845 N 4.42 4.51 0.42 0.38 0.04 -1.26 -4.82 135.00 138.69 2iv8 s PRO 845 Ca 1.04 1.81 0.25 0.00 0.04 0.00 0.00 61.00 64.15 2iv8 s PRO 845 Cb -1.11 -3.27 1.32 0.00 0.04 0.00 0.00 34.50 31.48 2iv8 s PRO 845 CO 0.64 -0.07 1.65 -0.91 0.04 0.00 0.00 177.00 178.35 2iv8 h ASN 846 N 5.44 0.32 -0.95 6.66 4.21 -1.89 3.28 115.58 132.65 2iv8 h ASN 846 Ca -0.44 0.14 0.31 0.00 1.21 0.00 0.00 56.30 57.52 2iv8 h ASN 846 Cb 1.21 0.11 -0.07 0.00 -1.12 0.00 0.00 38.32 38.45 2iv8 h ASN 846 CO 0.75 -0.14 0.64 -0.62 -1.29 0.00 0.00 177.43 176.77 2iv8 n GLU 847 N -4.75 -0.02 -0.26 0.81 1.02 -1.26 -0.41 120.64 115.78 2iv8 n GLU 847 Ca 0.34 0.74 0.10 0.00 -0.02 0.00 0.00 57.16 58.32 2iv8 n GLU 847 Cb 1.26 -1.52 0.26 0.00 -0.02 0.00 0.00 31.44 31.43 2iv8 n GLU 847 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2iv8 n ASN 848 N -3.69 3.06 -4.58 1.62 5.15 1.09 -4.91 115.26 113.01 2iv8 n ASN 848 Ca 0.25 -1.97 -0.37 0.00 -0.60 0.00 0.00 54.58 51.90 2iv8 n ASN 848 Cb 1.04 -0.34 -0.11 0.00 -0.53 0.00 0.00 39.78 39.85 2iv8 n ASN 848 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2iv8 s GLU 849 N -1.32 3.91 0.14 1.20 2.12 0.46 -4.29 118.70 120.93 2iv8 s GLU 849 Ca 0.39 -0.35 0.03 0.00 0.36 0.00 0.00 54.97 55.39 2iv8 s GLU 849 Cb 0.21 -3.46 -0.04 0.00 0.26 0.00 0.00 34.13 31.10 2iv8 s GLU 849 CO 0.28 -0.03 0.26 -0.51 -0.54 0.00 0.00 175.26 174.72 2iv8 s LEU 850 N 1.28 4.29 -0.04 2.70 1.43 -0.80 -4.97 118.68 122.57 2iv8 s LEU 850 Ca 0.06 0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.33 2iv8 s LEU 850 Cb -0.14 -2.86 0.01 0.00 0.03 0.00 0.00 46.19 43.22 2iv8 s LEU 850 CO 0.05 0.06 -0.08 -1.10 0.23 0.00 0.00 176.35 175.51 2iv8 s GLN 851 N -3.18 1.08 0.23 1.70 -0.21 -1.26 -1.06 119.66 116.97 2iv8 s GLN 851 Ca 0.34 -0.26 0.08 0.00 0.02 0.00 0.00 55.36 55.54 2iv8 s GLN 851 Cb -0.11 -0.99 -0.05 0.00 1.00 0.00 0.00 33.01 32.86 2iv8 s GLN 851 CO 0.28 0.03 -0.14 -0.06 -2.12 0.00 0.00 175.29 173.28 2iv8 s PHE 852 N 0.53 1.87 -0.34 0.91 0.40 0.83 -4.94 117.98 117.23 2iv8 s PHE 852 Ca -0.09 -0.55 0.03 0.00 -0.60 0.00 0.00 56.93 55.73 2iv8 s PHE 852 Cb -0.12 -0.90 0.10 0.00 0.51 0.00 0.00 43.02 42.61 2iv8 s PHE 852 CO 0.01 0.41 0.06 -0.65 0.70 0.00 0.00 175.22 175.76 2iv8 s GLN 853 N -3.63 1.53 -1.17 0.44 -1.52 -1.26 0.69 119.66 114.74 2iv8 s GLN 853 Ca 0.25 -1.87 -0.21 0.00 -1.95 0.00 0.00 55.36 51.58 2iv8 s GLN 853 Cb -0.01 -3.24 -0.06 0.00 -0.22 0.00 0.00 33.01 29.49 2iv8 s GLN 853 CO 0.09 -0.95 1.90 -0.89 -0.25 0.00 0.00 175.29 175.20 2iv8 n ILE 854 N 4.28 2.44 -1.40 1.08 5.41 0.56 -4.82 119.36 126.92 2iv8 n ILE 854 Ca 0.03 -2.48 -0.55 0.00 1.00 0.00 0.00 62.75 60.76 2iv8 n ILE 854 Cb 0.42 -2.25 -0.08 0.00 -0.71 0.00 0.00 39.64 37.02 2iv8 n ILE 854 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 2iv8 n LYS 855 N 8.04 0.00 -3.54 0.38 2.85 -1.26 -2.37 118.16 122.26 2iv8 n LYS 855 Ca 0.47 0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 57.37 2iv8 n LYS 855 Cb 0.45 -1.33 0.03 0.00 -0.65 0.00 0.00 35.03 33.53 2iv8 n LYS 855 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2iv8 n GLU 856 N 2.02 -1.80 -4.10 -1.58 4.07 -1.19 -4.94 120.64 113.11 2iv8 n GLU 856 Ca 0.21 1.22 -0.14 0.00 -0.06 0.00 0.00 57.16 58.39 2iv8 n GLU 856 Cb 0.03 -2.00 -0.12 0.00 -0.06 0.00 0.00 31.44 29.29 2iv8 n GLU 856 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2iv8 n HIS 858 N 1.94 0.00 -2.50 0.00 8.25 -1.26 -4.53 115.22 117.13 2iv8 n HIS 858 Ca -0.19 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 56.86 2iv8 n HIS 858 Cb 0.56 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.63 2iv8 n HIS 858 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2iv8 s LEU 859 N -0.24 4.48 0.44 2.41 1.43 -1.26 -4.98 118.68 120.96 2iv8 s LEU 859 Ca 0.00 2.11 -0.20 0.00 -1.03 0.00 0.00 54.13 55.01 2iv8 s LEU 859 Cb 0.00 -3.60 -0.15 0.00 0.03 0.00 0.00 46.19 42.47 2iv8 s LEU 859 CO 0.00 -0.24 0.08 0.59 0.23 0.00 0.00 176.35 177.01 2iv8 n ASN 860 N 2.36 -2.88 -0.11 2.29 3.02 -1.26 -4.41 115.26 114.28 2iv8 n ASN 860 Ca 0.03 0.77 -0.02 0.00 -0.03 0.00 0.00 54.58 55.33 2iv8 n ASN 860 Cb 0.46 -0.90 -0.01 0.00 -0.61 0.00 0.00 39.78 38.71 2iv8 n ASN 860 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2iv8 n ALA 861 N -1.17 -0.12 0.14 5.41 0.00 -1.26 0.23 120.51 123.74 2iv8 n ALA 861 Ca 0.10 0.24 -0.01 0.00 0.00 0.00 0.00 53.44 53.77 2iv8 n ALA 861 Cb 0.42 -0.06 0.20 0.00 0.00 0.00 0.00 19.45 20.00 2iv8 n ALA 861 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2iv8 h ASP 862 N 0.00 0.04 0.39 0.00 5.19 -2.01 -2.68 116.42 117.35 2iv8 h ASP 862 Ca 0.06 -0.02 -0.32 0.00 -0.62 0.00 0.00 57.03 56.13 2iv8 h ASP 862 Cb 0.12 -0.01 0.02 0.00 0.18 0.00 0.00 39.33 39.64 2iv8 h ASP 862 CO -0.25 0.60 -1.45 0.74 -3.12 0.00 0.00 179.24 175.76 2iv8 h THR 863 N 0.03 1.29 0.53 0.35 2.02 -1.23 -3.29 112.91 112.61 2iv8 h THR 863 Ca -0.01 -2.81 -0.02 0.00 0.77 0.00 0.00 66.41 64.35 2iv8 h THR 863 Cb 1.01 2.95 -0.01 0.00 -1.74 0.00 0.00 68.15 70.36 2iv8 h THR 863 CO 0.08 0.84 -0.42 0.58 0.37 0.00 0.00 175.52 176.97 2iv8 h VAL 864 N 0.11 0.00 -0.99 3.16 2.07 -0.14 -2.84 116.25 117.62 2iv8 h VAL 864 Ca -0.23 0.00 0.31 0.00 0.82 0.00 0.00 66.70 67.60 2iv8 h VAL 864 Cb 2.09 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 31.71 2iv8 h VAL 864 CO 0.23 0.00 0.55 0.28 0.02 0.00 0.00 177.57 178.65 2iv8 h SER 865 N -0.92 0.49 -0.19 0.57 0.02 -1.61 -2.71 113.55 109.20 2iv8 h SER 865 Ca -0.07 0.19 -0.17 0.00 -0.84 0.00 0.00 61.79 60.89 2iv8 h SER 865 Cb 0.77 0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.45 2iv8 h SER 865 CO 0.01 -0.11 -0.55 0.77 -1.14 0.00 0.00 176.83 175.81 2iv8 h SER 866 N 0.34 0.82 0.59 3.07 4.64 -1.58 -1.32 113.55 120.10 2iv8 h SER 866 Ca 0.71 -0.58 -0.03 0.00 -0.47 0.00 0.00 61.79 61.42 2iv8 h SER 866 Cb 1.59 -0.24 0.01 0.00 -0.31 0.00 0.00 62.40 63.44 2iv8 h SER 866 CO -0.60 1.26 -0.28 0.11 -0.87 0.00 0.00 176.83 176.45 2iv8 h LYS 867 N 0.42 -0.76 -0.72 4.77 1.57 -1.26 -2.76 116.57 117.82 2iv8 h LYS 867 Ca -0.01 0.05 0.15 0.00 -1.87 0.00 0.00 60.65 58.97 2iv8 h LYS 867 Cb 1.17 0.17 -0.05 0.00 0.08 0.00 0.00 32.23 33.61 2iv8 h LYS 867 CO 0.12 -0.49 0.49 -0.07 -0.57 0.00 0.00 179.45 178.93 2iv8 h LEU 868 N -0.85 0.33 -1.14 2.94 3.38 -1.44 0.98 115.31 119.51 2iv8 h LEU 868 Ca -0.08 0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.00 2iv8 h LEU 868 Cb 0.63 -0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.26 2iv8 h LEU 868 CO 0.13 0.17 0.60 1.56 0.09 0.00 0.00 178.44 180.99 2iv8 h GLN 869 N 0.35 0.93 0.00 1.13 1.08 -0.24 3.98 115.11 122.34 2iv8 h GLN 869 Ca 0.35 -0.06 -0.18 0.00 -1.45 0.00 0.00 58.65 57.31 2iv8 h GLN 869 Cb 0.88 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 28.09 2iv8 h GLN 869 CO -0.10 0.61 -0.84 -0.91 -0.95 0.00 0.00 178.83 176.64 2iv8 h ASN 870 N 0.95 0.12 -0.62 1.46 2.35 -0.52 -2.68 115.58 116.65 2iv8 h ASN 870 Ca 0.43 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 56.08 2iv8 h ASN 870 Cb 0.37 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.70 2iv8 h ASN 870 CO -0.19 0.91 0.00 0.59 -1.65 0.00 0.00 177.43 177.09 2iv8 n ASN 871 N -3.62 4.33 -1.85 5.81 3.02 -1.03 -4.39 115.26 117.54 2iv8 n ASN 871 Ca -0.02 -2.35 -0.14 0.00 -0.03 0.00 0.00 54.58 52.05 2iv8 n ASN 871 Cb 0.79 -0.54 0.02 0.00 -0.61 0.00 0.00 39.78 39.44 2iv8 n ASN 871 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2iv8 n ASN 872 N 1.12 -4.29 -4.47 6.41 4.13 0.86 -4.84 115.26 114.17 2iv8 n ASN 872 Ca 0.24 -0.15 -0.38 0.00 1.68 0.00 0.00 54.58 55.97 2iv8 n ASN 872 Cb 0.79 -3.23 -0.12 0.00 -1.54 0.00 0.00 39.78 35.69 2iv8 n ASN 872 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2iv8 s VAL 873 N -2.87 4.67 -0.16 2.41 1.01 1.28 -4.63 120.40 122.11 2iv8 s VAL 873 Ca 0.15 -0.24 -0.05 0.00 0.00 0.00 0.00 61.98 61.83 2iv8 s VAL 873 Cb -0.07 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 2iv8 s VAL 873 CO 0.19 0.17 0.01 -0.31 0.00 0.00 0.00 175.10 175.16 2iv8 s TYR 874 N 1.64 3.15 -0.16 5.22 2.02 -0.71 -1.60 117.35 126.92 2iv8 s TYR 874 Ca 0.06 -0.08 -0.28 0.00 -0.37 0.00 0.00 57.07 56.40 2iv8 s TYR 874 Cb -0.16 -2.00 -0.01 0.00 -0.40 0.00 0.00 41.96 39.38 2iv8 s TYR 874 CO 0.06 0.10 0.94 0.99 -1.57 0.00 0.00 175.55 176.07 2iv8 s THR 875 N 0.26 4.81 -0.14 -0.71 2.01 -1.26 -1.58 115.64 119.03 2iv8 s THR 875 Ca 0.01 1.86 -0.10 0.00 0.31 0.00 0.00 61.69 63.76 2iv8 s THR 875 Cb -0.13 -4.24 -0.25 0.00 0.01 0.00 0.00 72.50 67.90 2iv8 s THR 875 CO 0.02 -0.02 0.33 -0.38 -0.69 0.00 0.00 174.62 173.88 2iv8 n ILE 876 N 4.77 1.73 -3.62 1.82 2.08 0.78 -4.95 119.36 121.98 2iv8 n ILE 876 Ca 0.07 -0.52 -0.13 0.00 0.56 0.00 0.00 62.75 62.74 2iv8 n ILE 876 Cb 0.48 -1.81 -0.05 0.00 -0.75 0.00 0.00 39.64 37.51 2iv8 n ILE 876 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2iv8 s ALA 877 N -2.52 -1.12 -0.11 -1.39 0.00 -0.67 -4.95 121.76 111.00 2iv8 s ALA 877 Ca -0.24 0.33 -0.02 0.00 0.00 0.00 0.00 51.96 52.04 2iv8 s ALA 877 Cb 0.06 0.46 0.03 0.00 0.00 0.00 0.00 23.12 23.68 2iv8 s ALA 877 CO 0.73 -0.53 -0.00 0.21 0.00 0.00 0.00 175.76 176.17 2iv8 s LYS 878 N -2.84 0.77 0.16 0.00 2.20 -1.26 0.33 119.74 119.10 2iv8 s LYS 878 Ca -0.03 -0.08 0.08 0.00 -0.36 0.00 0.00 55.97 55.58 2iv8 s LYS 878 Cb -0.00 -1.35 -0.04 0.00 -1.51 0.00 0.00 37.83 34.93 2iv8 s LYS 878 CO -0.05 -0.38 -0.17 1.03 -0.36 0.00 0.00 175.35 175.42 2iv8 s ARG 879 N 1.90 1.22 -0.03 4.03 1.81 -1.24 -4.93 118.95 121.71 2iv8 s ARG 879 Ca 0.04 -1.37 0.07 0.00 -1.72 0.00 0.00 55.73 52.75 2iv8 s ARG 879 Cb -0.13 -1.25 -0.02 0.00 -0.45 0.00 0.00 34.95 33.10 2iv8 s ARG 879 CO -0.06 0.25 -0.25 1.21 -0.68 0.00 0.00 175.30 175.76 2iv8 s ASN 880 N -2.62 3.09 -0.11 0.23 2.47 -1.26 0.65 114.94 117.39 2iv8 s ASN 880 Ca 0.14 -0.47 -0.10 0.00 0.42 0.00 0.00 52.86 52.85 2iv8 s ASN 880 Cb -0.06 -0.50 0.03 0.00 -1.45 0.00 0.00 41.25 39.27 2iv8 s ASN 880 CO 0.06 0.30 0.29 -0.69 -3.72 0.00 0.00 177.10 173.34 2iv8 s VAL 881 N -0.49 -0.00 -1.07 -5.21 1.01 -0.72 -4.87 120.40 109.05 2iv8 s VAL 881 Ca 0.06 0.02 -0.07 0.00 0.00 0.00 0.00 61.98 61.99 2iv8 s VAL 881 Cb -0.11 -0.41 0.07 0.00 0.00 0.00 0.00 36.38 35.92 2iv8 s VAL 881 CO 0.00 0.01 0.17 -0.62 0.00 0.00 0.00 175.10 174.66 2iv8 n GLU 882 N 3.09 -0.90 0.00 2.72 -0.58 -1.26 -0.60 120.64 123.11 2iv8 n GLU 882 Ca -0.14 0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.67 2iv8 n GLU 882 Cb 0.57 -2.57 0.00 0.00 -0.57 0.00 0.00 31.44 28.87 2iv8 n GLU 882 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2iv8 n GLY 883 N -1.49 3.07 3.72 0.62 0.00 -1.26 -5.01 105.19 104.84 2iv8 n GLY 883 Ca -0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 2iv8 n GLY 883 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2iv8 s GLN 884 N -0.16 4.35 0.26 1.61 -0.21 0.23 -4.48 119.66 121.24 2iv8 s GLN 884 Ca 0.00 0.52 -0.21 0.00 0.02 0.00 0.00 55.36 55.69 2iv8 s GLN 884 Cb 0.00 -3.45 -0.09 0.00 1.00 0.00 0.00 33.01 30.47 2iv8 s GLN 884 CO 0.00 0.12 0.78 -0.51 -2.12 0.00 0.00 175.29 173.56 2iv8 s ASP 885 N 0.70 7.11 -0.36 5.90 1.01 -0.82 -1.76 116.67 128.44 2iv8 s ASP 885 Ca 0.28 1.52 0.00 0.00 0.71 0.00 0.00 52.55 55.06 2iv8 s ASP 885 Cb -0.16 -2.46 0.12 0.00 1.01 0.00 0.00 42.92 41.44 2iv8 s ASP 885 CO 0.12 -0.01 0.18 0.00 0.21 0.00 0.00 175.17 175.66 2iv8 s MET 886 N -2.07 0.81 -0.12 8.23 0.23 0.21 -0.39 119.30 126.20 2iv8 s MET 886 Ca 0.46 -1.41 -0.29 0.00 -1.03 0.00 0.00 55.69 53.41 2iv8 s MET 886 Cb -0.17 -1.83 -0.04 0.00 -1.53 0.00 0.00 34.83 31.27 2iv8 s MET 886 CO 0.21 -1.11 1.52 -0.51 -2.03 0.00 0.00 175.02 173.10 2iv8 s LEU 887 N 1.08 4.20 -0.34 0.18 1.43 0.14 -3.68 118.68 121.69 2iv8 s LEU 887 Ca 0.15 1.95 -0.17 0.00 -1.03 0.00 0.00 54.13 55.03 2iv8 s LEU 887 Cb -0.21 -3.53 -0.01 0.00 0.03 0.00 0.00 46.19 42.46 2iv8 s LEU 887 CO -0.10 -0.93 0.46 -0.31 0.23 0.00 0.00 176.35 175.70 2iv8 s TYR 888 N 4.05 3.20 0.04 0.29 2.02 1.01 0.00 117.35 127.97 2iv8 s TYR 888 Ca 0.67 0.15 0.00 0.00 -0.37 0.00 0.00 57.07 57.52 2iv8 s TYR 888 Cb -0.28 -2.82 -0.03 0.00 -0.40 0.00 0.00 41.96 38.43 2iv8 s TYR 888 CO 0.25 -0.48 -0.04 1.14 -1.57 0.00 0.00 175.55 174.84 2iv8 s GLN 889 N 2.26 0.51 0.01 -0.62 -2.07 -0.07 0.27 119.66 119.95 2iv8 s GLN 889 Ca 0.16 -0.92 0.02 0.00 -1.82 0.00 0.00 55.36 52.80 2iv8 s GLN 889 Cb -0.16 0.02 -0.01 0.00 -1.09 0.00 0.00 33.01 31.77 2iv8 s GLN 889 CO 0.12 -0.04 -0.07 -1.54 -1.32 0.00 0.00 175.29 172.44 2iv8 s SER 890 N -2.14 0.75 0.25 12.60 1.04 -0.61 0.55 113.70 126.15 2iv8 s SER 890 Ca -0.04 -0.22 -0.03 0.00 0.48 0.00 0.00 55.95 56.13 2iv8 s SER 890 Cb -0.03 -0.05 -0.02 0.00 0.10 0.00 0.00 66.02 66.02 2iv8 s SER 890 CO -0.04 0.00 0.30 -1.48 0.98 0.00 0.00 173.24 173.00 2iv8 s LEU 891 N -0.52 0.99 -0.21 2.42 -0.00 -0.53 -1.73 118.68 119.10 2iv8 s LEU 891 Ca -0.01 -1.34 -0.18 0.00 -0.00 0.00 0.00 54.13 52.60 2iv8 s LEU 891 Cb -0.04 0.95 0.06 0.00 -0.00 0.00 0.00 46.19 47.15 2iv8 s LEU 891 CO -0.00 -1.03 0.56 -0.75 -0.00 0.00 0.00 176.35 175.14 2iv8 s LYS 892 N -3.84 0.64 0.44 1.48 2.20 -1.26 -0.60 119.74 118.80 2iv8 s LYS 892 Ca 0.34 0.82 -0.13 0.00 -0.36 0.00 0.00 55.97 56.64 2iv8 s LYS 892 Cb 0.03 0.27 -0.07 0.00 -1.51 0.00 0.00 37.83 36.55 2iv8 s LYS 892 CO 0.15 -0.09 0.85 -0.51 -0.36 0.00 0.00 175.35 175.39 2iv8 s LEU 893 N 0.51 3.76 0.30 5.43 1.43 0.04 -1.16 118.68 129.00 2iv8 s LEU 893 Ca -0.02 1.31 0.23 0.00 -1.03 0.00 0.00 54.13 54.63 2iv8 s LEU 893 Cb -0.04 -4.21 1.10 0.00 0.03 0.00 0.00 46.19 43.06 2iv8 s LEU 893 CO -0.02 -0.46 1.70 0.35 0.23 0.00 0.00 176.35 178.14 2iv8 n THR 894 N -1.36 0.92 0.91 5.49 -2.24 -0.35 -0.43 114.28 117.22 2iv8 n THR 894 Ca 0.04 0.48 0.10 0.00 -2.27 0.00 0.00 64.05 62.41 2iv8 n THR 894 Cb 0.54 -1.45 0.02 0.00 -2.10 0.00 0.00 70.33 67.34 2iv8 n THR 894 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2iv8 n ASN 895 N -2.28 2.18 0.00 3.42 2.04 -1.26 -4.95 115.26 114.41 2iv8 n ASN 895 Ca 0.00 -1.59 0.00 0.00 -0.44 0.00 0.00 54.58 52.55 2iv8 n ASN 895 Cb 0.13 0.34 0.00 0.00 -2.53 0.00 0.00 39.78 37.72 2iv8 n ASN 895 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2iv8 n GLY 896 N 1.31 1.43 3.76 4.83 0.00 0.43 -5.10 105.19 111.84 2iv8 n GLY 896 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 2iv8 n GLY 896 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2iv8 s ILE 897 N -2.00 3.30 0.13 -0.61 1.01 -1.25 -4.69 121.20 117.09 2iv8 s ILE 897 Ca 0.00 1.29 -0.17 0.00 0.00 0.00 0.00 60.65 61.77 2iv8 s ILE 897 Cb 0.00 -3.82 -0.07 0.00 0.01 0.00 0.00 42.46 38.58 2iv8 s ILE 897 CO 0.00 0.30 0.59 0.26 0.00 0.00 0.00 174.94 176.09 2iv8 s TRP 898 N -1.06 3.69 -0.06 3.97 0.52 -1.26 -0.78 118.94 123.96 2iv8 s TRP 898 Ca 0.46 1.20 0.04 0.00 0.02 0.00 0.00 56.10 57.82 2iv8 s TRP 898 Cb -0.34 -2.46 -0.02 0.00 -1.15 0.00 0.00 33.47 29.50 2iv8 s TRP 898 CO 0.44 0.47 -0.19 0.42 0.02 0.00 0.00 176.95 178.11 2iv8 s ILE 899 N -1.34 2.64 0.05 2.03 1.09 0.23 -4.09 121.20 121.82 2iv8 s ILE 899 Ca 0.35 -0.86 0.08 0.00 -1.10 0.00 0.00 60.65 59.12 2iv8 s ILE 899 Cb -0.17 -2.01 -0.03 0.00 -1.06 0.00 0.00 42.46 39.18 2iv8 s ILE 899 CO 0.19 0.57 -0.19 -0.76 -0.10 0.00 0.00 174.94 174.65 2iv8 s LEU 900 N -0.40 2.56 0.03 2.97 1.43 0.95 -1.46 118.68 124.76 2iv8 s LEU 900 Ca 0.04 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.67 2iv8 s LEU 900 Cb -0.12 -1.48 -0.02 0.00 0.03 0.00 0.00 46.19 44.59 2iv8 s LEU 900 CO 0.02 0.24 -0.05 0.00 0.23 0.00 0.00 176.35 176.79 2iv8 s ALA 901 N -0.95 0.31 -0.21 4.21 0.00 0.19 -0.28 121.76 125.04 2iv8 s ALA 901 Ca 0.15 -0.68 0.01 0.00 0.00 0.00 0.00 51.96 51.44 2iv8 s ALA 901 Cb -0.10 0.11 0.04 0.00 0.00 0.00 0.00 23.12 23.17 2iv8 s ALA 901 CO 0.06 -0.11 -0.11 -2.00 0.00 0.00 0.00 175.76 173.60 2iv8 s GLU 902 N -1.58 2.08 -0.12 0.00 2.12 0.21 -0.89 118.70 120.53 2iv8 s GLU 902 Ca -0.13 -0.92 -0.11 0.00 0.36 0.00 0.00 54.97 54.17 2iv8 s GLU 902 Cb -0.10 -2.50 -0.05 0.00 0.26 0.00 0.00 34.13 31.75 2iv8 s GLU 902 CO -0.01 -0.45 0.25 -1.17 -0.54 0.00 0.00 175.26 173.35 2iv8 s LEU 903 N 1.35 4.33 -0.16 2.70 2.96 0.10 -2.27 118.68 127.69 2iv8 s LEU 903 Ca -0.02 0.56 0.00 0.00 -0.22 0.00 0.00 54.13 54.45 2iv8 s LEU 903 Cb -0.17 -2.29 0.00 0.00 0.50 0.00 0.00 46.19 44.24 2iv8 s LEU 903 CO -0.08 0.25 -0.17 -0.60 -1.32 0.00 0.00 176.35 174.44 2iv8 s ARG 904 N -0.34 3.14 -0.20 1.98 3.52 -0.29 0.25 118.95 127.02 2iv8 s ARG 904 Ca 0.16 -0.78 -0.04 0.00 -0.13 0.00 0.00 55.73 54.95 2iv8 s ARG 904 Cb -0.13 -2.61 -0.01 0.00 -1.56 0.00 0.00 34.95 30.63 2iv8 s ARG 904 CO 0.05 -0.06 -0.04 0.42 -0.81 0.00 0.00 175.30 174.86 2iv8 s ILE 905 N 0.98 3.53 0.36 4.11 1.01 0.48 -2.56 121.20 129.11 2iv8 s ILE 905 Ca -0.02 -0.46 -0.03 0.00 0.00 0.00 0.00 60.65 60.14 2iv8 s ILE 905 Cb -0.15 -2.58 -0.04 0.00 0.01 0.00 0.00 42.46 39.70 2iv8 s ILE 905 CO -0.03 0.44 0.62 -1.10 0.00 0.00 0.00 174.94 174.86 2iv8 s GLN 906 N 1.12 3.57 -0.00 2.79 -0.21 -1.26 -1.94 119.66 123.72 2iv8 s GLN 906 Ca 0.02 -0.04 -0.30 0.00 0.02 0.00 0.00 55.36 55.05 2iv8 s GLN 906 Cb -0.15 -2.58 -0.05 0.00 1.00 0.00 0.00 33.01 31.24 2iv8 s GLN 906 CO -0.00 0.08 1.33 -1.25 -2.12 0.00 0.00 175.29 173.33 2iv8 s PRO 907 N -4.11 4.31 3.40 2.91 0.04 -1.26 -4.44 135.00 135.84 2iv8 s PRO 907 Ca 0.44 1.88 0.00 0.00 0.04 0.00 0.00 61.00 63.36 2iv8 s PRO 907 Cb -0.10 -3.54 0.00 0.00 0.04 0.00 0.00 34.50 30.90 2iv8 s PRO 907 CO 0.36 -0.51 0.00 0.41 0.04 0.00 0.00 177.00 177.29 2iv8 n GLY 908 N 3.53 1.70 0.00 0.56 0.00 -1.26 -5.01 105.19 104.72 2iv8 n GLY 908 Ca 0.12 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2iv8 n GLY 908 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2iv8 n ASN 909 N 6.65 0.00 0.30 1.61 5.15 -1.26 -4.81 115.26 122.90 2iv8 n ASN 909 Ca 0.00 0.00 0.19 0.00 -0.60 0.00 0.00 54.58 54.17 2iv8 n ASN 909 Cb 0.00 0.00 0.92 0.00 -0.53 0.00 0.00 39.78 40.17 2iv8 n ASN 909 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2iv8 h PRO 910 N 0.00 0.00 -6.92 1.20 0.13 -1.95 -3.43 132.00 121.03 2iv8 h PRO 910 Ca 0.00 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.68 2iv8 h PRO 910 Cb 0.00 0.00 0.06 0.00 0.13 0.00 0.00 31.00 31.19 2iv8 h PRO 910 CO 0.00 0.02 0.01 -0.80 -0.23 0.00 0.00 178.00 177.00 2iv8 s ASN 911 N -5.56 5.05 -0.20 1.44 0.01 -1.26 -1.42 114.94 113.01 2iv8 s ASN 911 Ca -0.02 -0.07 -0.05 0.00 -0.71 0.00 0.00 52.86 52.01 2iv8 s ASN 911 Cb 0.11 -0.69 0.08 0.00 0.41 0.00 0.00 41.25 41.16 2iv8 s ASN 911 CO 0.50 -1.32 0.13 -0.31 -1.51 0.00 0.00 177.10 174.58 2iv8 s TYR 912 N -2.87 0.12 -0.16 2.20 1.51 -1.00 -4.51 117.35 112.64 2iv8 s TYR 912 Ca 0.59 -0.33 -0.29 0.00 -1.01 0.00 0.00 57.07 56.03 2iv8 s TYR 912 Cb -0.09 -0.67 -0.03 0.00 -0.11 0.00 0.00 41.96 41.06 2iv8 s TYR 912 CO 0.40 -0.60 1.44 0.99 -1.11 0.00 0.00 175.55 176.67 2iv8 s THR 913 N 2.17 3.97 -0.19 -0.71 2.01 -1.06 -0.32 115.64 121.51 2iv8 s THR 913 Ca 0.04 1.15 -0.07 0.00 0.31 0.00 0.00 61.69 63.12 2iv8 s THR 913 Cb -0.16 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.50 2iv8 s THR 913 CO -0.15 -0.18 0.06 -0.22 -0.69 0.00 0.00 174.62 173.43 2iv8 s LEU 914 N 4.05 3.75 -0.07 4.42 2.96 0.22 -1.14 118.68 132.86 2iv8 s LEU 914 Ca 0.63 0.04 0.05 0.00 -0.22 0.00 0.00 54.13 54.63 2iv8 s LEU 914 Cb -0.25 -1.95 -0.01 0.00 0.50 0.00 0.00 46.19 44.48 2iv8 s LEU 914 CO 0.22 0.15 -0.23 -0.44 -1.32 0.00 0.00 176.35 174.73 2iv8 s SER 915 N 0.52 2.86 -0.06 3.68 0.01 -0.96 0.29 113.70 120.03 2iv8 s SER 915 Ca 0.03 -0.49 0.05 0.00 1.31 0.00 0.00 55.95 56.85 2iv8 s SER 915 Cb -0.13 -0.97 -0.01 0.00 0.21 0.00 0.00 66.02 65.13 2iv8 s SER 915 CO 0.01 0.19 -0.23 -0.76 0.41 0.00 0.00 173.24 172.87 2iv8 s LEU 916 N 0.06 2.02 0.01 2.44 1.43 -0.22 -0.62 118.68 123.80 2iv8 s LEU 916 Ca -0.09 -0.48 0.08 0.00 -1.03 0.00 0.00 54.13 52.62 2iv8 s LEU 916 Cb -0.15 -1.27 -0.02 0.00 0.03 0.00 0.00 46.19 44.78 2iv8 s LEU 916 CO 0.05 0.20 -0.26 -0.54 0.23 0.00 0.00 176.35 176.03 2iv8 s LYS 917 N 0.02 1.92 -0.28 1.70 1.02 0.61 -1.91 119.74 122.81 2iv8 s LYS 917 Ca -0.07 -0.99 -0.23 0.00 0.02 0.00 0.00 55.97 54.70 2iv8 s LYS 917 Cb -0.14 -1.96 0.12 0.00 -0.52 0.00 0.00 37.83 35.33 2iv8 s LYS 917 CO 0.04 0.52 0.99 0.00 -0.92 0.00 0.00 175.35 175.99 2iv8 h ARG 919 N 4.73 0.59 -4.07 0.00 3.08 -1.94 -3.33 114.38 113.43 2iv8 h ARG 919 Ca -0.28 -0.18 -0.65 0.00 0.07 0.00 0.00 59.98 58.94 2iv8 h ARG 919 Cb 1.18 -0.06 -0.40 0.00 0.08 0.00 0.00 29.97 30.77 2iv8 h ARG 919 CO 0.12 0.70 -0.67 0.00 -1.07 0.00 0.00 179.97 179.05 2iv8 s ALA 920 N -4.75 3.10 -2.00 0.04 0.00 -1.26 -5.04 121.76 111.85 2iv8 s ALA 920 Ca -0.08 -2.89 0.11 0.00 0.00 0.00 0.00 51.96 49.10 2iv8 s ALA 920 Cb 0.14 -2.07 0.64 0.00 0.00 0.00 0.00 23.12 21.83 2iv8 s ALA 920 CO 0.79 -1.85 1.11 -0.35 0.00 0.00 0.00 175.76 175.46 2iv8 n PRO 921 N 3.72 0.56 0.13 0.00 -0.04 -1.25 -2.93 135.00 135.19 2iv8 n PRO 921 Ca 0.04 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.55 2iv8 n PRO 921 Cb 0.37 -1.30 0.03 0.00 -0.04 0.00 0.00 33.50 32.57 2iv8 n PRO 921 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2iv8 h GLU 922 N 0.00 0.00 -0.31 0.54 9.09 -1.96 -2.96 114.58 118.98 2iv8 h GLU 922 Ca 0.00 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.32 2iv8 h GLU 922 Cb 0.00 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.08 2iv8 h GLU 922 CO 0.00 0.32 -0.18 0.28 0.05 0.00 0.00 179.01 179.48 2iv8 h VAL 923 N 0.00 1.25 -0.60 -1.06 2.07 -1.98 -3.34 116.25 112.60 2iv8 h VAL 923 Ca -0.03 -1.18 0.03 0.00 0.82 0.00 0.00 66.70 66.34 2iv8 h VAL 923 Cb 1.31 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 32.25 2iv8 h VAL 923 CO 0.04 0.38 0.36 0.28 0.02 0.00 0.00 177.57 178.66 2iv8 h SER 924 N 0.51 0.59 -0.13 0.57 0.02 -1.74 0.16 113.55 113.53 2iv8 h SER 924 Ca 0.08 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 61.07 2iv8 h SER 924 Cb 0.60 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 2iv8 h SER 924 CO 0.04 0.41 0.20 -0.61 -1.14 0.00 0.00 176.83 175.74 2iv8 h GLN 925 N 0.72 0.00 0.03 3.45 4.15 -1.74 0.62 115.11 122.34 2iv8 h GLN 925 Ca 0.24 0.00 -0.28 0.00 0.77 0.00 0.00 58.65 59.38 2iv8 h GLN 925 Cb 0.02 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.68 2iv8 h GLN 925 CO -0.10 0.00 -1.52 1.88 -1.93 0.00 0.00 178.83 177.16 2iv8 h TYR 926 N 0.00 0.13 0.02 3.99 0.05 -0.92 -2.83 116.97 117.41 2iv8 h TYR 926 Ca 0.06 -0.09 -0.00 0.00 0.05 0.00 0.00 58.73 58.75 2iv8 h TYR 926 Cb 0.46 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.20 2iv8 h TYR 926 CO 0.00 1.13 -0.01 0.82 -1.05 0.00 0.00 178.16 179.06 2iv8 h ILE 927 N 0.02 1.19 -0.20 -2.88 1.08 -0.67 -2.32 117.51 113.73 2iv8 h ILE 927 Ca -0.22 -0.62 0.02 0.00 -0.39 0.00 0.00 64.86 63.64 2iv8 h ILE 927 Cb 1.96 1.61 -0.02 0.00 -3.07 0.00 0.00 36.82 37.29 2iv8 h ILE 927 CO 0.11 0.16 -0.12 0.00 -0.69 0.00 0.00 178.15 177.61 2iv8 n TYR 928 N -4.97 -0.09 -0.54 1.37 9.36 -0.26 -0.88 117.16 121.15 2iv8 n TYR 928 Ca -0.08 0.25 0.44 0.00 3.32 0.00 0.00 57.90 61.83 2iv8 n TYR 928 Cb 0.16 -0.48 0.71 0.00 -0.63 0.00 0.00 39.34 39.09 2iv8 n TYR 928 CO 0.00 0.00 0.00 0.94 0.22 0.00 0.00 176.86 178.02 2iv8 n GLN 929 N -3.40 -0.02 -0.00 2.98 7.27 -0.90 0.11 117.38 123.41 2iv8 n GLN 929 Ca 0.00 1.15 0.03 0.00 0.07 0.00 0.00 57.00 58.26 2iv8 n GLN 929 Cb 0.05 -2.40 -0.04 0.00 2.41 0.00 0.00 30.24 30.26 2iv8 n GLN 929 CO 0.00 0.00 0.00 1.55 0.07 0.00 0.00 177.06 178.68 2iv8 n VAL 930 N -4.36 0.00 0.03 1.69 3.14 -0.61 -1.99 118.33 116.22 2iv8 n VAL 930 Ca 0.41 -0.30 -0.13 0.00 -2.96 0.00 0.00 64.34 61.36 2iv8 n VAL 930 Cb 1.68 0.83 -0.09 0.00 -1.06 0.00 0.00 33.84 35.20 2iv8 n VAL 930 CO 0.00 0.00 0.00 0.22 -6.46 0.00 0.00 176.83 170.59 2iv8 h TYR 931 N 0.00 -0.05 -0.21 1.45 5.03 -0.03 -2.68 116.97 120.47 2iv8 h TYR 931 Ca 0.00 -0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.34 2iv8 h TYR 931 Cb 0.18 0.02 -0.05 0.00 1.55 0.00 0.00 36.73 38.43 2iv8 h TYR 931 CO 0.00 0.27 -0.32 0.22 -1.32 0.00 0.00 178.16 177.01 2iv8 h ASP 932 N -0.39 -1.07 -0.40 -2.11 3.58 -0.38 -0.50 116.42 115.16 2iv8 h ASP 932 Ca -0.01 0.14 0.08 0.00 0.42 0.00 0.00 57.03 57.66 2iv8 h ASP 932 Cb 0.35 0.43 -0.09 0.00 1.72 0.00 0.00 39.33 41.74 2iv8 h ASP 932 CO 0.01 -0.24 -0.31 0.28 -2.88 0.00 0.00 179.24 176.10 2iv8 h SER 933 N -0.25 -1.04 -0.32 2.28 0.02 -1.48 -0.09 113.55 112.68 2iv8 h SER 933 Ca 0.04 0.19 0.04 0.00 -0.84 0.00 0.00 61.79 61.21 2iv8 h SER 933 Cb 0.35 0.49 -0.06 0.00 0.14 0.00 0.00 62.40 63.33 2iv8 h SER 933 CO -0.33 -0.31 -0.37 0.40 -1.14 0.00 0.00 176.83 175.08 2iv8 h ILE 934 N -0.24 0.00 -0.09 3.27 2.04 -1.11 0.87 117.51 122.25 2iv8 h ILE 934 Ca 0.18 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.06 2iv8 h ILE 934 Cb 0.53 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2iv8 h ILE 934 CO -0.53 0.00 0.11 -0.07 0.00 0.00 0.00 178.15 177.66 2iv8 h LEU 935 N -0.22 0.00 0.16 1.44 3.38 0.48 0.63 115.31 121.19 2iv8 h LEU 935 Ca 0.05 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.77 2iv8 h LEU 935 Cb 0.37 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.15 2iv8 h LEU 935 CO -0.42 0.00 -1.11 0.11 0.09 0.00 0.00 178.44 177.11 2iv8 h LYS 936 N 0.00 0.46 -0.02 1.13 1.57 -0.48 -3.47 116.57 115.76 2iv8 h LYS 936 Ca 0.05 -0.72 0.00 0.00 -1.87 0.00 0.00 60.65 58.11 2iv8 h LYS 936 Cb 0.26 0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.83 2iv8 h LYS 936 CO -0.00 1.33 0.00 0.09 -0.57 0.00 0.00 179.45 180.30