#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iv9 n GLY 706 N 0.00 -0.26 3.72 -0.02 0.00 -1.22 -4.84 105.19 102.57 2iv9 n GLY 706 Ca 0.00 -1.89 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 2iv9 n GLY 706 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2iv9 s TYR 707 N -3.29 2.94 -0.13 1.61 5.04 -1.26 -5.02 117.35 117.24 2iv9 s TYR 707 Ca 0.67 0.49 0.02 0.00 -2.44 0.00 0.00 57.07 55.81 2iv9 s TYR 707 Cb -0.03 -4.01 0.01 0.00 0.35 0.00 0.00 41.96 38.29 2iv9 s TYR 707 CO 0.45 -3.79 -0.19 0.08 -1.34 0.00 0.00 175.55 170.77 2iv9 s VAL 708 N 1.31 1.79 0.46 3.14 1.01 -1.26 -4.93 120.40 121.93 2iv9 s VAL 708 Ca 0.72 -0.82 -0.23 0.00 0.00 0.00 0.00 61.98 61.65 2iv9 s VAL 708 Cb -0.45 -1.61 -0.07 0.00 0.00 0.00 0.00 36.38 34.24 2iv9 s VAL 708 CO 0.32 0.50 1.18 0.00 0.00 0.00 0.00 175.10 177.10 2iv9 s ALA 709 N 0.91 2.98 0.46 5.51 0.00 -1.26 -4.99 121.76 125.37 2iv9 s ALA 709 Ca -0.07 0.97 -0.23 0.00 0.00 0.00 0.00 51.96 52.63 2iv9 s ALA 709 Cb -0.15 -3.40 -0.10 0.00 0.00 0.00 0.00 23.12 19.48 2iv9 s ALA 709 CO -0.02 -0.69 0.96 -2.30 0.00 0.00 0.00 175.76 173.71 2iv9 n PRO 710 N -0.47 1.21 -1.71 0.00 -0.02 -1.26 -4.79 135.00 127.95 2iv9 n PRO 710 Ca 0.07 0.44 -0.39 0.00 -2.02 0.00 0.00 63.50 61.60 2iv9 n PRO 710 Cb 0.48 -2.03 0.04 0.00 -0.02 0.00 0.00 33.50 31.97 2iv9 n PRO 710 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2iv9 n LYS 711 N -0.04 1.60 -4.27 -0.52 5.02 -1.26 -4.80 118.16 113.89 2iv9 n LYS 711 Ca 0.10 0.59 -0.20 0.00 -2.02 0.00 0.00 58.31 56.78 2iv9 n LYS 711 Cb 0.41 -2.46 -0.11 0.00 -0.02 0.00 0.00 35.03 32.84 2iv9 n LYS 711 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2iv9 s ALA 712 N -1.31 1.65 -0.87 7.82 0.00 -0.57 -4.84 121.76 123.64 2iv9 s ALA 712 Ca 0.70 -1.31 -0.25 0.00 0.00 0.00 0.00 51.96 51.10 2iv9 s ALA 712 Cb -0.44 -0.13 0.04 0.00 0.00 0.00 0.00 23.12 22.59 2iv9 s ALA 712 CO 0.51 0.18 1.35 0.08 0.00 0.00 0.00 175.76 177.88 2iv9 s VAL 713 N -1.89 3.85 0.24 0.00 1.01 -1.26 -1.05 120.40 121.29 2iv9 s VAL 713 Ca 0.09 -0.20 0.09 0.00 0.00 0.00 0.00 61.98 61.97 2iv9 s VAL 713 Cb -0.06 -4.98 -0.07 0.00 0.00 0.00 0.00 36.38 31.27 2iv9 s VAL 713 CO 0.04 -1.88 1.53 -0.50 0.00 0.00 0.00 175.10 174.29 2iv9 h TRP 714 N 9.88 0.01 -2.88 5.22 6.55 -1.58 -3.41 115.95 129.74 2iv9 h TRP 714 Ca -0.05 -0.01 -0.53 0.00 0.95 0.00 0.00 58.89 59.26 2iv9 h TRP 714 Cb 1.03 -0.00 -0.40 0.00 -0.86 0.00 0.00 29.16 28.93 2iv9 h TRP 714 CO 1.20 0.72 -0.77 -1.17 -1.05 0.00 0.00 178.44 177.36 2iv9 s LEU 715 N -7.41 0.76 0.50 -4.49 2.96 -0.86 -4.72 118.68 105.41 2iv9 s LEU 715 Ca -0.01 -1.25 -0.21 0.00 -0.22 0.00 0.00 54.13 52.44 2iv9 s LEU 715 Cb 0.12 -0.41 -0.07 0.00 0.50 0.00 0.00 46.19 46.33 2iv9 s LEU 715 CO 0.78 -0.42 1.10 -2.84 -1.32 0.00 0.00 176.35 173.65 2iv9 s PRO 716 N 2.03 3.64 0.21 0.98 0.02 -1.26 -1.11 135.00 139.51 2iv9 s PRO 716 Ca 0.08 1.56 -0.09 0.00 0.02 0.00 0.00 61.00 62.58 2iv9 s PRO 716 Cb -0.16 -2.16 0.26 0.00 0.02 0.00 0.00 34.50 32.46 2iv9 s PRO 716 CO -0.32 -0.60 1.80 0.00 -0.33 0.00 0.00 177.00 177.56 2iv9 h ALA 717 N 1.60 0.92 0.00 -1.55 0.00 -1.86 -2.08 119.26 116.29 2iv9 h ALA 717 Ca -0.50 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2iv9 h ALA 717 Cb 1.24 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2iv9 h ALA 717 CO 0.59 0.04 0.00 -0.39 0.00 0.00 0.00 179.25 179.49 2iv9 h VAL 718 N 0.68 0.00 -0.01 0.00 -1.51 -1.92 -0.11 116.25 113.38 2iv9 h VAL 718 Ca 0.31 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 65.71 2iv9 h VAL 718 Cb 0.22 0.66 0.00 0.00 -2.13 0.00 0.00 31.29 30.04 2iv9 h VAL 718 CO -0.20 0.00 -0.67 0.29 -1.23 0.00 0.00 177.57 175.77 2iv9 n LYS 719 N -2.35 0.54 -1.63 5.19 5.02 -0.79 -4.51 118.16 119.64 2iv9 n LYS 719 Ca -0.01 -0.43 0.02 0.00 -2.02 0.00 0.00 58.31 55.88 2iv9 n LYS 719 Cb 0.09 -1.49 0.06 0.00 -0.02 0.00 0.00 35.03 33.66 2iv9 n LYS 719 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2iv9 n ALA 720 N -0.85 2.75 -3.82 7.82 0.00 -0.13 -5.00 120.51 121.27 2iv9 n ALA 720 Ca 0.07 -2.65 -0.23 0.00 0.00 0.00 0.00 53.44 50.63 2iv9 n ALA 720 Cb 0.38 -0.68 0.01 0.00 0.00 0.00 0.00 19.45 19.16 2iv9 n ALA 720 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2iv9 n LYS 721 N -0.03 -4.11 0.00 0.00 5.02 -0.79 -1.67 118.16 116.59 2iv9 n LYS 721 Ca 0.10 0.51 0.00 0.00 -2.02 0.00 0.00 58.31 56.90 2iv9 n LYS 721 Cb 1.00 -4.86 0.00 0.00 -0.02 0.00 0.00 35.03 31.16 2iv9 n LYS 721 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2iv9 n GLY 722 N -1.78 3.34 3.66 0.72 0.00 -0.75 -4.68 105.19 105.71 2iv9 n GLY 722 Ca -0.31 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 2iv9 n GLY 722 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2iv9 s LEU 723 N 0.00 4.15 -0.11 0.99 2.96 -0.67 -0.66 118.68 125.35 2iv9 s LEU 723 Ca 0.00 1.62 0.01 0.00 -0.22 0.00 0.00 54.13 55.54 2iv9 s LEU 723 Cb 0.00 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.14 2iv9 s LEU 723 CO 0.00 -0.76 -0.15 -0.70 -1.32 0.00 0.00 176.35 173.42 2iv9 s GLU 724 N 3.49 3.18 -0.14 1.98 2.12 -0.68 -3.44 118.70 125.20 2iv9 s GLU 724 Ca 0.53 -0.72 0.00 0.00 0.36 0.00 0.00 54.97 55.14 2iv9 s GLU 724 Cb -0.20 -2.53 0.02 0.00 0.26 0.00 0.00 34.13 31.68 2iv9 s GLU 724 CO 0.14 0.28 -0.13 0.42 -0.54 0.00 0.00 175.26 175.43 2iv9 s ILE 725 N 0.17 1.48 0.02 -3.70 1.01 -0.27 -0.71 121.20 119.20 2iv9 s ILE 725 Ca -0.08 -0.59 0.00 0.00 0.00 0.00 0.00 60.65 59.98 2iv9 s ILE 725 Cb -0.15 -1.41 -0.04 0.00 0.01 0.00 0.00 42.46 40.86 2iv9 s ILE 725 CO 0.05 0.43 0.10 -0.44 0.00 0.00 0.00 174.94 175.09 2iv9 s SER 726 N 1.52 5.78 0.12 3.58 0.01 -0.18 -1.41 113.70 123.13 2iv9 s SER 726 Ca 0.05 0.15 -0.24 0.00 1.31 0.00 0.00 55.95 57.21 2iv9 s SER 726 Cb -0.13 -1.67 0.07 0.00 0.21 0.00 0.00 66.02 64.50 2iv9 s SER 726 CO -0.10 0.24 0.59 -0.83 0.41 0.00 0.00 173.24 173.55 2iv9 s GLY 727 N -1.97 -0.58 0.35 3.44 0.00 -0.22 0.02 107.32 108.36 2iv9 s GLY 727 Ca 0.26 0.59 -0.06 0.00 0.00 0.00 0.00 44.72 45.51 2iv9 s GLY 727 CO 0.17 0.27 0.54 -1.08 0.00 0.00 0.00 173.10 173.00 2iv9 s THR 728 N -3.26 0.00 -0.03 0.90 -1.32 -0.17 -1.52 115.64 110.24 2iv9 s THR 728 Ca -0.01 -1.46 0.07 0.00 -1.21 0.00 0.00 61.69 59.08 2iv9 s THR 728 Cb -0.01 -2.66 -0.02 0.00 -1.51 0.00 0.00 72.50 68.30 2iv9 s THR 728 CO -0.09 0.00 -0.24 -0.36 -2.21 0.00 0.00 174.62 171.73 2iv9 s PHE 729 N -2.95 2.19 0.15 9.09 0.40 -1.26 -0.83 117.98 124.77 2iv9 s PHE 729 Ca 0.27 -0.48 0.06 0.00 -0.60 0.00 0.00 56.93 56.17 2iv9 s PHE 729 Cb -0.01 -1.42 -0.04 0.00 0.51 0.00 0.00 43.02 42.05 2iv9 s PHE 729 CO 0.18 -0.09 -0.13 0.95 0.70 0.00 0.00 175.22 176.83 2iv9 s THR 730 N -0.44 1.41 -0.27 0.64 -4.23 -0.64 -4.58 115.64 107.53 2iv9 s THR 730 Ca 0.06 -1.94 -0.02 0.00 -1.18 0.00 0.00 61.69 58.61 2iv9 s THR 730 Cb -0.10 -1.76 0.09 0.00 1.34 0.00 0.00 72.50 72.07 2iv9 s THR 730 CO 0.00 -0.54 0.08 -2.28 -0.54 0.00 0.00 174.62 171.33 2iv9 s HIS 731 N -2.66 1.45 -0.12 3.99 2.46 -1.26 -1.01 115.29 118.13 2iv9 s HIS 731 Ca 0.15 -1.43 0.03 0.00 0.47 0.00 0.00 55.06 54.27 2iv9 s HIS 731 Cb -0.02 -1.45 0.01 0.00 -0.13 0.00 0.00 32.58 30.98 2iv9 s HIS 731 CO 0.03 -0.80 -0.21 1.03 -2.47 0.00 0.00 174.74 172.32 2iv9 s ARG 732 N 1.71 2.89 -1.13 2.88 3.00 0.49 -4.74 118.95 124.05 2iv9 s ARG 732 Ca 0.06 -0.81 -0.30 0.00 0.00 0.00 0.00 55.73 54.68 2iv9 s ARG 732 Cb -0.17 -2.30 0.04 0.00 0.00 0.00 0.00 34.95 32.52 2iv9 s ARG 732 CO -0.21 0.03 0.65 0.00 0.00 0.00 0.00 175.30 175.78 2iv9 n GLN 733 N 3.93 -0.40 -0.97 3.54 -0.00 -1.26 -0.48 117.38 121.74 2iv9 n GLN 733 Ca -0.20 0.14 0.00 0.00 -0.00 0.00 0.00 57.00 56.94 2iv9 n GLN 733 Cb 0.52 -2.31 0.00 0.00 -0.00 0.00 0.00 30.24 28.45 2iv9 n GLN 733 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2iv9 n GLY 734 N -2.02 0.21 3.32 2.61 0.00 -1.26 -4.99 105.19 103.06 2iv9 n GLY 734 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 2iv9 n GLY 734 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2iv9 s HIS 735 N -1.44 2.45 -0.12 1.61 3.76 0.37 -5.12 115.29 116.79 2iv9 s HIS 735 Ca 0.00 -0.54 -0.13 0.00 -0.15 0.00 0.00 55.06 54.24 2iv9 s HIS 735 Cb 0.00 -1.58 -0.05 0.00 1.11 0.00 0.00 32.58 32.07 2iv9 s HIS 735 CO 0.00 -0.10 0.29 0.42 -0.85 0.00 0.00 174.74 174.51 2iv9 s ILE 736 N -0.39 5.28 0.00 0.60 1.01 -1.26 -0.38 121.20 126.07 2iv9 s ILE 736 Ca 0.03 0.56 0.05 0.00 0.00 0.00 0.00 60.65 61.29 2iv9 s ILE 736 Cb -0.12 -3.61 -0.02 0.00 0.01 0.00 0.00 42.46 38.72 2iv9 s ILE 736 CO 0.02 0.46 -0.16 -0.31 0.00 0.00 0.00 174.94 174.95 2iv9 s TYR 737 N -0.07 1.40 -0.41 3.97 1.51 -0.18 0.21 117.35 123.77 2iv9 s TYR 737 Ca 0.18 -0.29 -0.20 0.00 -1.01 0.00 0.00 57.07 55.75 2iv9 s TYR 737 Cb -0.14 -0.88 0.02 0.00 -0.11 0.00 0.00 41.96 40.85 2iv9 s TYR 737 CO 0.06 0.00 0.58 1.41 -1.11 0.00 0.00 175.55 176.49 2iv9 s MET 738 N -0.61 3.37 -0.42 -0.62 -2.45 0.11 -1.62 119.30 117.06 2iv9 s MET 738 Ca 0.05 -0.34 -0.15 0.00 -1.25 0.00 0.00 55.69 54.00 2iv9 s MET 738 Cb -0.07 -3.91 0.03 0.00 1.25 0.00 0.00 34.83 32.14 2iv9 s MET 738 CO 0.00 -0.87 0.32 -1.21 1.05 0.00 0.00 175.02 174.31 2iv9 s GLU 739 N 2.60 2.97 0.11 4.11 0.41 -0.01 -0.57 118.70 128.33 2iv9 s GLU 739 Ca 0.20 -1.08 0.09 0.00 -0.41 0.00 0.00 54.97 53.78 2iv9 s GLU 739 Cb -0.15 -4.01 -0.04 0.00 -1.78 0.00 0.00 34.13 28.16 2iv9 s GLU 739 CO 0.16 -0.80 -0.24 -1.64 -0.49 0.00 0.00 175.26 172.25 2iv9 s MET 740 N 1.68 1.29 -0.24 1.61 -1.94 -0.04 -1.00 119.30 120.65 2iv9 s MET 740 Ca 0.05 -1.24 -0.01 0.00 -1.71 0.00 0.00 55.69 52.79 2iv9 s MET 740 Cb -0.20 -1.65 0.03 0.00 2.01 0.00 0.00 34.83 35.02 2iv9 s MET 740 CO 0.09 0.39 -0.08 1.21 -0.01 0.00 0.00 175.02 176.62 2iv9 s ASN 741 N -1.92 4.22 -0.25 3.03 2.47 0.10 0.29 114.94 122.88 2iv9 s ASN 741 Ca 0.10 -0.94 -0.12 0.00 0.42 0.00 0.00 52.86 52.32 2iv9 s ASN 741 Cb -0.10 -1.63 -0.05 0.00 -1.45 0.00 0.00 41.25 38.03 2iv9 s ASN 741 CO 0.05 -0.13 0.25 -0.36 -3.72 0.00 0.00 177.10 173.19 2iv9 s PHE 742 N 1.29 3.28 -0.08 0.43 0.40 0.00 -1.01 117.98 122.29 2iv9 s PHE 742 Ca -0.01 0.30 0.04 0.00 -0.60 0.00 0.00 56.93 56.66 2iv9 s PHE 742 Cb -0.17 -2.41 -0.01 0.00 0.51 0.00 0.00 43.02 40.95 2iv9 s PHE 742 CO -0.05 -0.07 -0.23 0.99 0.70 0.00 0.00 175.22 176.56 2iv9 s THR 743 N 1.52 2.23 -0.53 0.64 2.01 0.11 -0.93 115.64 120.69 2iv9 s THR 743 Ca 0.11 -0.98 -0.20 0.00 0.31 0.00 0.00 61.69 60.92 2iv9 s THR 743 Cb -0.15 -1.85 0.06 0.00 0.01 0.00 0.00 72.50 70.58 2iv9 s THR 743 CO 0.08 0.56 0.72 0.21 -0.69 0.00 0.00 174.62 175.50 2iv9 s ASN 744 N 0.06 6.24 0.00 3.53 3.84 -0.83 -1.68 114.94 126.10 2iv9 s ASN 744 Ca -0.10 -0.86 0.20 0.00 0.21 0.00 0.00 52.86 52.31 2iv9 s ASN 744 Cb -0.15 -2.33 0.52 0.00 -0.55 0.00 0.00 41.25 38.74 2iv9 s ASN 744 CO 0.06 -1.02 1.44 0.29 -2.79 0.00 0.00 177.10 175.08 2iv9 n LYS 745 N 6.54 2.67 -1.69 0.43 5.02 0.16 0.93 118.16 132.23 2iv9 n LYS 745 Ca -0.05 -2.43 -0.20 0.00 -2.02 0.00 0.00 58.31 53.61 2iv9 n LYS 745 Cb 0.45 -1.49 0.13 0.00 -0.02 0.00 0.00 35.03 34.10 2iv9 n LYS 745 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2iv9 n ALA 746 N 1.35 -0.59 0.11 7.82 0.00 -1.25 -4.82 120.51 123.15 2iv9 n ALA 746 Ca 0.20 -1.36 0.11 0.00 0.00 0.00 0.00 53.44 52.40 2iv9 n ALA 746 Cb 0.57 0.07 -0.14 0.00 0.00 0.00 0.00 19.45 19.94 2iv9 n ALA 746 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2iv9 n LEU 747 N 0.00 0.19 -4.91 0.00 4.77 -1.26 -4.54 117.00 111.24 2iv9 n LEU 747 Ca 0.12 -0.02 -0.30 0.00 -0.03 0.00 0.00 56.01 55.78 2iv9 n LEU 747 Cb 0.43 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.47 2iv9 n LEU 747 CO 0.31 0.01 -0.01 -1.58 -1.33 0.00 0.00 177.39 174.78 2iv9 s GLN 748 N -3.45 3.54 0.59 3.23 0.74 -1.26 -4.79 119.66 118.27 2iv9 s GLN 748 Ca -0.05 -0.27 -0.18 0.00 0.05 0.00 0.00 55.36 54.90 2iv9 s GLN 748 Cb 0.14 -2.89 -0.04 0.00 1.10 0.00 0.00 33.01 31.32 2iv9 s GLN 748 CO 0.89 0.48 1.18 -1.01 -0.55 0.00 0.00 175.29 176.27 2iv9 s HIS 749 N -1.70 2.47 -0.09 1.67 3.76 -1.26 -4.46 115.29 115.68 2iv9 s HIS 749 Ca 0.39 1.53 0.02 0.00 -0.15 0.00 0.00 55.06 56.85 2iv9 s HIS 749 Cb -0.12 -3.40 -0.02 0.00 1.11 0.00 0.00 32.58 30.15 2iv9 s HIS 749 CO 0.27 -2.00 -0.14 -1.64 -0.85 0.00 0.00 174.74 170.38 2iv9 s MET 750 N -3.41 2.92 0.33 1.40 -1.94 0.10 -4.95 119.30 113.74 2iv9 s MET 750 Ca 0.75 -0.71 0.05 0.00 -1.71 0.00 0.00 55.69 54.07 2iv9 s MET 750 Cb -0.27 -2.48 -0.02 0.00 2.01 0.00 0.00 34.83 34.07 2iv9 s MET 750 CO 0.32 0.42 0.33 0.25 -0.01 0.00 0.00 175.02 176.34 2iv9 n THR 751 N 2.92 0.00 -3.41 2.05 -2.24 -1.26 -0.63 114.28 111.71 2iv9 n THR 751 Ca -0.18 -2.18 -0.23 0.00 -2.27 0.00 0.00 64.05 59.19 2iv9 n THR 751 Cb 0.52 1.15 0.07 0.00 -2.10 0.00 0.00 70.33 69.97 2iv9 n THR 751 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2iv9 n ASP 752 N -1.70 -6.26 -4.74 3.42 8.00 -1.26 -0.98 116.55 113.03 2iv9 n ASP 752 Ca 0.06 -0.46 -0.41 0.00 0.71 0.00 0.00 54.79 54.69 2iv9 n ASP 752 Cb 0.58 -4.94 -0.03 0.00 -0.02 0.00 0.00 41.12 36.71 2iv9 n ASP 752 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2iv9 s PHE 753 N -3.27 3.25 0.05 1.24 0.08 -1.26 -3.95 117.98 114.12 2iv9 s PHE 753 Ca 0.49 1.30 -0.15 0.00 0.12 0.00 0.00 56.93 58.70 2iv9 s PHE 753 Cb -0.22 -3.59 0.02 0.00 -0.57 0.00 0.00 43.02 38.67 2iv9 s PHE 753 CO 0.61 -1.75 0.33 0.00 -0.10 0.00 0.00 175.22 174.32 2iv9 s ALA 754 N -0.22 -0.77 0.03 5.36 0.00 -0.92 -4.53 121.76 120.72 2iv9 s ALA 754 Ca 0.54 0.07 0.02 0.00 0.00 0.00 0.00 51.96 52.60 2iv9 s ALA 754 Cb -0.37 0.34 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 2iv9 s ALA 754 CO 0.41 -0.43 -0.07 -1.50 0.00 0.00 0.00 175.76 174.16 2iv9 s ILE 755 N -2.60 0.52 -0.04 0.00 2.07 -1.26 -1.08 121.20 118.82 2iv9 s ILE 755 Ca -0.05 -0.82 -0.03 0.00 -1.41 0.00 0.00 60.65 58.34 2iv9 s ILE 755 Cb -0.01 -0.54 0.01 0.00 0.13 0.00 0.00 42.46 42.06 2iv9 s ILE 755 CO -0.03 -0.22 0.10 -1.58 -1.91 0.00 0.00 174.94 171.29 2iv9 s GLN 756 N -1.13 0.10 -0.17 3.50 0.74 -0.08 -4.87 119.66 117.76 2iv9 s GLN 756 Ca -0.06 0.17 -0.07 0.00 0.05 0.00 0.00 55.36 55.45 2iv9 s GLN 756 Cb -0.08 0.01 -0.04 0.00 1.10 0.00 0.00 33.01 34.00 2iv9 s GLN 756 CO 0.00 -0.04 0.08 -0.06 -0.55 0.00 0.00 175.29 174.72 2iv9 s PHE 757 N 0.25 3.31 0.79 1.67 0.40 -1.26 -0.57 117.98 122.57 2iv9 s PHE 757 Ca -0.02 0.18 -0.12 0.00 -0.60 0.00 0.00 56.93 56.38 2iv9 s PHE 757 Cb -0.03 -2.05 0.07 0.00 0.51 0.00 0.00 43.02 41.52 2iv9 s PHE 757 CO -0.01 0.28 1.13 1.21 0.70 0.00 0.00 175.22 178.53 2iv9 s ASN 758 N 0.08 4.11 0.32 1.36 2.47 -0.15 -4.98 114.94 118.15 2iv9 s ASN 758 Ca 0.06 2.04 -0.26 0.00 0.42 0.00 0.00 52.86 55.12 2iv9 s ASN 758 Cb -0.12 -2.55 -0.14 0.00 -1.45 0.00 0.00 41.25 36.99 2iv9 s ASN 758 CO 0.00 -2.30 0.69 0.29 -3.72 0.00 0.00 177.10 172.06 2iv9 n LYS 759 N -3.41 0.67 -4.05 0.43 5.02 -1.26 -4.74 118.16 110.82 2iv9 n LYS 759 Ca 0.11 0.24 -0.11 0.00 -2.02 0.00 0.00 58.31 56.52 2iv9 n LYS 759 Cb 0.52 -1.47 -0.05 0.00 -0.02 0.00 0.00 35.03 34.01 2iv9 n LYS 759 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2iv9 s ASN 760 N -0.83 0.32 0.25 4.39 2.20 -1.20 -4.58 114.94 115.48 2iv9 s ASN 760 Ca 0.62 -1.20 -0.06 0.00 -0.94 0.00 0.00 52.86 51.28 2iv9 s ASN 760 Cb -0.73 0.60 0.29 0.00 -2.00 0.00 0.00 41.25 39.41 2iv9 s ASN 760 CO 0.58 -1.19 1.91 0.28 -2.94 0.00 0.00 177.10 175.75 2iv9 h SER 761 N 2.23 1.10 -0.48 3.54 0.02 -1.43 -1.92 113.55 116.61 2iv9 h SER 761 Ca -0.28 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 2iv9 h SER 761 Cb 1.25 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.52 2iv9 h SER 761 CO 0.39 0.77 0.00 0.49 -1.14 0.00 0.00 176.83 177.34 2iv9 n PHE 762 N -4.43 0.95 -2.04 3.45 3.72 -1.26 -4.69 117.46 113.16 2iv9 n PHE 762 Ca 0.12 -0.60 -0.15 0.00 -0.05 0.00 0.00 57.45 56.77 2iv9 n PHE 762 Cb 0.05 -0.14 -0.02 0.00 -0.94 0.00 0.00 39.48 38.43 2iv9 n PHE 762 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2iv9 n GLY 763 N 0.68 0.25 3.74 1.37 0.00 -1.06 -4.74 105.19 105.43 2iv9 n GLY 763 Ca 0.20 -0.29 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 2iv9 n GLY 763 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2iv9 s VAL 764 N -2.68 3.07 -0.15 1.61 1.01 -1.26 -0.57 120.40 121.44 2iv9 s VAL 764 Ca 0.00 0.91 -0.24 0.00 0.00 0.00 0.00 61.98 62.65 2iv9 s VAL 764 Cb 0.00 -3.58 0.06 0.00 0.00 0.00 0.00 36.38 32.86 2iv9 s VAL 764 CO 0.00 0.15 0.61 -0.51 0.00 0.00 0.00 175.10 175.35 2iv9 s ILE 765 N -0.08 0.01 0.45 2.22 2.07 -0.44 -4.77 121.20 120.66 2iv9 s ILE 765 Ca 0.56 -0.05 -0.25 0.00 -1.41 0.00 0.00 60.65 59.50 2iv9 s ILE 765 Cb -0.38 -0.89 -0.08 0.00 0.13 0.00 0.00 42.46 41.25 2iv9 s ILE 765 CO 0.41 -0.03 1.40 -2.84 -1.91 0.00 0.00 174.94 171.97 2iv9 s PRO 766 N -0.33 3.69 0.19 3.50 0.02 -1.26 -1.04 135.00 139.77 2iv9 s PRO 766 Ca -0.05 2.36 0.24 0.00 0.02 0.00 0.00 61.00 63.57 2iv9 s PRO 766 Cb -0.03 -2.64 0.38 0.00 0.02 0.00 0.00 34.50 32.23 2iv9 s PRO 766 CO 0.04 -0.80 1.40 0.77 -0.33 0.00 0.00 177.00 178.09 2iv9 h SER 767 N 2.31 0.00 -5.18 2.53 0.02 -1.29 -3.44 113.55 108.50 2iv9 h SER 767 Ca -0.51 -0.11 -0.09 0.00 -0.84 0.00 0.00 61.79 60.24 2iv9 h SER 767 Cb 1.27 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.67 2iv9 h SER 767 CO 0.61 0.05 -0.40 0.42 -1.14 0.00 0.00 176.83 176.38 2iv9 s THR 768 N -3.19 0.14 0.71 -2.27 -4.23 -1.26 -5.07 115.64 100.47 2iv9 s THR 768 Ca 0.06 -1.26 -0.16 0.00 -1.18 0.00 0.00 61.69 59.15 2iv9 s THR 768 Cb 0.11 -1.41 0.02 0.00 1.34 0.00 0.00 72.50 72.57 2iv9 s THR 768 CO 0.70 -0.65 1.17 -2.65 -0.54 0.00 0.00 174.62 172.65 2iv9 n PRO 769 N -0.06 0.68 -0.06 3.99 -0.02 -1.26 -4.93 135.00 133.35 2iv9 n PRO 769 Ca -0.14 0.30 0.05 0.00 -2.02 0.00 0.00 63.50 61.68 2iv9 n PRO 769 Cb 0.62 -2.41 0.41 0.00 -0.02 0.00 0.00 33.50 32.10 2iv9 n PRO 769 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2iv9 h LEU 770 N -0.08 0.52 -3.08 2.45 5.85 -1.89 -3.47 115.31 115.60 2iv9 h LEU 770 Ca -0.49 -0.01 -0.25 0.00 0.84 0.00 0.00 57.88 57.97 2iv9 h LEU 770 Cb 1.33 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.23 2iv9 h LEU 770 CO 0.49 0.37 -0.58 0.00 -0.34 0.00 0.00 178.44 178.38 2iv9 n ALA 771 N -2.47 -2.66 -3.29 1.25 0.00 -1.26 -4.99 120.51 107.08 2iv9 n ALA 771 Ca 0.06 -0.12 -0.38 0.00 0.00 0.00 0.00 53.44 52.99 2iv9 n ALA 771 Cb 0.13 -1.13 -0.12 0.00 0.00 0.00 0.00 19.45 18.33 2iv9 n ALA 771 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2iv9 s ILE 772 N -2.97 3.86 -0.19 0.00 1.01 -1.26 -4.98 121.20 116.67 2iv9 s ILE 772 Ca 0.01 -1.29 -0.22 0.00 0.00 0.00 0.00 60.65 59.15 2iv9 s ILE 772 Cb -0.00 -3.28 -0.20 0.00 0.01 0.00 0.00 42.46 39.00 2iv9 s ILE 772 CO 0.83 -0.32 0.30 0.45 0.00 0.00 0.00 174.94 176.20 2iv9 h HIS 773 N 8.26 0.00 -3.31 3.97 3.86 -1.97 -3.43 115.15 122.52 2iv9 h HIS 773 Ca -0.22 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.46 2iv9 h HIS 773 Cb 1.08 0.00 0.06 0.00 1.06 0.00 0.00 27.41 29.61 2iv9 h HIS 773 CO 0.59 1.33 0.80 -0.08 0.86 0.00 0.00 177.93 181.43 2iv9 s THR 774 N -2.32 2.50 0.50 2.45 -1.32 -1.26 -4.97 115.64 111.22 2iv9 s THR 774 Ca -0.26 0.42 -0.22 0.00 -1.21 0.00 0.00 61.69 60.42 2iv9 s THR 774 Cb 0.04 -3.27 -0.06 0.00 -1.51 0.00 0.00 72.50 67.70 2iv9 s THR 774 CO 0.59 0.06 1.20 -2.84 -2.21 0.00 0.00 174.62 171.42 2iv9 s PRO 775 N -0.26 3.52 -0.29 7.08 0.02 -1.26 -4.98 135.00 138.83 2iv9 s PRO 775 Ca 0.61 1.83 -0.11 0.00 0.02 0.00 0.00 61.00 63.35 2iv9 s PRO 775 Cb -0.44 -2.28 -0.05 0.00 0.02 0.00 0.00 34.50 31.76 2iv9 s PRO 775 CO 0.43 -0.76 0.20 -1.17 -0.33 0.00 0.00 177.00 175.37 2iv9 s LEU 776 N -3.32 4.07 0.35 -5.54 2.96 0.19 -4.93 118.68 112.47 2iv9 s LEU 776 Ca 0.68 -0.05 -0.10 0.00 -0.22 0.00 0.00 54.13 54.44 2iv9 s LEU 776 Cb -0.30 -2.13 -0.07 0.00 0.50 0.00 0.00 46.19 44.20 2iv9 s LEU 776 CO 0.35 -0.07 0.70 -0.04 -1.32 0.00 0.00 176.35 175.97 2iv9 s MET 777 N 1.76 3.78 -0.05 1.98 -1.94 -1.26 -0.72 119.30 122.85 2iv9 s MET 777 Ca 0.07 0.38 -0.38 0.00 -1.71 0.00 0.00 55.69 54.05 2iv9 s MET 777 Cb -0.16 -2.48 -0.16 0.00 2.01 0.00 0.00 34.83 34.04 2iv9 s MET 777 CO 0.11 0.08 1.49 -2.30 -0.01 0.00 0.00 175.02 174.38 2iv9 n PRO 778 N -0.97 1.14 -0.90 2.03 -0.02 -1.26 -0.91 135.00 134.11 2iv9 n PRO 778 Ca 0.02 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2iv9 n PRO 778 Cb 0.54 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 2iv9 n PRO 778 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2iv9 n ASN 779 N 3.55 -0.89 -4.86 2.55 4.13 0.26 -5.02 115.26 114.98 2iv9 n ASN 779 Ca 0.21 0.00 -0.35 0.00 1.68 0.00 0.00 54.58 56.12 2iv9 n ASN 779 Cb 0.17 -0.82 -0.06 0.00 -1.54 0.00 0.00 39.78 37.53 2iv9 n ASN 779 CO 0.00 0.00 0.00 -1.58 0.28 0.00 0.00 177.26 175.96 2iv9 s GLN 780 N -0.33 3.79 0.11 3.52 0.74 -0.09 -4.87 119.66 122.53 2iv9 s GLN 780 Ca 0.00 0.22 0.08 0.00 0.05 0.00 0.00 55.36 55.71 2iv9 s GLN 780 Cb 0.00 -3.02 -0.04 0.00 1.10 0.00 0.00 33.01 31.05 2iv9 s GLN 780 CO 0.00 0.57 -0.20 -1.54 -0.55 0.00 0.00 175.29 173.57 2iv9 s SER 781 N -1.67 2.49 0.03 6.67 1.04 -1.26 -1.96 113.70 119.04 2iv9 s SER 781 Ca 0.32 -0.72 0.05 0.00 0.48 0.00 0.00 55.95 56.08 2iv9 s SER 781 Cb -0.14 -0.13 -0.02 0.00 0.10 0.00 0.00 66.02 65.82 2iv9 s SER 781 CO 0.17 0.02 -0.15 0.27 0.98 0.00 0.00 173.24 174.54 2iv9 s ILE 782 N -1.39 1.16 -0.34 -1.02 -4.36 -0.11 -4.98 121.20 110.16 2iv9 s ILE 782 Ca 0.08 -0.91 -0.14 0.00 -0.26 0.00 0.00 60.65 59.42 2iv9 s ILE 782 Cb -0.09 -1.02 -0.02 0.00 1.25 0.00 0.00 42.46 42.58 2iv9 s ILE 782 CO 0.05 0.11 0.29 -1.81 0.24 0.00 0.00 174.94 173.81 2iv9 s ASP 783 N -0.92 6.11 -0.10 4.36 1.01 -1.26 -0.82 116.67 125.05 2iv9 s ASP 783 Ca 0.03 -0.33 -0.02 0.00 0.71 0.00 0.00 52.55 52.94 2iv9 s ASP 783 Cb -0.07 -2.16 -0.03 0.00 1.01 0.00 0.00 42.92 41.66 2iv9 s ASP 783 CO 0.01 -0.27 0.00 -0.69 0.21 0.00 0.00 175.17 174.43 2iv9 s VAL 784 N 1.84 4.29 -0.34 -1.27 1.01 0.15 -4.98 120.40 121.10 2iv9 s VAL 784 Ca 0.08 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.83 2iv9 s VAL 784 Cb -0.17 -2.82 0.09 0.00 0.00 0.00 0.00 36.38 33.48 2iv9 s VAL 784 CO 0.11 0.59 0.05 -0.44 0.00 0.00 0.00 175.10 175.41 2iv9 s SER 785 N -0.69 4.86 -0.39 3.32 0.01 -1.26 -0.86 113.70 118.69 2iv9 s SER 785 Ca 0.11 -1.84 -0.16 0.00 1.31 0.00 0.00 55.95 55.36 2iv9 s SER 785 Cb -0.12 -1.68 0.01 0.00 0.21 0.00 0.00 66.02 64.44 2iv9 s SER 785 CO 0.02 -0.37 0.38 -0.22 0.41 0.00 0.00 173.24 173.47 2iv9 s LEU 786 N 1.06 4.73 0.24 2.44 2.96 0.27 -4.91 118.68 125.47 2iv9 s LEU 786 Ca 0.04 -0.54 -0.30 0.00 -0.22 0.00 0.00 54.13 53.12 2iv9 s LEU 786 Cb -0.20 -2.33 -0.09 0.00 0.50 0.00 0.00 46.19 44.07 2iv9 s LEU 786 CO -0.05 -0.46 1.23 -2.16 -1.32 0.00 0.00 176.35 173.58 2iv9 s PRO 787 N 2.02 4.47 0.19 0.98 0.04 -1.26 0.10 135.00 141.52 2iv9 s PRO 787 Ca 0.11 1.98 0.11 0.00 0.04 0.00 0.00 61.00 63.24 2iv9 s PRO 787 Cb -0.17 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.14 2iv9 s PRO 787 CO 0.12 -0.09 -0.23 -0.51 0.04 0.00 0.00 177.00 176.34 2iv9 s LEU 788 N -0.80 2.43 0.28 -3.56 1.43 0.13 -0.83 118.68 117.77 2iv9 s LEU 788 Ca 0.51 -0.86 0.03 0.00 -1.03 0.00 0.00 54.13 52.77 2iv9 s LEU 788 Cb -0.35 -1.08 -0.06 0.00 0.03 0.00 0.00 46.19 44.73 2iv9 s LEU 788 CO 0.41 0.08 0.07 0.54 0.23 0.00 0.00 176.35 177.68 2iv9 s ASN 789 N -2.66 1.73 -0.25 2.29 2.20 -0.20 -4.19 114.94 113.86 2iv9 s ASN 789 Ca 0.19 -1.35 0.12 0.00 -0.94 0.00 0.00 52.86 50.87 2iv9 s ASN 789 Cb -0.07 0.05 0.50 0.00 -2.00 0.00 0.00 41.25 39.72 2iv9 s ASN 789 CO 0.09 -0.65 1.43 0.35 -2.94 0.00 0.00 177.10 175.38 2iv9 n THR 790 N -0.54 2.44 -0.45 0.54 -2.24 -1.26 -1.32 114.28 111.45 2iv9 n THR 790 Ca -0.02 -2.49 0.11 0.00 -2.27 0.00 0.00 64.05 59.38 2iv9 n THR 790 Cb 0.66 -0.30 0.32 0.00 -2.10 0.00 0.00 70.33 68.92 2iv9 n THR 790 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2iv9 n LEU 791 N -0.98 4.16 -4.94 3.22 4.32 -1.19 -4.59 117.00 117.01 2iv9 n LEU 791 Ca 0.29 -2.16 -0.30 0.00 -0.02 0.00 0.00 56.01 53.82 2iv9 n LEU 791 Cb 0.97 -0.50 0.19 0.00 -1.62 0.00 0.00 43.42 42.46 2iv9 n LEU 791 CO 0.17 0.91 0.88 -0.83 -1.22 0.00 0.00 177.39 177.30 2iv9 s GLY 792 N -0.98 1.80 0.54 -0.72 0.00 0.27 -5.04 107.32 103.19 2iv9 s GLY 792 Ca 0.48 -1.30 -0.20 0.00 0.00 0.00 0.00 44.72 43.70 2iv9 s GLY 792 CO 0.29 -0.50 1.19 2.56 0.00 0.00 0.00 173.10 176.64 2iv9 s PRO 793 N -5.90 3.32 -0.06 2.90 0.04 -1.26 -4.51 135.00 129.53 2iv9 s PRO 793 Ca 0.75 1.78 0.04 0.00 0.04 0.00 0.00 61.00 63.61 2iv9 s PRO 793 Cb -0.03 -2.11 -0.02 0.00 0.04 0.00 0.00 34.50 32.38 2iv9 s PRO 793 CO 0.53 -0.92 -0.16 0.08 0.04 0.00 0.00 177.00 176.57 2iv9 s VAL 794 N -1.61 2.89 -0.15 -0.36 1.01 -1.26 -3.26 120.40 117.67 2iv9 s VAL 794 Ca 0.72 -0.78 -0.11 0.00 0.00 0.00 0.00 61.98 61.81 2iv9 s VAL 794 Cb -0.29 -2.13 0.05 0.00 0.00 0.00 0.00 36.38 34.01 2iv9 s VAL 794 CO 0.33 0.58 0.38 -0.32 0.00 0.00 0.00 175.10 176.07 2iv9 s MET 795 N -0.55 0.40 -0.03 2.72 0.00 -0.75 -4.76 119.30 116.33 2iv9 s MET 795 Ca 0.08 0.64 -0.30 0.00 0.00 0.00 0.00 55.69 56.11 2iv9 s MET 795 Cb -0.11 0.08 -0.06 0.00 0.00 0.00 0.00 34.83 34.74 2iv9 s MET 795 CO 0.01 -0.11 1.56 0.21 0.00 0.00 0.00 175.02 176.69 2iv9 s LYS 796 N 0.84 4.21 0.25 4.11 2.20 -1.26 -1.35 119.74 128.74 2iv9 s LYS 796 Ca -0.05 2.11 0.01 0.00 -0.36 0.00 0.00 55.97 57.68 2iv9 s LYS 796 Cb -0.06 -3.82 -0.04 0.00 -1.51 0.00 0.00 37.83 32.41 2iv9 s LYS 796 CO -0.06 -0.76 0.43 -1.64 -0.36 0.00 0.00 175.35 172.96 2iv9 s MET 797 N 3.43 3.49 -0.16 4.03 -1.94 -1.26 -4.90 119.30 121.98 2iv9 s MET 797 Ca 0.70 -0.44 0.00 0.00 -1.71 0.00 0.00 55.69 54.24 2iv9 s MET 797 Cb -0.33 -2.80 0.03 0.00 2.01 0.00 0.00 34.83 33.74 2iv9 s MET 797 CO 0.28 0.33 -0.12 -2.00 -0.01 0.00 0.00 175.02 173.50 2iv9 s GLU 798 N -3.77 2.08 1.15 2.03 2.56 -1.26 -2.78 118.70 118.72 2iv9 s GLU 798 Ca 0.38 -0.61 -0.14 0.00 0.00 0.00 0.00 54.97 54.61 2iv9 s GLU 798 Cb -0.10 -2.14 0.27 0.00 2.00 0.00 0.00 34.13 34.16 2iv9 s GLU 798 CO 0.31 -0.31 1.04 -1.25 -0.56 0.00 0.00 175.26 174.49 2iv9 s PRO 799 N 1.49 -0.83 0.29 4.30 0.04 -1.26 -4.88 135.00 134.16 2iv9 s PRO 799 Ca 0.03 0.65 -0.02 0.00 0.04 0.00 0.00 61.00 61.70 2iv9 s PRO 799 Cb -0.14 -1.58 0.43 0.00 0.04 0.00 0.00 34.50 33.25 2iv9 s PRO 799 CO -0.10 -3.61 1.95 1.25 0.04 0.00 0.00 177.00 176.53 2iv9 h LEU 800 N -2.53 0.98 -3.36 -3.56 5.85 -1.92 -2.67 115.31 108.08 2iv9 h LEU 800 Ca -0.59 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.11 2iv9 h LEU 800 Cb 1.34 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.13 2iv9 h LEU 800 CO 0.51 0.69 0.00 -0.46 -0.34 0.00 0.00 178.44 178.84 2iv9 n ASN 801 N -4.42 5.38 -4.74 1.25 6.94 -1.26 -4.44 115.26 113.98 2iv9 n ASN 801 Ca 0.11 -2.85 -0.41 0.00 -0.02 0.00 0.00 54.58 51.41 2iv9 n ASN 801 Cb 0.07 -0.67 -0.05 0.00 -2.36 0.00 0.00 39.78 36.77 2iv9 n ASN 801 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 2iv9 s ASN 802 N -0.73 7.49 -0.13 0.53 2.47 -1.01 -0.71 114.94 122.86 2iv9 s ASN 802 Ca 0.51 1.78 0.01 0.00 0.42 0.00 0.00 52.86 55.58 2iv9 s ASN 802 Cb 0.38 -2.58 0.02 0.00 -1.45 0.00 0.00 41.25 37.62 2iv9 s ASN 802 CO 0.15 -0.00 -0.17 -0.22 -3.72 0.00 0.00 177.10 173.14 2iv9 s LEU 803 N -0.28 1.84 -0.09 3.21 2.96 0.63 -4.77 118.68 122.18 2iv9 s LEU 803 Ca 0.44 -0.51 -0.22 0.00 -0.22 0.00 0.00 54.13 53.63 2iv9 s LEU 803 Cb -0.24 -1.23 -0.04 0.00 0.50 0.00 0.00 46.19 45.18 2iv9 s LEU 803 CO 0.29 0.01 0.63 -1.10 -1.32 0.00 0.00 176.35 174.86 2iv9 s GLN 804 N 1.12 4.39 0.06 1.98 -0.21 -1.26 -1.05 119.66 124.68 2iv9 s GLN 804 Ca -0.02 0.73 0.05 0.00 0.02 0.00 0.00 55.36 56.14 2iv9 s GLN 804 Cb -0.14 -3.45 -0.03 0.00 1.00 0.00 0.00 33.01 30.39 2iv9 s GLN 804 CO -0.05 0.07 -0.15 0.08 -2.12 0.00 0.00 175.29 173.12 2iv9 s VAL 805 N 0.82 1.15 -0.07 1.09 1.01 0.72 -0.98 120.40 124.15 2iv9 s VAL 805 Ca 0.33 -1.17 0.03 0.00 0.00 0.00 0.00 61.98 61.18 2iv9 s VAL 805 Cb -0.17 -1.07 0.01 0.00 0.00 0.00 0.00 36.38 35.15 2iv9 s VAL 805 CO 0.15 -0.10 -0.16 0.00 0.00 0.00 0.00 175.10 175.00 2iv9 s ALA 806 N -1.05 1.50 -0.05 5.51 0.00 0.26 -1.29 121.76 126.64 2iv9 s ALA 806 Ca 0.00 -0.59 0.05 0.00 0.00 0.00 0.00 51.96 51.43 2iv9 s ALA 806 Cb -0.09 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.42 2iv9 s ALA 806 CO 0.02 0.18 -0.22 0.08 0.00 0.00 0.00 175.76 175.83 2iv9 s VAL 807 N 0.47 1.79 0.06 0.00 1.01 0.02 -0.90 120.40 122.85 2iv9 s VAL 807 Ca -0.13 -0.92 0.07 0.00 0.00 0.00 0.00 61.98 61.00 2iv9 s VAL 807 Cb -0.15 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 2iv9 s VAL 807 CO 0.05 0.50 -0.16 -0.75 0.00 0.00 0.00 175.10 174.74 2iv9 s LYS 808 N -0.09 2.06 0.00 2.72 2.20 -0.24 -0.91 119.74 125.48 2iv9 s LYS 808 Ca -0.04 -1.01 0.00 0.00 -0.36 0.00 0.00 55.97 54.57 2iv9 s LYS 808 Cb -0.13 -2.21 0.00 0.00 -1.51 0.00 0.00 37.83 33.98 2iv9 s LYS 808 CO 0.03 0.53 0.00 0.27 -0.36 0.00 0.00 175.35 175.82 2iv9 n ASN 809 N 1.29 0.00 0.11 1.43 0.23 -0.90 -2.17 115.26 115.25 2iv9 n ASN 809 Ca -0.16 -0.09 0.12 0.00 -0.53 0.00 0.00 54.58 53.92 2iv9 n ASN 809 Cb 0.52 0.00 0.46 0.00 -2.08 0.00 0.00 39.78 38.68 2iv9 n ASN 809 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 2iv9 n ASN 810 N -0.27 0.67 -0.11 0.53 6.94 -0.15 -3.94 115.26 118.94 2iv9 n ASN 810 Ca 0.00 0.62 -0.23 0.00 -0.02 0.00 0.00 54.58 54.95 2iv9 n ASN 810 Cb 0.00 -0.78 -0.11 0.00 -2.36 0.00 0.00 39.78 36.53 2iv9 n ASN 810 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 2iv9 n ILE 811 N -2.19 1.54 -3.87 1.53 5.41 -1.26 -5.05 119.36 115.47 2iv9 n ILE 811 Ca 0.04 -0.11 -0.04 0.00 1.00 0.00 0.00 62.75 63.64 2iv9 n ILE 811 Cb 0.31 -2.00 0.02 0.00 -0.71 0.00 0.00 39.64 37.25 2iv9 n ILE 811 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2iv9 s ASP 812 N -6.97 0.00 -0.18 4.38 -1.08 -1.25 -5.15 116.67 106.41 2iv9 s ASP 812 Ca -0.30 -0.77 -0.08 0.00 -0.52 0.00 0.00 52.55 50.88 2iv9 s ASP 812 Cb 0.07 0.57 -0.04 0.00 -1.46 0.00 0.00 42.92 42.07 2iv9 s ASP 812 CO 0.58 -1.14 0.07 -0.69 0.52 0.00 0.00 175.17 174.51 2iv9 s VAL 813 N -2.21 4.80 0.03 1.11 1.01 -1.26 -2.11 120.40 121.77 2iv9 s VAL 813 Ca 0.20 -0.03 0.08 0.00 0.00 0.00 0.00 61.98 62.24 2iv9 s VAL 813 Cb -0.03 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 2iv9 s VAL 813 CO 0.07 0.46 -0.24 -0.36 0.00 0.00 0.00 175.10 175.02 2iv9 s PHE 814 N 0.41 2.15 -0.06 5.22 0.08 -0.08 -4.99 117.98 120.71 2iv9 s PHE 814 Ca 0.03 -0.40 0.04 0.00 0.12 0.00 0.00 56.93 56.72 2iv9 s PHE 814 Cb -0.12 -1.31 -0.02 0.00 -0.57 0.00 0.00 43.02 41.00 2iv9 s PHE 814 CO 0.00 0.09 -0.17 0.71 -0.10 0.00 0.00 175.22 175.75 2iv9 s TYR 815 N -0.76 2.64 0.25 0.36 2.02 -1.26 -0.80 117.35 119.79 2iv9 s TYR 815 Ca 0.10 -0.35 -0.12 0.00 -0.37 0.00 0.00 57.07 56.33 2iv9 s TYR 815 Cb -0.10 -1.64 -0.00 0.00 -0.40 0.00 0.00 41.96 39.82 2iv9 s TYR 815 CO 0.01 0.04 0.47 -0.59 -1.57 0.00 0.00 175.55 173.91 2iv9 s PHE 816 N -0.46 0.44 0.16 2.71 -0.12 -0.41 -5.02 117.98 115.27 2iv9 s PHE 816 Ca 0.05 -0.79 0.06 0.00 -0.05 0.00 0.00 56.93 56.21 2iv9 s PHE 816 Cb -0.12 0.15 -0.04 0.00 -0.63 0.00 0.00 43.02 42.38 2iv9 s PHE 816 CO 0.02 -1.00 -0.14 -1.54 -0.05 0.00 0.00 175.22 172.51 2iv9 s SER 817 N -3.04 2.21 0.22 1.98 1.04 -1.26 -0.20 113.70 114.65 2iv9 s SER 817 Ca 0.24 -0.91 -0.06 0.00 0.48 0.00 0.00 55.95 55.69 2iv9 s SER 817 Cb -0.00 -0.09 -0.02 0.00 0.10 0.00 0.00 66.02 66.01 2iv9 s SER 817 CO 0.10 -0.17 0.28 0.00 0.98 0.00 0.00 173.24 174.43 2iv9 s LEU 819 N -3.09 4.06 -0.39 0.00 2.96 -1.26 -0.27 118.68 120.70 2iv9 s LEU 819 Ca 0.31 0.12 -0.19 0.00 -0.22 0.00 0.00 54.13 54.15 2iv9 s LEU 819 Cb 0.04 -2.07 0.01 0.00 0.50 0.00 0.00 46.19 44.66 2iv9 s LEU 819 CO 0.10 0.10 0.54 -0.63 -1.32 0.00 0.00 176.35 175.15 2iv9 s ILE 820 N 0.83 4.97 0.17 6.68 1.01 0.12 -4.91 121.20 130.06 2iv9 s ILE 820 Ca 0.07 0.18 -0.30 0.00 0.00 0.00 0.00 60.65 60.59 2iv9 s ILE 820 Cb -0.13 -4.05 -0.08 0.00 0.01 0.00 0.00 42.46 38.21 2iv9 s ILE 820 CO 0.02 -0.36 1.27 -2.84 0.00 0.00 0.00 174.94 173.03 2iv9 s PRO 821 N 2.49 4.42 0.23 2.79 0.02 -1.26 -4.81 135.00 138.87 2iv9 s PRO 821 Ca 0.19 1.96 0.22 0.00 0.02 0.00 0.00 61.00 63.40 2iv9 s PRO 821 Cb -0.15 -3.23 0.94 0.00 0.02 0.00 0.00 34.50 32.07 2iv9 s PRO 821 CO 0.15 -0.22 1.67 1.28 -0.33 0.00 0.00 177.00 179.55 2iv9 n LEU 822 N 2.92 0.58 0.24 -5.54 4.77 -1.26 -2.71 117.00 116.00 2iv9 n LEU 822 Ca 0.07 0.65 0.09 0.00 -0.03 0.00 0.00 56.01 56.78 2iv9 n LEU 822 Cb 0.44 -0.58 0.60 0.00 -2.33 0.00 0.00 43.42 41.54 2iv9 n LEU 822 CO 0.57 -0.55 0.92 -0.55 -1.33 0.00 0.00 177.39 176.45 2iv9 h ASN 823 N 0.00 0.00 0.69 -1.43 -1.07 -1.92 -0.70 115.58 111.16 2iv9 h ASN 823 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 2iv9 h ASN 823 Cb 0.33 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.58 2iv9 h ASN 823 CO 0.00 0.17 0.00 -0.37 0.07 0.00 0.00 177.43 177.30 2iv9 h VAL 824 N 0.00 0.00 -0.58 6.14 -1.51 -1.87 -1.87 116.25 116.57 2iv9 h VAL 824 Ca -0.00 -0.32 0.00 0.00 -1.23 0.00 0.00 66.70 65.15 2iv9 h VAL 824 Cb 0.37 1.25 0.00 0.00 -2.13 0.00 0.00 31.29 30.78 2iv9 h VAL 824 CO 0.02 0.00 0.00 0.18 -1.23 0.00 0.00 177.57 176.54 2iv9 n LEU 825 N -2.90 3.62 -4.69 4.19 4.77 -0.28 -4.81 117.00 116.91 2iv9 n LEU 825 Ca -0.00 -1.72 -0.42 0.00 -0.03 0.00 0.00 56.01 53.84 2iv9 n LEU 825 Cb 0.22 -0.38 -0.03 0.00 -2.33 0.00 0.00 43.42 40.90 2iv9 n LEU 825 CO 0.23 0.86 0.70 -0.36 -1.33 0.00 0.00 177.39 177.49 2iv9 s PHE 826 N -1.24 3.51 0.33 -1.77 0.08 -0.70 -1.49 117.98 116.70 2iv9 s PHE 826 Ca 0.44 1.50 -0.06 0.00 0.12 0.00 0.00 56.93 58.93 2iv9 s PHE 826 Cb 0.24 -3.11 -0.05 0.00 -0.57 0.00 0.00 43.02 39.53 2iv9 s PHE 826 CO 0.32 -0.18 0.62 0.14 -0.10 0.00 0.00 175.22 176.02 2iv9 s VAL 827 N 1.83 4.97 0.24 -0.44 -7.23 -0.62 -4.88 120.40 114.27 2iv9 s VAL 827 Ca 0.45 0.13 -0.07 0.00 -1.81 0.00 0.00 61.98 60.68 2iv9 s VAL 827 Cb -0.18 -3.76 0.22 0.00 0.56 0.00 0.00 36.38 33.23 2iv9 s VAL 827 CO 0.18 -0.43 1.91 1.05 -0.31 0.00 0.00 175.10 177.50 2iv9 h GLU 828 N 1.38 1.22 -2.59 4.82 9.09 -1.91 -3.25 114.58 123.35 2iv9 h GLU 828 Ca -0.48 -0.08 -0.50 0.00 0.05 0.00 0.00 59.36 58.35 2iv9 h GLU 828 Cb 1.19 -0.27 -0.02 0.00 -1.65 0.00 0.00 28.75 28.00 2iv9 h GLU 828 CO 0.65 0.81 2.16 -3.47 0.05 0.00 0.00 179.01 179.21 2iv9 n ASP 829 N -4.43 7.42 -0.56 3.06 2.03 -1.26 -4.49 116.55 118.32 2iv9 n ASP 829 Ca 0.10 -2.61 0.06 0.00 0.52 0.00 0.00 54.79 52.86 2iv9 n ASP 829 Cb 0.02 -1.48 0.19 0.00 -0.72 0.00 0.00 41.12 39.12 2iv9 n ASP 829 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2iv9 n GLY 830 N 2.96 4.84 3.48 0.27 0.00 -1.23 -4.82 105.19 110.69 2iv9 n GLY 830 Ca 0.64 -1.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 2iv9 n GLY 830 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2iv9 s LYS 831 N -3.05 3.11 0.26 1.61 2.20 -1.26 -3.52 119.74 119.08 2iv9 s LYS 831 Ca 0.38 -0.90 -0.21 0.00 -0.36 0.00 0.00 55.97 54.88 2iv9 s LYS 831 Cb 0.34 -3.94 -0.09 0.00 -1.51 0.00 0.00 37.83 32.64 2iv9 s LYS 831 CO 0.00 -0.69 0.78 1.41 -0.36 0.00 0.00 175.35 176.49 2iv9 s MET 832 N 1.73 4.31 0.36 4.03 -2.45 -1.26 -5.05 119.30 120.96 2iv9 s MET 832 Ca 0.06 0.96 -0.28 0.00 -1.25 0.00 0.00 55.69 55.18 2iv9 s MET 832 Cb -0.18 -2.81 -0.10 0.00 1.25 0.00 0.00 34.83 32.98 2iv9 s MET 832 CO 0.10 0.34 1.29 -1.21 1.05 0.00 0.00 175.02 176.60 2iv9 s GLU 833 N -2.09 4.24 0.28 4.11 2.02 -1.26 -4.88 118.70 121.12 2iv9 s GLU 833 Ca 0.46 2.16 -0.02 0.00 0.02 0.00 0.00 54.97 57.59 2iv9 s GLU 833 Cb -0.16 -2.96 0.40 0.00 0.10 0.00 0.00 34.13 31.51 2iv9 s GLU 833 CO 0.21 -0.27 1.87 -0.09 0.02 0.00 0.00 175.26 177.01 2iv9 h ARG 834 N 3.15 0.94 -0.31 1.61 2.43 -1.97 -0.17 114.38 120.06 2iv9 h ARG 834 Ca -0.49 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 58.54 2iv9 h ARG 834 Cb 1.23 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.60 2iv9 h ARG 834 CO 0.64 0.75 0.20 0.37 -1.51 0.00 0.00 179.97 180.43 2iv9 h GLN 835 N 0.94 0.42 -0.42 0.20 4.15 -2.00 -1.66 115.11 116.73 2iv9 h GLN 835 Ca 0.23 -0.03 -0.14 0.00 0.77 0.00 0.00 58.65 59.48 2iv9 h GLN 835 Cb 0.14 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.72 2iv9 h GLN 835 CO -0.03 0.29 -0.29 0.28 -1.93 0.00 0.00 178.83 177.15 2iv9 h VAL 836 N 0.42 1.27 -0.19 2.39 2.07 -1.79 -2.51 116.25 117.92 2iv9 h VAL 836 Ca 0.11 -1.46 0.05 0.00 0.82 0.00 0.00 66.70 66.23 2iv9 h VAL 836 Cb -0.04 1.26 -0.07 0.00 -1.52 0.00 0.00 31.29 30.92 2iv9 h VAL 836 CO -0.02 0.49 -0.30 0.15 0.02 0.00 0.00 177.57 177.91 2iv9 h PHE 837 N 0.77 -0.81 -0.47 1.57 3.04 -0.81 0.68 116.94 120.92 2iv9 h PHE 837 Ca 0.09 0.04 -0.02 0.00 3.98 0.00 0.00 57.97 62.05 2iv9 h PHE 837 Cb 0.86 0.39 -0.02 0.00 2.56 0.00 0.00 35.95 39.74 2iv9 h PHE 837 CO 0.05 -0.37 0.20 -0.07 -2.02 0.00 0.00 178.31 176.10 2iv9 h LEU 838 N -0.34 0.64 -0.49 0.59 4.07 -1.18 0.11 115.31 118.72 2iv9 h LEU 838 Ca 0.12 -0.16 -0.14 0.00 0.08 0.00 0.00 57.88 57.78 2iv9 h LEU 838 Cb 0.52 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 42.08 2iv9 h LEU 838 CO -0.38 0.62 -0.25 0.00 -1.08 0.00 0.00 178.44 177.36 2iv9 h ALA 839 N 1.04 0.68 -0.13 1.53 0.00 -1.34 -2.58 119.26 118.47 2iv9 h ALA 839 Ca 0.16 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 2iv9 h ALA 839 Cb 0.18 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2iv9 h ALA 839 CO -0.01 0.67 -0.04 1.15 0.00 0.00 0.00 179.25 181.02 2iv9 h THR 840 N 0.83 1.30 -0.61 0.00 2.02 -0.58 -1.39 112.91 114.48 2iv9 h THR 840 Ca 0.10 -1.01 0.10 0.00 0.77 0.00 0.00 66.41 66.37 2iv9 h THR 840 Cb 0.83 1.70 -0.08 0.00 -1.74 0.00 0.00 68.15 68.86 2iv9 h THR 840 CO 0.07 0.29 0.20 -0.25 0.37 0.00 0.00 175.52 176.21 2iv9 h TRP 841 N -0.06 0.35 -0.39 3.16 2.91 -0.78 -0.61 115.95 120.52 2iv9 h TRP 841 Ca 0.03 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 60.07 2iv9 h TRP 841 Cb 0.47 -0.06 -0.02 0.00 -0.51 0.00 0.00 29.16 29.04 2iv9 h TRP 841 CO 0.06 0.06 0.19 -0.22 -1.03 0.00 0.00 178.44 177.50 2iv9 h LYS 842 N 0.37 0.57 -0.35 2.65 3.64 -1.38 -3.28 116.57 118.78 2iv9 h LYS 842 Ca 0.31 -0.08 -0.10 0.00 -1.27 0.00 0.00 60.65 59.51 2iv9 h LYS 842 Cb 0.42 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 2iv9 h LYS 842 CO -0.34 0.50 -0.19 0.22 -2.27 0.00 0.00 179.45 177.37 2iv9 h ASP 843 N 0.50 0.77 -2.43 4.20 3.58 -0.41 -3.44 116.42 119.19 2iv9 h ASP 843 Ca 0.14 -0.41 -0.54 0.00 0.42 0.00 0.00 57.03 56.64 2iv9 h ASP 843 Cb 0.12 -0.21 0.03 0.00 1.72 0.00 0.00 39.33 40.99 2iv9 h ASP 843 CO -0.02 1.02 1.14 -0.38 -2.88 0.00 0.00 179.24 178.11 2iv9 n ILE 844 N -4.30 0.47 -1.66 2.25 5.41 -0.32 -4.89 119.36 116.33 2iv9 n ILE 844 Ca -0.02 -0.09 -0.46 0.00 1.00 0.00 0.00 62.75 63.18 2iv9 n ILE 844 Cb 0.41 -2.15 -0.03 0.00 -0.71 0.00 0.00 39.64 37.16 2iv9 n ILE 844 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2iv9 n PRO 845 N 6.13 1.92 0.31 0.38 -0.04 -1.26 -4.86 135.00 137.58 2iv9 n PRO 845 Ca 0.19 0.69 0.19 0.00 -0.04 0.00 0.00 63.50 64.53 2iv9 n PRO 845 Cb 0.38 -2.34 1.04 0.00 -0.04 0.00 0.00 33.50 32.53 2iv9 n PRO 845 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 2iv9 h ASN 846 N 4.42 0.00 0.11 3.54 2.35 -1.91 0.15 115.58 124.24 2iv9 h ASN 846 Ca -0.45 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.30 2iv9 h ASN 846 Cb 1.28 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.65 2iv9 h ASN 846 CO 0.77 0.00 -0.01 1.05 -1.65 0.00 0.00 177.43 177.59 2iv9 h GLU 847 N 0.00 0.00 -0.00 0.81 4.11 -2.02 0.55 114.58 118.03 2iv9 h GLU 847 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.44 2iv9 h GLU 847 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2iv9 h GLU 847 CO -0.00 0.01 -0.10 0.09 0.07 0.00 0.00 179.01 179.08 2iv9 n ASN 848 N -3.39 0.41 -4.69 3.06 4.13 0.53 -4.85 115.26 110.46 2iv9 n ASN 848 Ca -0.03 -0.52 -0.41 0.00 1.68 0.00 0.00 54.58 55.30 2iv9 n ASN 848 Cb 0.11 -0.09 -0.04 0.00 -1.54 0.00 0.00 39.78 38.21 2iv9 n ASN 848 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 2iv9 s GLU 849 N -2.49 4.38 -0.01 3.52 2.12 0.18 -4.19 118.70 122.22 2iv9 s GLU 849 Ca 0.29 0.97 0.05 0.00 0.36 0.00 0.00 54.97 56.64 2iv9 s GLU 849 Cb 0.20 -3.50 -0.01 0.00 0.26 0.00 0.00 34.13 31.07 2iv9 s GLU 849 CO 0.47 -0.11 -0.17 -0.51 -0.54 0.00 0.00 175.26 174.41 2iv9 s LEU 850 N 1.38 2.04 0.00 2.70 1.43 -0.48 -4.96 118.68 120.79 2iv9 s LEU 850 Ca 0.39 -0.31 0.07 0.00 -1.03 0.00 0.00 54.13 53.25 2iv9 s LEU 850 Cb -0.18 -0.85 -0.02 0.00 0.03 0.00 0.00 46.19 45.17 2iv9 s LEU 850 CO 0.17 0.20 -0.22 -1.10 0.23 0.00 0.00 176.35 175.63 2iv9 s GLN 851 N -0.41 1.69 0.10 1.70 -0.21 -1.26 -1.01 119.66 120.26 2iv9 s GLN 851 Ca 0.06 -0.86 0.02 0.00 0.02 0.00 0.00 55.36 54.60 2iv9 s GLN 851 Cb -0.06 -1.70 -0.04 0.00 1.00 0.00 0.00 33.01 32.21 2iv9 s GLN 851 CO -0.01 0.46 -0.06 -0.06 -2.12 0.00 0.00 175.29 173.50 2iv9 s PHE 852 N -0.61 0.87 -0.14 0.91 0.40 -0.08 -5.00 117.98 114.33 2iv9 s PHE 852 Ca 0.09 -0.93 -0.02 0.00 -0.60 0.00 0.00 56.93 55.46 2iv9 s PHE 852 Cb -0.09 -0.51 -0.02 0.00 0.51 0.00 0.00 43.02 42.91 2iv9 s PHE 852 CO 0.00 -0.17 -0.07 -0.65 0.70 0.00 0.00 175.22 175.03 2iv9 s GLN 853 N -3.84 3.52 -0.45 0.44 -1.52 -1.26 -0.71 119.66 115.84 2iv9 s GLN 853 Ca 0.12 -0.57 -0.18 0.00 -1.95 0.00 0.00 55.36 52.77 2iv9 s GLN 853 Cb 0.05 -2.80 0.03 0.00 -0.22 0.00 0.00 33.01 30.08 2iv9 s GLN 853 CO -0.05 0.27 0.51 0.42 -0.25 0.00 0.00 175.29 176.19 2iv9 s ILE 854 N 0.27 5.01 -0.04 1.08 1.09 0.41 -4.96 121.20 124.05 2iv9 s ILE 854 Ca -0.05 -0.36 -0.14 0.00 -1.10 0.00 0.00 60.65 58.99 2iv9 s ILE 854 Cb -0.14 -4.13 -0.05 0.00 -1.06 0.00 0.00 42.46 37.07 2iv9 s ILE 854 CO 0.04 -0.55 0.38 -0.54 -0.10 0.00 0.00 174.94 174.16 2iv9 s LYS 855 N 2.33 3.96 -1.35 2.79 1.02 -1.26 -1.30 119.74 125.92 2iv9 s LYS 855 Ca 0.14 0.34 -0.03 0.00 0.02 0.00 0.00 55.97 56.44 2iv9 s LYS 855 Cb -0.18 -3.26 -0.00 0.00 -0.52 0.00 0.00 37.83 33.87 2iv9 s LYS 855 CO 0.14 0.59 0.52 0.39 -0.92 0.00 0.00 175.35 176.07 2iv9 n GLU 856 N 2.22 -3.41 -3.02 1.68 -0.58 -0.90 -4.94 120.64 111.69 2iv9 n GLU 856 Ca -0.13 0.46 -0.40 0.00 -0.42 0.00 0.00 57.16 56.67 2iv9 n GLU 856 Cb 0.52 -4.62 -0.05 0.00 -0.57 0.00 0.00 31.44 26.72 2iv9 n GLU 856 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2iv9 n HIS 858 N 3.16 1.11 -4.02 0.00 -0.00 -1.26 -4.77 115.22 109.43 2iv9 n HIS 858 Ca -0.02 -0.92 -0.36 0.00 -0.00 0.00 0.00 57.72 56.41 2iv9 n HIS 858 Cb 0.51 -0.36 -0.07 0.00 -0.00 0.00 0.00 29.99 30.07 2iv9 n HIS 858 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2iv9 s LEU 859 N -2.86 4.15 0.78 2.41 1.43 -1.26 -5.11 118.68 118.22 2iv9 s LEU 859 Ca 0.44 0.37 -0.11 0.00 -1.03 0.00 0.00 54.13 53.80 2iv9 s LEU 859 Cb 0.36 -2.00 0.06 0.00 0.03 0.00 0.00 46.19 44.64 2iv9 s LEU 859 CO 0.09 0.40 1.09 0.54 0.23 0.00 0.00 176.35 178.70 2iv9 s ASN 860 N -0.96 4.69 0.40 2.29 2.20 -1.26 -4.84 114.94 117.45 2iv9 s ASN 860 Ca 0.14 1.32 0.14 0.00 -0.94 0.00 0.00 52.86 53.52 2iv9 s ASN 860 Cb -0.12 -2.07 0.98 0.00 -2.00 0.00 0.00 41.25 38.04 2iv9 s ASN 860 CO 0.03 -1.85 1.87 0.00 -2.94 0.00 0.00 177.10 174.22 2iv9 h ALA 861 N -1.00 2.04 -0.09 3.54 0.00 -1.99 -1.43 119.26 120.33 2iv9 h ALA 861 Ca -0.46 0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.25 2iv9 h ALA 861 Cb 1.26 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2iv9 h ALA 861 CO 0.60 -0.30 -0.80 -0.44 0.00 0.00 0.00 179.25 178.30 2iv9 h ASP 862 N 0.51 0.71 -0.27 0.00 3.32 -1.99 -1.42 116.42 117.27 2iv9 h ASP 862 Ca 0.45 -0.48 -0.12 0.00 0.02 0.00 0.00 57.03 56.89 2iv9 h ASP 862 Cb 0.95 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 2iv9 h ASP 862 CO -0.18 1.26 -0.27 0.74 -1.72 0.00 0.00 179.24 179.07 2iv9 h THR 863 N 0.39 1.28 -0.26 0.35 2.02 -1.79 -2.11 112.91 112.79 2iv9 h THR 863 Ca -0.05 -1.40 0.03 0.00 0.77 0.00 0.00 66.41 65.76 2iv9 h THR 863 Cb 1.41 1.28 -0.03 0.00 -1.74 0.00 0.00 68.15 69.07 2iv9 h THR 863 CO 0.15 0.46 0.09 0.58 0.37 0.00 0.00 175.52 177.17 2iv9 h VAL 864 N 0.66 0.93 -0.52 3.16 2.07 -1.12 -1.07 116.25 120.35 2iv9 h VAL 864 Ca 0.08 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 67.46 2iv9 h VAL 864 Cb 0.79 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 2iv9 h VAL 864 CO 0.07 0.04 0.04 -1.28 0.02 0.00 0.00 177.57 176.46 2iv9 h SER 865 N 0.20 0.87 -0.08 0.57 0.87 -1.17 -2.07 113.55 112.74 2iv9 h SER 865 Ca 0.11 -0.28 -0.01 0.00 -1.23 0.00 0.00 61.79 60.38 2iv9 h SER 865 Cb 0.08 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 61.81 2iv9 h SER 865 CO -0.12 0.93 -0.01 -1.28 -0.53 0.00 0.00 176.83 175.83 2iv9 h SER 866 N 0.77 0.14 -0.22 6.23 0.87 -1.27 0.18 113.55 120.25 2iv9 h SER 866 Ca 0.15 -0.33 0.05 0.00 -1.23 0.00 0.00 61.79 60.43 2iv9 h SER 866 Cb 0.46 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 62.34 2iv9 h SER 866 CO 0.02 0.43 -0.07 0.11 -0.53 0.00 0.00 176.83 176.79 2iv9 h LYS 867 N -0.16 -0.03 -0.55 2.24 1.57 -1.20 -1.86 116.57 116.58 2iv9 h LYS 867 Ca 0.02 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 2iv9 h LYS 867 Cb 0.37 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.66 2iv9 h LYS 867 CO 0.01 -0.02 0.15 -0.07 -0.57 0.00 0.00 179.45 178.94 2iv9 h LEU 868 N -0.03 0.77 -0.99 2.94 3.38 -1.30 -2.33 115.31 117.76 2iv9 h LEU 868 Ca 0.11 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 2iv9 h LEU 868 Cb 0.19 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2iv9 h LEU 868 CO -0.24 0.75 0.07 -0.61 0.09 0.00 0.00 178.44 178.50 2iv9 h GLN 869 N 0.81 0.80 0.00 1.13 4.15 -0.34 -0.26 115.11 121.40 2iv9 h GLN 869 Ca 0.18 -0.18 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2iv9 h GLN 869 Cb 0.28 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.86 2iv9 h GLN 869 CO -0.00 0.76 0.00 0.09 -1.93 0.00 0.00 178.83 177.74 2iv9 n ASN 870 N -4.25 0.27 -0.70 -0.69 5.03 -0.72 -1.77 115.26 112.42 2iv9 n ASN 870 Ca 0.03 0.60 0.07 0.00 0.87 0.00 0.00 54.58 56.15 2iv9 n ASN 870 Cb 0.26 -0.65 0.21 0.00 -1.02 0.00 0.00 39.78 38.59 2iv9 n ASN 870 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2iv9 n ASN 871 N -1.84 3.13 -2.19 6.41 3.02 -0.59 -3.38 115.26 119.82 2iv9 n ASN 871 Ca 0.00 -3.21 -0.19 0.00 -0.03 0.00 0.00 54.58 51.16 2iv9 n ASN 871 Cb 0.07 -0.53 -0.01 0.00 -0.61 0.00 0.00 39.78 38.70 2iv9 n ASN 871 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2iv9 n ASN 872 N -0.90 -5.48 -4.26 6.41 3.02 -0.73 -4.86 115.26 108.46 2iv9 n ASN 872 Ca 0.22 -0.03 -0.37 0.00 -0.03 0.00 0.00 54.58 54.37 2iv9 n ASN 872 Cb 0.84 -4.52 -0.13 0.00 -0.61 0.00 0.00 39.78 35.36 2iv9 n ASN 872 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2iv9 s VAL 873 N -2.96 3.58 -0.21 2.41 1.01 -0.21 -4.66 120.40 119.37 2iv9 s VAL 873 Ca 0.02 -1.06 -0.11 0.00 0.00 0.00 0.00 61.98 60.83 2iv9 s VAL 873 Cb -0.01 -2.97 -0.05 0.00 0.00 0.00 0.00 36.38 33.36 2iv9 s VAL 873 CO 0.02 -0.06 0.16 -0.31 0.00 0.00 0.00 175.10 174.90 2iv9 s TYR 874 N 1.39 3.39 -0.47 5.22 2.02 -0.15 -2.52 117.35 126.23 2iv9 s TYR 874 Ca -0.01 0.34 -0.22 0.00 -0.37 0.00 0.00 57.07 56.80 2iv9 s TYR 874 Cb -0.19 -2.21 0.03 0.00 -0.40 0.00 0.00 41.96 39.20 2iv9 s TYR 874 CO 0.01 0.23 0.77 0.99 -1.57 0.00 0.00 175.55 175.99 2iv9 s THR 875 N 0.54 4.66 -0.30 -0.71 2.01 -1.26 -0.72 115.64 119.85 2iv9 s THR 875 Ca 0.09 0.23 0.23 0.00 0.31 0.00 0.00 61.69 62.55 2iv9 s THR 875 Cb -0.12 -4.34 -0.10 0.00 0.01 0.00 0.00 72.50 67.95 2iv9 s THR 875 CO 0.00 -0.79 0.93 2.30 -0.69 0.00 0.00 174.62 176.37 2iv9 n ILE 876 N 6.04 0.36 -3.66 1.82 -5.35 0.44 -4.93 119.36 114.08 2iv9 n ILE 876 Ca 0.00 -0.45 -0.15 0.00 -0.27 0.00 0.00 62.75 61.89 2iv9 n ILE 876 Cb 0.48 -0.12 -0.08 0.00 -1.74 0.00 0.00 39.64 38.17 2iv9 n ILE 876 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2iv9 s ALA 877 N -3.35 -1.30 -0.12 -1.28 0.00 -1.13 -4.93 121.76 109.65 2iv9 s ALA 877 Ca -0.01 1.14 -0.01 0.00 0.00 0.00 0.00 51.96 53.09 2iv9 s ALA 877 Cb 0.12 -0.39 0.03 0.00 0.00 0.00 0.00 23.12 22.88 2iv9 s ALA 877 CO 0.82 -0.29 -0.04 0.21 0.00 0.00 0.00 175.76 176.46 2iv9 s LYS 878 N -0.54 1.21 -0.08 0.00 2.20 -1.26 -0.23 119.74 121.04 2iv9 s LYS 878 Ca -0.07 -0.24 0.05 0.00 -0.36 0.00 0.00 55.97 55.36 2iv9 s LYS 878 Cb -0.03 -1.57 -0.00 0.00 -1.51 0.00 0.00 37.83 34.71 2iv9 s LYS 878 CO 0.04 -0.34 -0.24 1.03 -0.36 0.00 0.00 175.35 175.48 2iv9 s ARG 879 N 1.77 2.85 -0.27 4.03 0.52 0.62 -4.96 118.95 123.50 2iv9 s ARG 879 Ca 0.04 -0.89 -0.13 0.00 -0.52 0.00 0.00 55.73 54.22 2iv9 s ARG 879 Cb -0.13 -2.24 -0.04 0.00 0.52 0.00 0.00 34.95 33.05 2iv9 s ARG 879 CO -0.07 0.26 0.30 1.21 0.02 0.00 0.00 175.30 177.02 2iv9 s ASN 880 N 0.14 6.17 -0.22 0.23 2.47 -1.26 -0.02 114.94 122.45 2iv9 s ASN 880 Ca -0.13 0.18 0.02 0.00 0.42 0.00 0.00 52.86 53.35 2iv9 s ASN 880 Cb -0.16 -2.18 0.05 0.00 -1.45 0.00 0.00 41.25 37.51 2iv9 s ASN 880 CO 0.07 -0.13 -0.12 -0.69 -3.72 0.00 0.00 177.10 172.52 2iv9 s VAL 881 N 1.92 1.91 -1.44 -5.21 1.01 0.41 -4.82 120.40 114.18 2iv9 s VAL 881 Ca 0.12 -1.28 -0.09 0.00 0.00 0.00 0.00 61.98 60.73 2iv9 s VAL 881 Cb -0.16 -1.98 0.05 0.00 0.00 0.00 0.00 36.38 34.29 2iv9 s VAL 881 CO 0.10 0.12 0.69 -0.62 0.00 0.00 0.00 175.10 175.38 2iv9 n GLU 882 N 4.57 -4.69 0.00 2.72 1.02 -1.26 -0.24 120.64 122.76 2iv9 n GLU 882 Ca -0.15 0.67 0.00 0.00 -0.02 0.00 0.00 57.16 57.66 2iv9 n GLU 882 Cb 0.45 -5.50 0.00 0.00 -0.02 0.00 0.00 31.44 26.37 2iv9 n GLU 882 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2iv9 n GLY 883 N -1.46 2.91 3.69 0.62 0.00 -1.26 -5.03 105.19 104.65 2iv9 n GLY 883 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 2iv9 n GLY 883 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2iv9 s GLN 884 N -0.09 4.40 0.10 1.61 -0.21 0.66 -4.43 119.66 121.70 2iv9 s GLN 884 Ca 0.00 1.44 -0.27 0.00 0.02 0.00 0.00 55.36 56.55 2iv9 s GLN 884 Cb 0.00 -3.55 -0.06 0.00 1.00 0.00 0.00 33.01 30.40 2iv9 s GLN 884 CO 0.00 -0.36 0.85 -0.51 -2.12 0.00 0.00 175.29 173.15 2iv9 s ASP 885 N 1.18 7.37 -0.15 5.90 1.01 0.46 -0.44 116.67 132.00 2iv9 s ASP 885 Ca 0.49 1.64 0.01 0.00 0.71 0.00 0.00 52.55 55.40 2iv9 s ASP 885 Cb -0.19 -2.53 0.02 0.00 1.01 0.00 0.00 42.92 41.23 2iv9 s ASP 885 CO 0.18 0.02 -0.15 -0.32 0.21 0.00 0.00 175.17 175.11 2iv9 s MET 886 N -0.26 2.39 -0.21 8.23 -2.45 0.97 0.04 119.30 128.03 2iv9 s MET 886 Ca 0.41 -0.60 -0.07 0.00 -1.25 0.00 0.00 55.69 54.19 2iv9 s MET 886 Cb -0.22 -2.14 -0.03 0.00 1.25 0.00 0.00 34.83 33.68 2iv9 s MET 886 CO 0.27 -0.20 0.05 -0.51 1.05 0.00 0.00 175.02 175.67 2iv9 s LEU 887 N 1.37 3.55 -0.22 4.11 1.02 0.34 -0.28 118.68 128.57 2iv9 s LEU 887 Ca 0.03 -0.08 -0.07 0.00 0.02 0.00 0.00 54.13 54.03 2iv9 s LEU 887 Cb -0.13 -1.91 -0.03 0.00 0.02 0.00 0.00 46.19 44.13 2iv9 s LEU 887 CO -0.09 0.08 0.06 -0.31 0.02 0.00 0.00 176.35 176.11 2iv9 s TYR 888 N 0.90 3.12 0.08 0.29 2.02 0.68 -0.55 117.35 123.89 2iv9 s TYR 888 Ca 0.03 -0.27 0.03 0.00 -0.37 0.00 0.00 57.07 56.48 2iv9 s TYR 888 Cb -0.14 -2.17 -0.03 0.00 -0.40 0.00 0.00 41.96 39.22 2iv9 s TYR 888 CO 0.02 -0.19 -0.08 -0.65 -1.57 0.00 0.00 175.55 173.08 2iv9 s GLN 889 N 1.17 0.74 0.05 -0.62 -0.21 0.65 -0.42 119.66 121.02 2iv9 s GLN 889 Ca 0.04 -1.07 0.01 0.00 0.02 0.00 0.00 55.36 54.35 2iv9 s GLN 889 Cb -0.14 -0.36 -0.03 0.00 1.00 0.00 0.00 33.01 33.48 2iv9 s GLN 889 CO 0.03 0.04 -0.05 -1.54 -2.12 0.00 0.00 175.29 171.66 2iv9 s SER 890 N -2.33 0.65 0.09 5.90 1.04 0.11 -0.87 113.70 118.28 2iv9 s SER 890 Ca 0.02 -0.78 -0.20 0.00 0.48 0.00 0.00 55.95 55.47 2iv9 s SER 890 Cb -0.03 0.12 0.05 0.00 0.10 0.00 0.00 66.02 66.26 2iv9 s SER 890 CO -0.01 -0.41 0.48 -1.48 0.98 0.00 0.00 173.24 172.80 2iv9 s LEU 891 N -2.29 0.05 0.01 2.42 -0.00 -0.90 -0.98 118.68 117.00 2iv9 s LEU 891 Ca -0.01 -0.03 0.04 0.00 -0.00 0.00 0.00 54.13 54.13 2iv9 s LEU 891 Cb -0.01 2.06 -0.01 0.00 -0.00 0.00 0.00 46.19 48.23 2iv9 s LEU 891 CO -0.04 -0.79 -0.13 -0.75 -0.00 0.00 0.00 176.35 174.63 2iv9 s LYS 892 N -3.08 0.97 0.42 1.48 2.20 -1.26 -0.56 119.74 119.90 2iv9 s LYS 892 Ca -0.02 -0.56 -0.01 0.00 -0.36 0.00 0.00 55.97 55.02 2iv9 s LYS 892 Cb 0.00 -0.94 -0.02 0.00 -1.51 0.00 0.00 37.83 35.36 2iv9 s LYS 892 CO -0.07 0.25 0.66 -0.51 -0.36 0.00 0.00 175.35 175.32 2iv9 s LEU 893 N -0.63 3.76 0.61 5.43 1.43 0.48 -1.59 118.68 128.18 2iv9 s LEU 893 Ca 0.03 0.50 0.32 0.00 -1.03 0.00 0.00 54.13 53.96 2iv9 s LEU 893 Cb -0.06 -3.39 1.85 0.00 0.03 0.00 0.00 46.19 44.62 2iv9 s LEU 893 CO 0.00 -0.54 2.18 0.71 0.23 0.00 0.00 176.35 178.93 2iv9 h THR 894 N 0.47 0.35 -0.31 5.49 1.35 -1.60 -0.18 112.91 118.47 2iv9 h THR 894 Ca -0.48 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 2iv9 h THR 894 Cb 1.23 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 68.54 2iv9 h THR 894 CO 0.60 0.00 0.00 -0.46 -0.25 0.00 0.00 175.52 175.41 2iv9 n ASN 895 N -3.58 2.08 0.00 5.36 6.94 -1.26 -4.93 115.26 119.86 2iv9 n ASN 895 Ca -0.01 -1.88 0.00 0.00 -0.02 0.00 0.00 54.58 52.67 2iv9 n ASN 895 Cb 0.22 -0.20 0.00 0.00 -2.36 0.00 0.00 39.78 37.44 2iv9 n ASN 895 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2iv9 n GLY 896 N 1.17 0.55 3.70 4.83 0.00 -0.08 -5.04 105.19 110.32 2iv9 n GLY 896 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 2iv9 n GLY 896 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2iv9 s ILE 897 N -2.20 3.11 -0.02 -0.61 1.01 -1.26 -4.74 121.20 116.48 2iv9 s ILE 897 Ca 0.00 0.63 -0.16 0.00 0.00 0.00 0.00 60.65 61.12 2iv9 s ILE 897 Cb 0.00 -3.41 -0.05 0.00 0.01 0.00 0.00 42.46 39.01 2iv9 s ILE 897 CO 0.00 0.01 0.44 0.26 0.00 0.00 0.00 174.94 175.65 2iv9 s TRP 898 N 2.17 3.68 -0.10 3.97 0.52 -1.26 -0.39 118.94 127.53 2iv9 s TRP 898 Ca 0.70 1.00 0.03 0.00 0.02 0.00 0.00 56.10 57.85 2iv9 s TRP 898 Cb -0.39 -2.38 -0.01 0.00 -1.15 0.00 0.00 33.47 29.55 2iv9 s TRP 898 CO 0.31 0.52 -0.20 0.42 0.02 0.00 0.00 176.95 178.02 2iv9 s ILE 899 N -0.65 2.47 -0.12 2.03 1.09 0.27 -4.56 121.20 121.72 2iv9 s ILE 899 Ca 0.25 -0.88 -0.06 0.00 -1.10 0.00 0.00 60.65 58.86 2iv9 s ILE 899 Cb -0.17 -1.97 -0.04 0.00 -1.06 0.00 0.00 42.46 39.22 2iv9 s ILE 899 CO 0.13 0.55 0.08 -0.76 -0.10 0.00 0.00 174.94 174.84 2iv9 s LEU 900 N 0.20 4.00 0.02 2.97 1.02 -0.57 -2.12 118.68 124.21 2iv9 s LEU 900 Ca -0.12 0.27 0.02 0.00 0.02 0.00 0.00 54.13 54.32 2iv9 s LEU 900 Cb -0.16 -1.97 -0.02 0.00 0.02 0.00 0.00 46.19 44.07 2iv9 s LEU 900 CO 0.07 0.34 -0.07 0.00 0.02 0.00 0.00 176.35 176.71 2iv9 s ALA 901 N -0.63 0.54 -0.10 4.21 0.00 -0.05 -1.15 121.76 124.56 2iv9 s ALA 901 Ca 0.12 -0.55 0.01 0.00 0.00 0.00 0.00 51.96 51.54 2iv9 s ALA 901 Cb -0.12 -0.03 0.02 0.00 0.00 0.00 0.00 23.12 22.99 2iv9 s ALA 901 CO 0.02 0.04 -0.13 -1.21 0.00 0.00 0.00 175.76 174.49 2iv9 s GLU 902 N -0.98 1.94 -0.20 0.00 2.02 -0.25 -0.25 118.70 120.99 2iv9 s GLU 902 Ca -0.05 -0.45 -0.02 0.00 0.02 0.00 0.00 54.97 54.47 2iv9 s GLU 902 Cb -0.07 -1.73 -0.01 0.00 0.10 0.00 0.00 34.13 32.43 2iv9 s GLU 902 CO 0.00 -0.11 -0.08 -1.17 0.02 0.00 0.00 175.26 173.92 2iv9 s LEU 903 N 1.14 2.77 -0.26 1.80 2.96 0.29 -0.75 118.68 126.62 2iv9 s LEU 903 Ca -0.04 -0.41 -0.11 0.00 -0.22 0.00 0.00 54.13 53.35 2iv9 s LEU 903 Cb -0.14 -1.68 -0.05 0.00 0.50 0.00 0.00 46.19 44.82 2iv9 s LEU 903 CO -0.03 0.02 0.18 -0.60 -1.32 0.00 0.00 176.35 174.61 2iv9 s ARG 904 N 1.21 4.00 -0.31 1.98 3.52 0.09 -0.51 118.95 128.94 2iv9 s ARG 904 Ca 0.02 -0.29 -0.00 0.00 -0.13 0.00 0.00 55.73 55.33 2iv9 s ARG 904 Cb -0.14 -3.61 0.06 0.00 -1.56 0.00 0.00 34.95 29.70 2iv9 s ARG 904 CO -0.03 -0.09 0.00 0.42 -0.81 0.00 0.00 175.30 174.80 2iv9 s ILE 905 N 1.49 2.77 -0.33 4.11 1.01 0.11 -2.21 121.20 128.14 2iv9 s ILE 905 Ca 0.07 -1.62 -0.12 0.00 0.00 0.00 0.00 60.65 58.99 2iv9 s ILE 905 Cb -0.15 -2.68 -0.02 0.00 0.01 0.00 0.00 42.46 39.62 2iv9 s ILE 905 CO 0.08 -0.21 0.22 -1.58 0.00 0.00 0.00 174.94 173.45 2iv9 s GLN 906 N 1.17 3.52 0.23 2.79 0.74 -1.26 -0.41 119.66 126.45 2iv9 s GLN 906 Ca -0.03 -0.62 -0.31 0.00 0.05 0.00 0.00 55.36 54.45 2iv9 s GLN 906 Cb -0.20 -3.75 -0.14 0.00 1.10 0.00 0.00 33.01 30.02 2iv9 s GLN 906 CO -0.03 -0.41 1.27 -0.35 -0.55 0.00 0.00 175.29 175.22 2iv9 n PRO 907 N 5.08 1.68 -0.73 1.67 -0.04 -1.26 -0.52 135.00 140.87 2iv9 n PRO 907 Ca -0.13 0.60 0.00 0.00 -0.04 0.00 0.00 63.50 63.93 2iv9 n PRO 907 Cb 0.50 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.80 2iv9 n PRO 907 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2iv9 n GLY 908 N 1.89 0.86 2.97 0.55 0.00 -1.26 -5.01 105.19 105.20 2iv9 n GLY 908 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 2iv9 n GLY 908 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2iv9 s ASN 909 N -2.99 3.62 0.00 1.61 3.84 0.32 -4.99 114.94 116.35 2iv9 s ASN 909 Ca 0.00 -1.02 0.22 0.00 0.21 0.00 0.00 52.86 52.27 2iv9 s ASN 909 Cb 0.00 -1.22 1.26 0.00 -0.55 0.00 0.00 41.25 40.74 2iv9 s ASN 909 CO 0.00 -0.18 1.82 -0.81 -2.79 0.00 0.00 177.10 175.14 2iv9 n PRO 910 N 4.67 1.10 -3.77 0.43 -0.04 -1.26 -4.46 135.00 131.66 2iv9 n PRO 910 Ca -0.13 -0.14 -0.37 0.00 -0.04 0.00 0.00 63.50 62.81 2iv9 n PRO 910 Cb 0.45 -1.36 -0.13 0.00 -0.04 0.00 0.00 33.50 32.43 2iv9 n PRO 910 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2iv9 s ASN 911 N -1.69 5.13 -0.04 3.54 0.01 -1.26 -1.20 114.94 119.42 2iv9 s ASN 911 Ca 0.33 -0.86 -0.15 0.00 -0.71 0.00 0.00 52.86 51.48 2iv9 s ASN 911 Cb 0.16 -1.86 -0.05 0.00 0.41 0.00 0.00 41.25 39.90 2iv9 s ASN 911 CO 0.26 -0.23 0.39 -0.31 -1.51 0.00 0.00 177.10 175.70 2iv9 s TYR 912 N 1.46 3.66 -0.25 2.20 2.02 -0.42 -4.80 117.35 121.20 2iv9 s TYR 912 Ca 0.01 0.90 -0.17 0.00 -0.37 0.00 0.00 57.07 57.44 2iv9 s TYR 912 Cb -0.18 -2.32 -0.03 0.00 -0.40 0.00 0.00 41.96 39.04 2iv9 s TYR 912 CO 0.02 0.53 0.49 0.99 -1.57 0.00 0.00 175.55 176.01 2iv9 s THR 913 N -0.62 5.09 -0.27 -0.71 2.01 -0.94 -0.45 115.64 119.75 2iv9 s THR 913 Ca 0.23 0.84 -0.09 0.00 0.31 0.00 0.00 61.69 62.98 2iv9 s THR 913 Cb -0.16 -3.81 -0.03 0.00 0.01 0.00 0.00 72.50 68.52 2iv9 s THR 913 CO 0.11 0.11 0.12 -0.22 -0.69 0.00 0.00 174.62 174.05 2iv9 s LEU 914 N 2.17 3.74 -0.17 4.42 2.96 0.11 -0.74 118.68 131.18 2iv9 s LEU 914 Ca 0.21 -0.24 -0.04 0.00 -0.22 0.00 0.00 54.13 53.83 2iv9 s LEU 914 Cb -0.16 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 2iv9 s LEU 914 CO 0.09 -0.08 -0.02 -0.44 -1.32 0.00 0.00 176.35 174.59 2iv9 s SER 915 N 1.65 4.91 -0.06 3.68 0.01 0.07 -0.91 113.70 123.06 2iv9 s SER 915 Ca 0.06 -0.12 0.06 0.00 1.31 0.00 0.00 55.95 57.26 2iv9 s SER 915 Cb -0.16 -1.82 -0.01 0.00 0.21 0.00 0.00 66.02 64.25 2iv9 s SER 915 CO 0.06 0.15 -0.23 -0.76 0.41 0.00 0.00 173.24 172.86 2iv9 s LEU 916 N 0.51 2.03 -0.04 2.44 1.43 -0.18 -1.09 118.68 123.78 2iv9 s LEU 916 Ca -0.02 -0.48 0.03 0.00 -1.03 0.00 0.00 54.13 52.64 2iv9 s LEU 916 Cb -0.14 -1.28 0.00 0.00 0.03 0.00 0.00 46.19 44.80 2iv9 s LEU 916 CO 0.02 0.22 -0.13 -0.54 0.23 0.00 0.00 176.35 176.15 2iv9 s LYS 917 N -0.09 1.48 -0.08 1.70 1.02 -0.30 -1.38 119.74 122.08 2iv9 s LYS 917 Ca -0.04 -0.46 -0.25 0.00 0.02 0.00 0.00 55.97 55.23 2iv9 s LYS 917 Cb -0.13 -1.29 0.06 0.00 -0.52 0.00 0.00 37.83 35.94 2iv9 s LYS 917 CO 0.04 0.15 0.58 0.00 -0.92 0.00 0.00 175.35 175.20 2iv9 n ARG 919 N 1.41 0.23 -3.66 0.00 1.74 -1.26 -3.55 116.66 111.57 2iv9 n ARG 919 Ca -0.18 0.07 -0.27 0.00 -0.77 0.00 0.00 57.85 56.69 2iv9 n ARG 919 Cb 0.56 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.40 2iv9 n ARG 919 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2iv9 n ALA 920 N -1.35 3.57 0.19 7.54 0.00 -1.26 -4.97 120.51 124.22 2iv9 n ALA 920 Ca 0.10 -4.46 0.09 0.00 0.00 0.00 0.00 53.44 49.16 2iv9 n ALA 920 Cb 0.22 -0.95 0.46 0.00 0.00 0.00 0.00 19.45 19.18 2iv9 n ALA 920 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2iv9 n PRO 921 N 1.59 0.12 0.30 0.00 -0.04 -1.23 -1.72 135.00 134.02 2iv9 n PRO 921 Ca 0.24 0.56 0.17 0.00 -0.04 0.00 0.00 63.50 64.43 2iv9 n PRO 921 Cb 0.39 -1.84 0.90 0.00 -0.04 0.00 0.00 33.50 32.91 2iv9 n PRO 921 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2iv9 h GLU 922 N 0.00 0.00 0.00 0.54 9.09 -1.93 -2.12 114.58 120.16 2iv9 h GLU 922 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2iv9 h GLU 922 Cb 0.08 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.18 2iv9 h GLU 922 CO 0.00 0.04 0.00 -0.39 0.05 0.00 0.00 179.01 178.71 2iv9 h VAL 923 N 0.00 0.00 -0.30 -1.06 -1.51 -1.77 -3.39 116.25 108.22 2iv9 h VAL 923 Ca -0.00 -0.54 0.05 0.00 -1.23 0.00 0.00 66.70 64.97 2iv9 h VAL 923 Cb 0.24 1.47 -0.04 0.00 -2.13 0.00 0.00 31.29 30.83 2iv9 h VAL 923 CO 0.01 0.00 0.03 0.28 -1.23 0.00 0.00 177.57 176.66 2iv9 h SER 924 N 0.00 -0.04 -0.76 4.19 0.02 -1.59 -1.71 113.55 113.66 2iv9 h SER 924 Ca 0.00 0.06 0.07 0.00 -0.84 0.00 0.00 61.79 61.08 2iv9 h SER 924 Cb 0.63 0.09 -0.05 0.00 0.14 0.00 0.00 62.40 63.20 2iv9 h SER 924 CO 0.00 0.01 0.50 0.06 -1.14 0.00 0.00 176.83 176.26 2iv9 h GLN 925 N 0.13 0.75 -0.14 3.45 3.07 -1.81 0.81 115.11 121.38 2iv9 h GLN 925 Ca 0.14 -0.04 -0.16 0.00 0.09 0.00 0.00 58.65 58.68 2iv9 h GLN 925 Cb 0.17 -0.17 -0.01 0.00 0.08 0.00 0.00 27.48 27.55 2iv9 h GLN 925 CO -0.21 0.49 -0.59 1.88 0.09 0.00 0.00 178.83 180.49 2iv9 h TYR 926 N 0.77 0.57 0.01 0.06 0.05 -1.61 -0.44 116.97 116.38 2iv9 h TYR 926 Ca 0.33 -0.21 -0.00 0.00 0.05 0.00 0.00 58.73 58.90 2iv9 h TYR 926 Cb 0.30 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 37.94 2iv9 h TYR 926 CO -0.00 0.93 -0.00 0.82 -1.05 0.00 0.00 178.16 178.85 2iv9 h ILE 927 N 0.34 1.27 -0.68 -2.88 1.08 -0.98 -2.72 117.51 112.94 2iv9 h ILE 927 Ca -0.00 -0.81 0.13 0.00 -0.39 0.00 0.00 64.86 63.79 2iv9 h ILE 927 Cb 1.13 1.82 -0.10 0.00 -3.07 0.00 0.00 36.82 36.60 2iv9 h ILE 927 CO 0.10 0.21 0.17 0.22 -0.69 0.00 0.00 178.15 178.17 2iv9 h TYR 928 N -0.35 0.28 -0.37 1.37 3.20 -0.73 -0.40 116.97 119.96 2iv9 h TYR 928 Ca -0.00 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 2iv9 h TYR 928 Cb 0.35 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.58 2iv9 h TYR 928 CO 0.04 -0.04 0.18 1.96 -1.64 0.00 0.00 178.16 178.67 2iv9 h GLN 929 N 0.29 0.53 -0.03 1.82 4.20 -0.97 0.22 115.11 121.17 2iv9 h GLN 929 Ca 0.37 -0.07 -0.18 0.00 0.06 0.00 0.00 58.65 58.83 2iv9 h GLN 929 Cb 0.58 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 2iv9 h GLN 929 CO -0.45 0.46 -0.77 -0.24 -0.67 0.00 0.00 178.83 177.17 2iv9 h VAL 930 N 0.46 1.44 -0.29 -0.54 3.04 -1.25 -1.82 116.25 117.28 2iv9 h VAL 930 Ca 0.13 -2.33 0.05 0.00 -1.01 0.00 0.00 66.70 63.54 2iv9 h VAL 930 Cb 0.10 2.26 -0.05 0.00 -2.01 0.00 0.00 31.29 31.59 2iv9 h VAL 930 CO -0.02 0.68 -0.03 0.22 -1.01 0.00 0.00 177.57 177.42 2iv9 h TYR 931 N 0.16 -0.08 -0.01 3.17 5.03 -0.74 -0.30 116.97 124.19 2iv9 h TYR 931 Ca -0.03 0.02 0.01 0.00 2.58 0.00 0.00 58.73 61.32 2iv9 h TYR 931 Cb 1.34 0.08 -0.02 0.00 1.55 0.00 0.00 36.73 39.69 2iv9 h TYR 931 CO 0.03 -0.08 -0.06 0.22 -1.32 0.00 0.00 178.16 176.95 2iv9 h ASP 932 N 0.05 -0.17 -0.97 -2.11 3.58 -0.37 -2.65 116.42 113.77 2iv9 h ASP 932 Ca 0.14 0.03 0.08 0.00 0.42 0.00 0.00 57.03 57.70 2iv9 h ASP 932 Cb 0.20 0.08 -0.07 0.00 1.72 0.00 0.00 39.33 41.26 2iv9 h ASP 932 CO -0.27 -0.09 0.62 0.28 -2.88 0.00 0.00 179.24 176.91 2iv9 h SER 933 N -0.10 0.96 -0.63 2.28 0.02 -1.03 -1.38 113.55 113.68 2iv9 h SER 933 Ca 0.03 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.97 2iv9 h SER 933 Cb 0.14 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.47 2iv9 h SER 933 CO -0.07 0.59 0.26 0.40 -1.14 0.00 0.00 176.83 176.87 2iv9 h ILE 934 N 1.08 1.23 0.00 3.27 2.04 -0.81 -2.47 117.51 121.85 2iv9 h ILE 934 Ca 0.44 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.60 2iv9 h ILE 934 Cb 0.25 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 2iv9 h ILE 934 CO -0.20 0.28 -0.06 0.18 0.00 0.00 0.00 178.15 178.35 2iv9 n LEU 935 N -4.45 0.70 -0.81 1.44 4.77 -0.88 -2.84 117.00 114.93 2iv9 n LEU 935 Ca 0.04 0.53 0.12 0.00 -0.03 0.00 0.00 56.01 56.67 2iv9 n LEU 935 Cb 0.16 -0.33 0.26 0.00 -2.33 0.00 0.00 43.42 41.18 2iv9 n LEU 935 CO 0.39 -0.14 0.72 0.29 -1.33 0.00 0.00 177.39 177.31 2iv9 n LYS 936 N -2.15 2.11 0.00 3.23 4.76 -0.57 -4.91 118.16 120.63 2iv9 n LYS 936 Ca 0.06 -1.63 0.00 0.00 -2.87 0.00 0.00 58.31 53.87 2iv9 n LYS 936 Cb 0.42 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 32.14 2iv9 n LYS 936 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12