#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xz7 n HIS 2 N 0.00 0.00 -4.38 3.52 -0.00 -1.26 -4.79 115.22 108.31 1xz7 n HIS 2 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 57.72 57.38 1xz7 n HIS 2 Cb 0.00 -0.40 -0.14 0.00 -0.00 0.00 0.00 29.99 29.45 1xz7 n HIS 2 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1xz7 s LEU 3 N 0.00 2.79 0.48 0.27 1.43 -1.26 -5.10 118.68 117.29 1xz7 s LEU 3 Ca 0.00 -0.36 -0.22 0.00 -1.03 0.00 0.00 54.13 52.52 1xz7 s LEU 3 Cb 0.00 -1.66 -0.07 0.00 0.03 0.00 0.00 46.19 44.49 1xz7 s LEU 3 CO 0.00 0.09 1.20 -0.89 0.23 0.00 0.00 176.35 176.98 1xz7 s THR 4 N 0.82 2.89 0.25 5.49 2.01 -1.26 -4.71 115.64 121.13 1xz7 s THR 4 Ca -0.03 0.66 -0.04 0.00 0.31 0.00 0.00 61.69 62.59 1xz7 s THR 4 Cb -0.15 -3.33 0.22 0.00 0.01 0.00 0.00 72.50 69.25 1xz7 s THR 4 CO 0.01 -0.02 1.79 -0.65 -0.69 0.00 0.00 174.62 175.06 1xz7 h PRO 5 N 1.86 0.67 0.00 4.92 0.11 -1.99 1.43 132.00 139.00 1xz7 h PRO 5 Ca -0.50 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.50 1xz7 h PRO 5 Cb 1.26 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1xz7 h PRO 5 CO 0.59 0.44 -0.34 1.05 -0.21 0.00 0.00 178.00 179.53 1xz7 h GLU 6 N 0.69 0.00 -0.04 1.05 9.09 -1.99 -1.61 114.58 121.77 1xz7 h GLU 6 Ca 0.41 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 59.78 1xz7 h GLU 6 Cb 0.47 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.57 1xz7 h GLU 6 CO -0.30 0.34 -0.13 0.93 0.05 0.00 0.00 179.01 179.90 1xz7 h GLU 7 N 0.00 0.16 -0.61 1.06 5.08 -0.99 -2.09 114.58 117.20 1xz7 h GLU 7 Ca -0.00 -0.12 0.10 0.00 -1.00 0.00 0.00 59.36 58.34 1xz7 h GLU 7 Cb 0.64 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.83 1xz7 h GLU 7 CO 0.04 0.74 0.19 0.87 -1.00 0.00 0.00 179.01 179.86 1xz7 h LYS 8 N -0.39 0.34 0.00 2.33 1.57 0.20 -1.53 116.57 119.09 1xz7 h LYS 8 Ca -0.00 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.66 1xz7 h LYS 8 Cb 0.76 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.98 1xz7 h LYS 8 CO 0.03 0.22 -0.46 0.66 -0.57 0.00 0.00 179.45 179.33 1xz7 h SER 9 N 0.35 0.00 -0.38 0.86 4.64 -1.35 -2.11 113.55 115.55 1xz7 h SER 9 Ca 0.32 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.48 1xz7 h SER 9 Cb 0.43 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.51 1xz7 h SER 9 CO -0.35 0.46 -0.35 0.00 -0.87 0.00 0.00 176.83 175.73 1xz7 h ALA 10 N 1.54 0.56 0.24 5.18 0.00 -0.59 -0.96 119.26 125.23 1xz7 h ALA 10 Ca -0.00 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 1xz7 h ALA 10 Cb 1.08 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1xz7 h ALA 10 CO 0.06 0.64 -0.12 0.28 0.00 0.00 0.00 179.25 180.11 1xz7 h VAL 11 N 0.73 0.82 -0.61 0.00 2.07 -1.20 -2.84 116.25 115.22 1xz7 h VAL 11 Ca 0.07 -0.44 0.03 0.00 0.82 0.00 0.00 66.70 67.17 1xz7 h VAL 11 Cb 0.94 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.74 1xz7 h VAL 11 CO 0.09 0.10 0.37 0.74 0.02 0.00 0.00 177.57 178.89 1xz7 h THR 12 N -0.55 1.07 -0.43 2.57 2.02 -1.40 -1.13 112.91 115.06 1xz7 h THR 12 Ca -0.03 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 66.87 1xz7 h THR 12 Cb 0.41 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 1xz7 h THR 12 CO 0.05 0.13 0.17 0.00 0.37 0.00 0.00 175.52 176.25 1xz7 h ALA 13 N 1.26 0.56 -0.48 6.16 0.00 -1.21 -2.48 119.26 123.07 1xz7 h ALA 13 Ca 0.24 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1xz7 h ALA 13 Cb 0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1xz7 h ALA 13 CO -0.10 0.17 0.03 1.25 0.00 0.00 0.00 179.25 180.60 1xz7 h LEU 14 N 0.55 0.81 -1.86 0.00 5.85 -1.22 -3.03 115.31 116.41 1xz7 h LEU 14 Ca 0.14 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 1xz7 h LEU 14 Cb 0.19 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.00 1xz7 h LEU 14 CO -0.01 0.89 -0.09 -0.25 -0.34 0.00 0.00 178.44 178.64 1xz7 h TRP 15 N 0.69 0.00 0.00 1.25 2.91 -1.03 -0.99 115.95 118.78 1xz7 h TRP 15 Ca 0.14 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.16 1xz7 h TRP 15 Cb 0.46 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.11 1xz7 h TRP 15 CO 0.03 0.09 0.00 0.41 -1.03 0.00 0.00 178.44 177.95 1xz7 n GLY 16 N -1.22 -1.04 0.90 2.65 0.00 -0.95 -1.74 105.19 103.79 1xz7 n GLY 16 Ca -0.03 0.12 0.10 0.00 0.00 0.00 0.00 46.02 46.21 1xz7 n GLY 16 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xz7 n LYS 17 N -2.15 2.07 -2.89 1.61 5.02 -0.38 -4.98 118.16 116.47 1xz7 n LYS 17 Ca 0.01 -1.93 -0.41 0.00 -2.02 0.00 0.00 58.31 53.96 1xz7 n LYS 17 Cb 0.13 -1.41 -0.04 0.00 -0.02 0.00 0.00 35.03 33.68 1xz7 n LYS 17 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1xz7 s VAL 18 N -1.48 4.86 -0.61 -0.18 1.01 -0.71 -5.00 120.40 118.29 1xz7 s VAL 18 Ca 0.29 1.75 -0.23 0.00 0.00 0.00 0.00 61.98 63.79 1xz7 s VAL 18 Cb 0.18 -4.18 0.06 0.00 0.00 0.00 0.00 36.38 32.44 1xz7 s VAL 18 CO 0.26 0.26 0.94 0.21 0.00 0.00 0.00 175.10 176.77 1xz7 s ASN 19 N 0.58 6.24 0.27 3.32 3.84 -1.26 -4.91 114.94 123.02 1xz7 s ASN 19 Ca 0.43 -0.71 -0.03 0.00 0.21 0.00 0.00 52.86 52.76 1xz7 s ASN 19 Cb -0.20 -2.42 0.35 0.00 -0.55 0.00 0.00 41.25 38.43 1xz7 s ASN 19 CO 0.24 -1.33 1.86 0.58 -2.79 0.00 0.00 177.10 175.66 1xz7 h VAL 20 N 5.99 1.23 0.33 -5.21 2.07 -1.95 -1.33 116.25 117.38 1xz7 h VAL 20 Ca -0.28 -0.67 -0.00 0.00 0.82 0.00 0.00 66.70 66.57 1xz7 h VAL 20 Cb 1.07 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1xz7 h VAL 20 CO 1.13 0.28 -0.32 0.44 0.02 0.00 0.00 177.57 179.12 1xz7 h ASP 21 N 1.00 -0.87 -0.08 0.57 5.19 -1.91 0.11 116.42 120.43 1xz7 h ASP 21 Ca 0.24 0.08 -0.01 0.00 -0.62 0.00 0.00 57.03 56.72 1xz7 h ASP 21 Cb 0.13 0.29 -0.00 0.00 0.18 0.00 0.00 39.33 39.93 1xz7 h ASP 21 CO -0.03 -0.46 0.01 -0.33 -3.12 0.00 0.00 179.24 175.31 1xz7 h GLU 22 N -0.68 0.14 -0.75 3.56 5.08 -1.93 -2.55 114.58 117.45 1xz7 h GLU 22 Ca -0.02 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1xz7 h GLU 22 Cb 0.62 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.82 1xz7 h GLU 22 CO -0.06 0.38 0.37 0.28 -1.00 0.00 0.00 179.01 178.99 1xz7 h VAL 23 N -0.12 1.24 -0.35 3.13 2.07 -1.18 -0.24 116.25 120.79 1xz7 h VAL 23 Ca 0.02 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 1xz7 h VAL 23 Cb 0.31 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 1xz7 h VAL 23 CO 0.00 0.28 0.15 1.23 0.02 0.00 0.00 177.57 179.25 1xz7 h GLY 24 N 1.06 0.56 0.99 2.17 0.00 -0.78 0.21 103.07 107.29 1xz7 h GLY 24 Ca 0.26 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 1xz7 h GLY 24 CO -0.03 0.28 0.33 -1.33 0.00 0.00 0.00 176.54 175.79 1xz7 h GLY 25 N 0.42 0.93 0.97 4.60 0.00 -1.21 -2.40 103.07 106.38 1xz7 h GLY 25 Ca 0.12 -0.43 -0.08 0.00 0.00 0.00 0.00 47.33 46.94 1xz7 h GLY 25 CO -0.01 0.41 -0.04 -2.09 0.00 0.00 0.00 176.54 174.81 1xz7 h GLU 26 N 0.84 0.77 0.10 4.80 4.81 -0.72 -1.88 114.58 123.30 1xz7 h GLU 26 Ca 0.22 -0.27 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 1xz7 h GLU 26 Cb 0.06 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1xz7 h GLU 26 CO -0.03 0.87 -0.05 0.00 -0.73 0.00 0.00 179.01 179.07 1xz7 h ALA 27 N 0.88 -0.14 -0.64 2.92 0.00 -0.51 -1.08 119.26 120.68 1xz7 h ALA 27 Ca 0.11 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1xz7 h ALA 27 Cb 0.55 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1xz7 h ALA 27 CO 0.03 -0.52 0.09 1.25 0.00 0.00 0.00 179.25 180.10 1xz7 h LEU 28 N -0.25 1.03 -0.74 0.00 5.85 -1.49 -1.99 115.31 117.72 1xz7 h LEU 28 Ca -0.01 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 1xz7 h LEU 28 Cb 0.21 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.93 1xz7 h LEU 28 CO 0.02 1.03 0.42 1.23 -0.34 0.00 0.00 178.44 180.81 1xz7 h GLY 29 N 0.98 1.10 1.45 3.75 0.00 -1.26 -2.48 103.07 106.62 1xz7 h GLY 29 Ca 0.19 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.96 1xz7 h GLY 29 CO 0.01 0.47 -0.09 3.21 0.00 0.00 0.00 176.54 180.14 1xz7 h ARG 30 N 1.02 0.66 -0.24 4.80 3.08 -0.87 -1.60 114.38 121.23 1xz7 h ARG 30 Ca 0.26 -0.20 0.03 0.00 0.07 0.00 0.00 59.98 60.14 1xz7 h ARG 30 Cb 0.02 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 29.97 1xz7 h ARG 30 CO -0.04 0.74 0.06 1.25 -1.07 0.00 0.00 179.97 180.91 1xz7 h LEU 31 N 0.61 0.05 -1.25 3.04 5.85 -1.05 0.27 115.31 122.82 1xz7 h LEU 31 Ca 0.11 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.79 1xz7 h LEU 31 Cb 0.52 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1xz7 h LEU 31 CO 0.03 0.06 -0.32 -0.07 -0.34 0.00 0.00 178.44 177.81 1xz7 h LEU 32 N 0.17 0.10 0.13 2.25 3.38 -1.07 -1.59 115.31 118.67 1xz7 h LEU 32 Ca 0.11 -0.03 -0.21 0.00 0.09 0.00 0.00 57.88 57.84 1xz7 h LEU 32 Cb 0.09 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 40.83 1xz7 h LEU 32 CO -0.13 0.41 -1.00 0.58 0.09 0.00 0.00 178.44 178.39 1xz7 h VAL 33 N 0.09 1.35 -0.01 1.22 2.07 -0.94 -3.27 116.25 116.75 1xz7 h VAL 33 Ca 0.01 -2.48 -0.18 0.00 0.82 0.00 0.00 66.70 64.86 1xz7 h VAL 33 Cb 0.60 3.03 -0.01 0.00 -1.52 0.00 0.00 31.29 33.39 1xz7 h VAL 33 CO 0.04 0.70 -0.81 0.58 0.02 0.00 0.00 177.57 178.11 1xz7 h VAL 34 N -0.38 1.47 -2.46 2.57 2.07 -0.46 -3.34 116.25 115.72 1xz7 h VAL 34 Ca -0.20 -2.47 -0.60 0.00 0.82 0.00 0.00 66.70 64.26 1xz7 h VAL 34 Cb 1.66 2.35 -0.41 0.00 -1.52 0.00 0.00 31.29 33.38 1xz7 h VAL 34 CO 0.11 0.72 -0.71 -1.22 0.02 0.00 0.00 177.57 176.49 1xz7 n TYR 35 N -3.71 2.39 -0.22 1.57 4.01 -0.60 -4.99 117.16 115.61 1xz7 n TYR 35 Ca -0.03 -4.02 0.29 0.00 -0.16 0.00 0.00 57.90 53.98 1xz7 n TYR 35 Cb 0.76 -0.45 0.71 0.00 -0.31 0.00 0.00 39.34 40.05 1xz7 n TYR 35 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1xz7 h PRO 36 N 4.69 0.04 0.00 -0.72 0.10 -1.69 -1.72 132.00 132.71 1xz7 h PRO 36 Ca 0.17 -0.00 -0.02 0.00 0.10 0.00 0.00 66.00 66.26 1xz7 h PRO 36 Cb 0.75 -0.01 -0.00 0.00 0.10 0.00 0.00 31.00 31.84 1xz7 h PRO 36 CO 0.69 0.02 -0.07 0.11 0.10 0.00 0.00 178.00 178.85 1xz7 h TRP 37 N 0.04 0.00 0.00 0.65 0.09 -1.92 -1.71 115.95 113.10 1xz7 h TRP 37 Ca 0.46 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.44 1xz7 h TRP 37 Cb 1.79 0.00 0.00 0.00 0.08 0.00 0.00 29.16 31.03 1xz7 h TRP 37 CO -0.00 0.07 0.00 0.25 0.09 0.00 0.00 178.44 178.85 1xz7 n THR 38 N -3.50 1.12 0.31 0.12 -2.24 -0.64 -2.02 114.28 107.42 1xz7 n THR 38 Ca -0.02 0.35 0.18 0.00 -2.27 0.00 0.00 64.05 62.29 1xz7 n THR 38 Cb 0.20 -1.23 0.98 0.00 -2.10 0.00 0.00 70.33 68.18 1xz7 n THR 38 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1xz7 h GLN 39 N 0.00 0.00 -0.21 -0.78 4.20 -1.52 -2.27 115.11 114.53 1xz7 h GLN 39 Ca 0.00 0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.77 1xz7 h GLN 39 Cb 0.21 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 1xz7 h GLN 39 CO 0.00 0.02 0.18 -0.09 -0.67 0.00 0.00 178.83 178.27 1xz7 h ARG 40 N 0.00 0.00 0.00 1.46 9.65 -1.63 0.22 114.38 124.08 1xz7 h ARG 40 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1xz7 h ARG 40 Cb 0.11 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.69 1xz7 h ARG 40 CO 0.00 0.00 0.00 1.19 2.80 0.00 0.00 179.97 183.96 1xz7 n PHE 41 N -4.21 0.59 -2.00 2.20 3.72 -0.85 -4.01 117.46 112.90 1xz7 n PHE 41 Ca 0.02 0.19 -0.04 0.00 -0.05 0.00 0.00 57.45 57.58 1xz7 n PHE 41 Cb 0.31 -0.81 0.11 0.00 -0.94 0.00 0.00 39.48 38.15 1xz7 n PHE 41 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1xz7 n PHE 42 N -2.00 0.95 -0.27 1.38 3.72 0.76 -4.85 117.46 117.14 1xz7 n PHE 42 Ca 0.05 -1.62 0.21 0.00 -0.05 0.00 0.00 57.45 56.03 1xz7 n PHE 42 Cb 0.33 -0.26 0.51 0.00 -0.94 0.00 0.00 39.48 39.12 1xz7 n PHE 42 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1xz7 h GLU 43 N 1.52 0.39 -0.02 -1.08 4.39 -1.68 -0.56 114.58 117.54 1xz7 h GLU 43 Ca 0.06 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1xz7 h GLU 43 Cb 1.33 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 1xz7 h GLU 43 CO 0.26 0.26 0.00 -1.13 -1.16 0.00 0.00 179.01 177.24 1xz7 n SER 44 N -4.54 0.33 0.10 1.42 3.41 -1.26 -3.63 113.62 109.45 1xz7 n SER 44 Ca 0.21 -1.38 0.13 0.00 -0.26 0.00 0.00 58.87 57.58 1xz7 n SER 44 Cb 0.77 -0.02 0.35 0.00 -0.26 0.00 0.00 64.21 65.05 1xz7 n SER 44 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1xz7 h PHE 45 N 0.45 0.00 0.00 7.33 -1.00 -1.49 -3.50 116.94 118.73 1xz7 h PHE 45 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1xz7 h PHE 45 Cb 0.10 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.66 1xz7 h PHE 45 CO 0.02 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.13 1xz7 n GLY 46 N 1.31 0.62 3.65 -1.45 0.00 -1.24 -4.78 105.19 103.30 1xz7 n GLY 46 Ca 0.05 -1.74 -0.43 0.00 0.00 0.00 0.00 46.02 43.91 1xz7 n GLY 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xz7 s ASP 47 N -4.00 6.68 -0.04 1.61 2.15 -1.26 -4.83 116.67 116.98 1xz7 s ASP 47 Ca 0.00 1.91 0.11 0.00 0.43 0.00 0.00 52.55 55.00 1xz7 s ASP 47 Cb 0.00 -2.53 0.19 0.00 -0.30 0.00 0.00 42.92 40.28 1xz7 s ASP 47 CO 0.00 -0.96 1.09 0.18 -0.17 0.00 0.00 175.17 175.31 1xz7 n LEU 48 N 7.30 0.91 0.14 -1.34 4.77 -1.26 -4.31 117.00 123.20 1xz7 n LEU 48 Ca 0.17 -1.88 -0.01 0.00 -0.03 0.00 0.00 56.01 54.26 1xz7 n LEU 48 Cb 0.44 -0.12 0.20 0.00 -2.33 0.00 0.00 43.42 41.60 1xz7 n LEU 48 CO 0.61 0.50 0.53 0.77 -1.33 0.00 0.00 177.39 178.46 1xz7 h SER 49 N 0.34 0.00 -3.57 -1.43 4.64 -1.94 -3.44 113.55 108.14 1xz7 h SER 49 Ca -0.06 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.84 1xz7 h SER 49 Cb 1.42 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.35 1xz7 h SER 49 CO 0.02 0.58 -0.74 0.42 -0.87 0.00 0.00 176.83 176.25 1xz7 s THR 50 N -3.67 1.53 0.23 2.95 -4.23 -1.26 -5.04 115.64 106.15 1xz7 s THR 50 Ca -0.01 -2.06 -0.06 0.00 -1.18 0.00 0.00 61.69 58.38 1xz7 s THR 50 Cb 0.13 -1.88 0.19 0.00 1.34 0.00 0.00 72.50 72.27 1xz7 s THR 50 CO 0.76 -0.58 1.75 -0.65 -0.54 0.00 0.00 174.62 175.36 1xz7 h PRO 51 N 2.85 0.50 -0.51 3.99 0.11 -1.98 -0.86 132.00 136.10 1xz7 h PRO 51 Ca -0.38 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.70 1xz7 h PRO 51 Cb 1.21 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 1xz7 h PRO 51 CO 0.59 0.33 0.33 -0.44 -0.21 0.00 0.00 178.00 178.60 1xz7 h ASP 52 N 0.51 0.57 -0.59 -2.05 3.32 -1.98 0.20 116.42 116.40 1xz7 h ASP 52 Ca 0.37 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.41 1xz7 h ASP 52 Cb 0.48 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.87 1xz7 h ASP 52 CO -0.33 0.41 0.35 0.00 -1.72 0.00 0.00 179.24 177.95 1xz7 h ALA 53 N 1.19 0.75 0.13 3.45 0.00 -1.72 -1.36 119.26 121.70 1xz7 h ALA 53 Ca 0.19 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1xz7 h ALA 53 Cb -0.07 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.49 1xz7 h ALA 53 CO -0.05 0.23 -0.06 0.28 0.00 0.00 0.00 179.25 179.65 1xz7 h VAL 54 N 0.79 0.89 0.00 0.00 2.07 -0.12 -0.93 116.25 118.95 1xz7 h VAL 54 Ca 0.21 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.61 1xz7 h VAL 54 Cb -0.02 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1xz7 h VAL 54 CO -0.04 0.02 -0.19 0.24 0.02 0.00 0.00 177.57 177.62 1xz7 h MET 55 N -0.22 0.00 -0.01 1.57 2.07 -0.53 -2.37 114.93 115.45 1xz7 h MET 55 Ca -0.02 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.61 1xz7 h MET 55 Cb 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.90 1xz7 h MET 55 CO 0.03 0.19 -0.35 0.41 1.07 0.00 0.00 176.91 178.27 1xz7 n GLY 56 N -0.70 -0.43 3.64 8.32 0.00 -0.53 -4.87 105.19 110.63 1xz7 n GLY 56 Ca -0.02 -0.48 -0.43 0.00 0.00 0.00 0.00 46.02 45.09 1xz7 n GLY 56 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1xz7 s ASN 57 N -2.51 6.43 0.46 1.61 3.84 -0.38 -4.89 114.94 119.49 1xz7 s ASN 57 Ca 0.22 1.81 0.11 0.00 0.21 0.00 0.00 52.86 55.21 1xz7 s ASN 57 Cb 0.19 -2.53 1.03 0.00 -0.55 0.00 0.00 41.25 39.38 1xz7 s ASN 57 CO 0.55 -1.19 2.08 -0.65 -2.79 0.00 0.00 177.10 175.10 1xz7 h PRO 58 N 10.55 0.27 -0.09 0.43 0.11 -1.90 0.54 132.00 141.91 1xz7 h PRO 58 Ca -0.35 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.56 1xz7 h PRO 58 Cb 1.16 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1xz7 h PRO 58 CO 0.99 0.20 -0.68 0.87 -0.21 0.00 0.00 178.00 179.17 1xz7 h LYS 59 N 0.28 0.38 -0.32 1.05 1.57 -1.90 0.74 116.57 118.36 1xz7 h LYS 59 Ca 0.07 -0.29 -0.07 0.00 -1.87 0.00 0.00 60.65 58.50 1xz7 h LYS 59 Cb 0.01 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1xz7 h LYS 59 CO -0.01 0.92 -0.07 0.28 -0.57 0.00 0.00 179.45 180.00 1xz7 h VAL 60 N 0.27 1.28 -0.53 0.50 2.07 -1.50 -1.69 116.25 116.65 1xz7 h VAL 60 Ca -0.02 -1.10 -0.02 0.00 0.82 0.00 0.00 66.70 66.37 1xz7 h VAL 60 Cb 1.23 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 32.31 1xz7 h VAL 60 CO 0.11 0.36 0.24 0.11 0.02 0.00 0.00 177.57 178.41 1xz7 h LYS 61 N 0.39 0.77 -0.41 1.57 1.57 -0.79 -0.97 116.57 118.71 1xz7 h LYS 61 Ca 0.08 -0.12 -0.09 0.00 -1.87 0.00 0.00 60.65 58.65 1xz7 h LYS 61 Cb 0.55 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 1xz7 h LYS 61 CO 0.03 0.65 -0.09 0.00 -0.57 0.00 0.00 179.45 179.47 1xz7 h ALA 62 N 1.08 0.56 -0.11 3.86 0.00 -0.81 -2.32 119.26 121.52 1xz7 h ALA 62 Ca 0.18 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 1xz7 h ALA 62 Cb 0.15 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1xz7 h ALA 62 CO -0.02 0.43 -0.45 1.25 0.00 0.00 0.00 179.25 180.46 1xz7 h HIS 63 N 0.60 0.31 -0.70 0.00 -0.00 -1.19 -2.27 115.15 111.89 1xz7 h HIS 63 Ca 0.10 -0.09 -0.04 0.00 -0.00 0.00 0.00 60.37 60.34 1xz7 h HIS 63 Cb 0.62 -0.07 -0.03 0.00 -0.00 0.00 0.00 27.41 27.93 1xz7 h HIS 63 CO 0.05 0.67 0.28 0.78 -0.00 0.00 0.00 177.93 179.70 1xz7 h GLY 64 N 1.27 1.12 1.35 5.26 0.00 -0.99 -0.74 103.07 110.33 1xz7 h GLY 64 Ca 0.01 -0.59 -0.06 0.00 0.00 0.00 0.00 47.33 46.69 1xz7 h GLY 64 CO 0.07 0.56 0.07 1.70 0.00 0.00 0.00 176.54 178.95 1xz7 h LYS 65 N 1.02 0.81 -0.04 4.80 3.64 -0.93 -1.62 116.57 124.25 1xz7 h LYS 65 Ca 0.24 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1xz7 h LYS 65 Cb 0.20 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1xz7 h LYS 65 CO -0.02 0.76 -0.04 -0.22 -2.27 0.00 0.00 179.45 177.67 1xz7 h LYS 66 N 0.77 0.10 -0.09 1.90 3.64 -0.94 -1.61 116.57 120.34 1xz7 h LYS 66 Ca 0.16 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.53 1xz7 h LYS 66 Cb 0.36 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.13 1xz7 h LYS 66 CO 0.01 0.54 -0.26 0.28 -2.27 0.00 0.00 179.45 177.75 1xz7 h VAL 67 N -0.34 0.40 0.00 2.00 2.07 -1.07 -2.32 116.25 117.00 1xz7 h VAL 67 Ca 0.01 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.49 1xz7 h VAL 67 Cb 0.52 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1xz7 h VAL 67 CO 0.01 0.00 -0.20 0.25 0.02 0.00 0.00 177.57 177.65 1xz7 h LEU 68 N -0.35 0.00 -0.66 2.57 5.85 -1.32 -1.10 115.31 120.31 1xz7 h LEU 68 Ca 0.09 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 1xz7 h LEU 68 Cb 0.48 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 1xz7 h LEU 68 CO -0.28 0.20 0.09 1.23 -0.34 0.00 0.00 178.44 179.33 1xz7 h GLY 69 N 1.54 1.18 0.96 3.75 0.00 -0.94 0.33 103.07 109.90 1xz7 h GLY 69 Ca -0.00 -0.81 -0.08 0.00 0.00 0.00 0.00 47.33 46.44 1xz7 h GLY 69 CO 0.03 0.75 -0.06 0.00 0.00 0.00 0.00 176.54 177.25 1xz7 h ALA 70 N 1.04 0.54 0.00 3.60 0.00 -0.81 -1.72 119.26 121.90 1xz7 h ALA 70 Ca 0.20 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1xz7 h ALA 70 Cb 0.47 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1xz7 h ALA 70 CO 0.02 0.37 -0.11 0.35 0.00 0.00 0.00 179.25 179.88 1xz7 h PHE 71 N 0.55 -0.28 -0.73 0.00 3.04 -0.92 -1.67 116.94 116.92 1xz7 h PHE 71 Ca 0.10 0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.16 1xz7 h PHE 71 Cb 0.57 0.12 -0.07 0.00 2.56 0.00 0.00 35.95 39.13 1xz7 h PHE 71 CO 0.05 -0.17 0.37 1.03 -2.02 0.00 0.00 178.31 177.57 1xz7 h SER 72 N -0.19 0.47 0.34 0.41 0.87 -0.22 0.18 113.55 115.41 1xz7 h SER 72 Ca 0.04 0.06 -0.05 0.00 -1.23 0.00 0.00 61.79 60.61 1xz7 h SER 72 Cb 0.24 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.18 1xz7 h SER 72 CO -0.11 0.26 -0.24 0.44 -0.53 0.00 0.00 176.83 176.65 1xz7 h ASP 73 N 0.61 0.00 0.15 6.23 3.32 -0.88 -2.40 116.42 123.44 1xz7 h ASP 73 Ca 0.37 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.35 1xz7 h ASP 73 Cb 0.40 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 1xz7 h ASP 73 CO -0.28 0.24 -0.25 1.23 -1.72 0.00 0.00 179.24 178.46 1xz7 h GLY 74 N 0.92 0.20 2.00 2.75 0.00 0.28 -2.73 103.07 106.48 1xz7 h GLY 74 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1xz7 h GLY 74 CO 0.03 0.13 0.00 1.04 0.00 0.00 0.00 176.54 177.74 1xz7 n LEU 75 N -4.18 0.50 -0.82 3.11 4.77 -0.90 -0.75 117.00 118.72 1xz7 n LEU 75 Ca -0.01 0.64 0.12 0.00 -0.03 0.00 0.00 56.01 56.73 1xz7 n LEU 75 Cb 0.34 -0.59 0.28 0.00 -2.33 0.00 0.00 43.42 41.13 1xz7 n LEU 75 CO 0.39 -0.55 0.73 0.00 -1.33 0.00 0.00 177.39 176.63 1xz7 n ALA 76 N -1.71 2.49 -2.45 -1.18 0.00 -1.03 -4.14 120.51 112.49 1xz7 n ALA 76 Ca 0.02 -0.68 -0.05 0.00 0.00 0.00 0.00 53.44 52.73 1xz7 n ALA 76 Cb 0.18 -0.97 0.05 0.00 0.00 0.00 0.00 19.45 18.72 1xz7 n ALA 76 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1xz7 n HIS 77 N 0.91 1.26 0.06 0.00 8.25 0.07 -4.91 115.22 120.86 1xz7 n HIS 77 Ca 0.17 -1.79 0.18 0.00 -0.26 0.00 0.00 57.72 56.02 1xz7 n HIS 77 Cb 0.49 -0.24 0.70 0.00 1.12 0.00 0.00 29.99 32.05 1xz7 n HIS 77 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1xz7 h LEU 78 N 2.04 0.00 0.00 2.41 3.38 -1.69 0.38 115.31 121.82 1xz7 h LEU 78 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1xz7 h LEU 78 Cb 1.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.18 1xz7 h LEU 78 CO 0.29 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.29 1xz7 n ASP 79 N -4.33 0.00 -2.95 -0.43 8.00 -1.26 -1.34 116.55 114.25 1xz7 n ASP 79 Ca 0.07 0.30 -0.13 0.00 0.71 0.00 0.00 54.79 55.74 1xz7 n ASP 79 Cb 0.50 -0.42 0.03 0.00 -0.02 0.00 0.00 41.12 41.20 1xz7 n ASP 79 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1xz7 n ASN 80 N -1.42 -0.93 -0.27 -2.24 5.15 0.13 -4.89 115.26 110.79 1xz7 n ASN 80 Ca 0.08 -3.34 -0.06 0.00 -0.60 0.00 0.00 54.58 50.65 1xz7 n ASN 80 Cb 0.25 0.74 0.06 0.00 -0.53 0.00 0.00 39.78 40.30 1xz7 n ASN 80 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1xz7 h LEU 81 N 3.11 1.09 -0.19 1.20 3.38 -1.67 -2.40 115.31 119.82 1xz7 h LEU 81 Ca -0.01 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.80 1xz7 h LEU 81 Cb 1.03 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 1xz7 h LEU 81 CO 0.31 1.00 -0.06 0.11 0.09 0.00 0.00 178.44 179.90 1xz7 h LYS 82 N 1.12 -0.02 -0.32 1.13 6.56 -1.90 -1.17 116.57 121.97 1xz7 h LYS 82 Ca 0.24 0.00 -0.12 0.00 -1.06 0.00 0.00 60.65 59.71 1xz7 h LYS 82 Cb 0.30 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.95 1xz7 h LYS 82 CO -0.01 -0.01 -0.31 0.78 -2.06 0.00 0.00 179.45 177.84 1xz7 h GLY 83 N -0.02 0.74 1.19 3.86 0.00 -1.95 -2.51 103.07 104.38 1xz7 h GLY 83 Ca 0.09 -0.68 -0.07 0.00 0.00 0.00 0.00 47.33 46.67 1xz7 h GLY 83 CO -0.21 0.62 0.10 -0.84 0.00 0.00 0.00 176.54 176.21 1xz7 h THR 84 N 0.58 1.25 -0.63 4.70 2.02 -1.06 -3.16 112.91 116.61 1xz7 h THR 84 Ca 0.07 -0.99 0.00 0.00 0.77 0.00 0.00 66.41 66.26 1xz7 h THR 84 Cb 0.82 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 1xz7 h THR 84 CO 0.07 0.37 0.00 0.49 0.37 0.00 0.00 175.52 176.82 1xz7 n PHE 85 N -4.22 1.07 0.21 3.16 3.72 -0.48 -4.66 117.46 116.26 1xz7 n PHE 85 Ca 0.04 -0.55 -0.15 0.00 -0.05 0.00 0.00 57.45 56.74 1xz7 n PHE 85 Cb 0.28 -0.10 -0.07 0.00 -0.94 0.00 0.00 39.48 38.65 1xz7 n PHE 85 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1xz7 h ALA 86 N 3.81 -0.64 -0.87 4.37 0.00 -1.42 0.31 119.26 124.82 1xz7 h ALA 86 Ca 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1xz7 h ALA 86 Cb 1.12 0.41 -0.04 0.00 0.00 0.00 0.00 17.79 19.29 1xz7 h ALA 86 CO 0.09 -0.89 0.47 1.79 0.00 0.00 0.00 179.25 180.70 1xz7 h THR 87 N -0.64 1.26 -0.49 0.00 1.35 -1.84 -0.71 112.91 111.83 1xz7 h THR 87 Ca -0.02 -0.65 -0.04 0.00 -0.55 0.00 0.00 66.41 65.14 1xz7 h THR 87 Cb 0.57 0.09 -0.02 0.00 -1.73 0.00 0.00 68.15 67.06 1xz7 h THR 87 CO -0.04 0.29 0.13 -0.07 -0.25 0.00 0.00 175.52 175.58 1xz7 h LEU 88 N 1.23 0.68 0.12 3.87 4.07 -1.78 -1.22 115.31 122.28 1xz7 h LEU 88 Ca 0.31 -0.11 -0.01 0.00 0.08 0.00 0.00 57.88 58.15 1xz7 h LEU 88 Cb 0.05 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.61 1xz7 h LEU 88 CO -0.05 0.67 -0.06 -1.28 -1.08 0.00 0.00 178.44 176.65 1xz7 h SER 89 N 0.72 -0.13 -0.76 -0.43 0.87 1.00 -1.38 113.55 113.43 1xz7 h SER 89 Ca 0.16 -0.15 0.10 0.00 -1.23 0.00 0.00 61.79 60.67 1xz7 h SER 89 Cb 0.26 0.03 -0.07 0.00 -0.44 0.00 0.00 62.40 62.18 1xz7 h SER 89 CO -0.00 0.07 0.40 -0.33 -0.53 0.00 0.00 176.83 176.44 1xz7 h GLU 90 N -0.34 0.64 -0.48 2.24 5.08 -0.99 -1.50 114.58 119.23 1xz7 h GLU 90 Ca -0.02 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 1xz7 h GLU 90 Cb 0.28 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1xz7 h GLU 90 CO 0.03 0.42 0.13 1.25 -1.00 0.00 0.00 179.01 179.84 1xz7 h LEU 91 N 0.66 0.72 -1.20 1.33 5.85 -1.09 0.30 115.31 121.89 1xz7 h LEU 91 Ca 0.38 -0.23 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 1xz7 h LEU 91 Cb 0.40 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 1xz7 h LEU 91 CO -0.27 0.76 0.11 0.45 -0.34 0.00 0.00 178.44 179.14 1xz7 h HIS 92 N 0.65 0.68 0.00 1.25 3.86 -0.68 -1.66 115.15 119.24 1xz7 h HIS 92 Ca 0.15 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.30 1xz7 h HIS 92 Cb 0.31 -0.20 -0.00 0.00 1.06 0.00 0.00 27.41 28.58 1xz7 h HIS 92 CO 0.02 0.58 -0.09 0.00 0.86 0.00 0.00 177.93 179.30 1xz7 h ASP 94 N -1.00 0.18 0.00 0.00 3.32 -0.46 -3.14 116.42 115.32 1xz7 h ASP 94 Ca -0.02 -0.17 -0.29 0.00 0.02 0.00 0.00 57.03 56.57 1xz7 h ASP 94 Cb 0.51 -0.06 -0.05 0.00 0.22 0.00 0.00 39.33 39.96 1xz7 h ASP 94 CO -0.01 1.07 -2.10 0.29 -1.72 0.00 0.00 179.24 176.77 1xz7 n LYS 95 N -3.50 0.50 0.06 3.56 4.01 -0.79 -4.73 118.16 117.27 1xz7 n LYS 95 Ca -0.03 0.11 0.08 0.00 -0.51 0.00 0.00 58.31 57.96 1xz7 n LYS 95 Cb 0.91 -1.39 -0.05 0.00 -0.51 0.00 0.00 35.03 33.99 1xz7 n LYS 95 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 1xz7 n LEU 96 N -3.06 0.71 -3.76 -0.35 4.77 -0.69 -5.00 117.00 109.62 1xz7 n LEU 96 Ca -0.34 0.29 -0.24 0.00 -0.03 0.00 0.00 56.01 55.68 1xz7 n LEU 96 Cb 0.87 -0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.99 1xz7 n LEU 96 CO 0.20 -0.06 0.02 1.41 -1.33 0.00 0.00 177.39 177.63 1xz7 n HIS 97 N -2.67 -2.12 -3.40 -1.77 8.25 -0.19 -4.97 115.22 108.35 1xz7 n HIS 97 Ca -0.04 0.88 -0.39 0.00 -0.26 0.00 0.00 57.72 57.91 1xz7 n HIS 97 Cb 0.64 -4.31 -0.09 0.00 1.12 0.00 0.00 29.99 27.35 1xz7 n HIS 97 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1xz7 s VAL 98 N -3.51 5.18 0.00 1.59 1.01 -0.74 -5.03 120.40 118.91 1xz7 s VAL 98 Ca 0.27 0.53 -0.32 0.00 0.00 0.00 0.00 61.98 62.46 1xz7 s VAL 98 Cb -0.13 -3.70 -0.11 0.00 0.00 0.00 0.00 36.38 32.44 1xz7 s VAL 98 CO 0.81 0.15 1.88 -0.67 0.00 0.00 0.00 175.10 177.27 1xz7 n ASP 99 N 5.33 3.72 0.29 3.32 -0.08 -1.26 -4.75 116.55 123.11 1xz7 n ASP 99 Ca -0.09 0.96 0.19 0.00 -1.51 0.00 0.00 54.79 54.35 1xz7 n ASP 99 Cb 0.51 -1.45 1.03 0.00 2.34 0.00 0.00 41.12 43.55 1xz7 n ASP 99 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1xz7 h PRO 100 N 9.26 0.00 -0.30 -0.67 0.11 -1.96 -0.92 132.00 137.52 1xz7 h PRO 100 Ca -0.48 0.00 0.09 0.00 0.11 0.00 0.00 66.00 65.71 1xz7 h PRO 100 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1xz7 h PRO 100 CO 0.94 0.00 0.24 1.49 -0.21 0.00 0.00 178.00 180.46 1xz7 h GLU 101 N 0.00 0.00 0.00 1.05 4.57 -1.98 0.94 114.58 119.16 1xz7 h GLU 101 Ca 0.00 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 1xz7 h GLU 101 Cb 0.01 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.60 1xz7 h GLU 101 CO 0.00 0.00 -0.13 -0.91 -1.18 0.00 0.00 179.01 176.79 1xz7 h ASN 102 N 0.00 0.00 -0.06 1.04 4.21 -1.53 -2.01 115.58 117.22 1xz7 h ASN 102 Ca 0.14 0.00 -0.11 0.00 1.21 0.00 0.00 56.30 57.55 1xz7 h ASN 102 Cb 0.62 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.80 1xz7 h ASN 102 CO -0.00 0.13 -0.29 -0.26 -1.29 0.00 0.00 177.43 175.72 1xz7 h PHE 103 N 0.00 0.59 -0.37 1.19 0.04 -0.99 -1.60 116.94 115.80 1xz7 h PHE 103 Ca -0.00 -0.14 -0.11 0.00 2.80 0.00 0.00 57.97 60.52 1xz7 h PHE 103 Cb 0.37 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.37 1xz7 h PHE 103 CO 0.00 0.76 -0.20 0.00 -0.60 0.00 0.00 178.31 178.26 1xz7 h ARG 104 N 0.45 0.78 -0.47 1.51 3.08 -1.38 -1.79 114.38 116.57 1xz7 h ARG 104 Ca 0.06 -0.35 -0.00 0.00 0.07 0.00 0.00 59.98 59.75 1xz7 h ARG 104 Cb 0.74 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.75 1xz7 h ARG 104 CO 0.06 0.98 0.28 -0.07 -1.07 0.00 0.00 179.97 180.14 1xz7 h LEU 105 N 0.58 0.56 -0.42 3.04 3.38 -1.23 -2.17 115.31 119.06 1xz7 h LEU 105 Ca 0.08 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1xz7 h LEU 105 Cb 0.76 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1xz7 h LEU 105 CO 0.06 0.46 0.19 0.25 0.09 0.00 0.00 178.44 179.49 1xz7 h LEU 106 N 0.62 0.55 -0.60 1.67 5.85 -1.22 -1.11 115.31 121.07 1xz7 h LEU 106 Ca 0.17 -0.14 0.12 0.00 0.84 0.00 0.00 57.88 58.87 1xz7 h LEU 106 Cb 0.00 -0.14 -0.11 0.00 0.37 0.00 0.00 40.66 40.79 1xz7 h LEU 106 CO -0.03 0.54 -0.06 1.23 -0.34 0.00 0.00 178.44 179.79 1xz7 h GLY 107 N 0.53 0.56 1.45 3.75 0.00 -1.16 0.39 103.07 108.59 1xz7 h GLY 107 Ca 0.14 0.13 -0.18 0.00 0.00 0.00 0.00 47.33 47.42 1xz7 h GLY 107 CO -0.02 -0.21 -0.64 3.43 0.00 0.00 0.00 176.54 179.11 1xz7 h ASN 108 N 0.07 0.65 -0.34 0.19 2.35 -1.09 -2.09 115.58 115.31 1xz7 h ASN 108 Ca 0.30 -0.38 0.01 0.00 -0.55 0.00 0.00 56.30 55.68 1xz7 h ASN 108 Cb 0.48 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.65 1xz7 h ASN 108 CO -0.55 1.12 0.21 0.58 -1.65 0.00 0.00 177.43 177.14 1xz7 h VAL 109 N 0.41 1.06 -0.81 2.81 2.07 -0.67 -1.32 116.25 119.80 1xz7 h VAL 109 Ca -0.01 -0.15 0.15 0.00 0.82 0.00 0.00 66.70 67.51 1xz7 h VAL 109 Cb 1.21 0.59 -0.10 0.00 -1.52 0.00 0.00 31.29 31.47 1xz7 h VAL 109 CO 0.12 0.08 0.37 0.25 0.02 0.00 0.00 177.57 178.41 1xz7 h LEU 110 N 0.43 0.40 -0.76 2.57 5.85 0.01 -0.39 115.31 123.42 1xz7 h LEU 110 Ca 0.13 0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.87 1xz7 h LEU 110 Cb -0.03 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 1xz7 h LEU 110 CO -0.04 0.15 0.06 0.58 -0.34 0.00 0.00 178.44 178.85 1xz7 h VAL 111 N 0.52 1.26 -0.59 1.05 2.07 -0.87 -1.23 116.25 118.47 1xz7 h VAL 111 Ca 0.44 -1.04 -0.06 0.00 0.82 0.00 0.00 66.70 66.86 1xz7 h VAL 111 Cb 0.66 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 1xz7 h VAL 111 CO -0.39 0.38 0.10 0.00 0.02 0.00 0.00 177.57 177.69 1xz7 h VAL 113 N 0.89 1.29 -0.88 0.00 2.07 -0.59 -0.56 116.25 118.46 1xz7 h VAL 113 Ca 0.18 -1.14 0.08 0.00 0.82 0.00 0.00 66.70 66.64 1xz7 h VAL 113 Cb 0.37 1.48 -0.07 0.00 -1.52 0.00 0.00 31.29 31.55 1xz7 h VAL 113 CO 0.01 0.36 0.54 -0.07 0.02 0.00 0.00 177.57 178.42 1xz7 h LEU 114 N 0.28 0.82 -0.49 2.57 3.38 -1.12 -0.07 115.31 120.68 1xz7 h LEU 114 Ca 0.06 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 1xz7 h LEU 114 Cb 0.58 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1xz7 h LEU 114 CO 0.03 0.50 0.08 0.00 0.09 0.00 0.00 178.44 179.14 1xz7 h ALA 115 N 1.44 0.65 -0.89 1.53 0.00 -1.13 -0.70 119.26 120.16 1xz7 h ALA 115 Ca 0.40 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1xz7 h ALA 115 Cb 0.27 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 1xz7 h ALA 115 CO -0.21 0.38 0.58 1.25 0.00 0.00 0.00 179.25 181.26 1xz7 h HIS 116 N 0.69 1.10 0.21 0.00 -0.00 -0.05 -0.99 115.15 116.11 1xz7 h HIS 116 Ca 0.15 0.03 -0.32 0.00 -0.00 0.00 0.00 60.37 60.23 1xz7 h HIS 116 Cb 0.39 -0.37 0.04 0.00 -0.00 0.00 0.00 27.41 27.46 1xz7 h HIS 116 CO 0.03 0.66 -1.38 0.45 -0.00 0.00 0.00 177.93 177.69 1xz7 h HIS 117 N 1.16 0.98 -0.01 5.26 -0.00 -0.81 -3.37 115.15 118.37 1xz7 h HIS 117 Ca 0.34 -0.69 0.00 0.00 -0.00 0.00 0.00 60.37 60.03 1xz7 h HIS 117 Cb -0.06 -0.05 0.00 0.00 -0.00 0.00 0.00 27.41 27.29 1xz7 h HIS 117 CO -0.01 1.53 -0.71 1.19 -0.00 0.00 0.00 177.93 179.93 1xz7 n PHE 118 N -3.77 0.00 0.00 2.45 3.72 -0.29 -5.01 117.46 114.56 1xz7 n PHE 118 Ca -0.16 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.24 1xz7 n PHE 118 Cb 1.06 -0.04 0.00 0.00 -0.94 0.00 0.00 39.48 39.56 1xz7 n PHE 118 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xz7 n GLY 119 N 1.46 2.14 0.38 1.37 0.00 -0.38 -1.21 105.19 108.94 1xz7 n GLY 119 Ca 0.07 0.43 0.15 0.00 0.00 0.00 0.00 46.02 46.66 1xz7 n GLY 119 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xz7 h LYS 120 N 0.00 0.55 0.00 1.61 1.79 -1.95 -0.92 116.57 117.65 1xz7 h LYS 120 Ca 0.00 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1xz7 h LYS 120 Cb 0.00 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 30.53 1xz7 h LYS 120 CO 0.00 0.36 0.00 1.49 -1.08 0.00 0.00 179.45 180.22 1xz7 h GLU 121 N 0.56 0.00 -2.72 3.15 4.81 -1.57 -3.29 114.58 115.52 1xz7 h GLU 121 Ca 0.45 0.00 -0.75 0.00 -0.13 0.00 0.00 59.36 58.93 1xz7 h GLU 121 Cb 0.88 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 30.12 1xz7 h GLU 121 CO -0.19 0.00 2.22 0.34 -0.73 0.00 0.00 179.01 180.65 1xz7 n PHE 122 N -2.82 2.65 -0.69 0.92 7.35 -0.35 -4.93 117.46 119.59 1xz7 n PHE 122 Ca 0.01 -2.79 -0.30 0.00 -0.76 0.00 0.00 57.45 53.61 1xz7 n PHE 122 Cb 0.29 -1.79 0.19 0.00 0.35 0.00 0.00 39.48 38.52 1xz7 n PHE 122 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1xz7 s THR 123 N -1.22 2.11 0.21 -2.13 -4.23 -1.24 -4.65 115.64 104.48 1xz7 s THR 123 Ca 0.50 0.04 -0.10 0.00 -1.18 0.00 0.00 61.69 60.95 1xz7 s THR 123 Cb 0.17 -2.09 0.14 0.00 1.34 0.00 0.00 72.50 72.06 1xz7 s THR 123 CO -0.08 -0.05 1.73 -0.65 -0.54 0.00 0.00 174.62 175.03 1xz7 h PRO 124 N -2.04 0.33 -0.63 3.99 0.11 -1.94 0.63 132.00 132.45 1xz7 h PRO 124 Ca -0.48 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 1xz7 h PRO 124 Cb 1.28 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 1xz7 h PRO 124 CO 0.44 0.22 0.23 -1.35 -0.21 0.00 0.00 178.00 177.33 1xz7 h PRO 125 N 0.34 0.93 -0.65 1.05 0.11 -2.00 -1.08 132.00 130.71 1xz7 h PRO 125 Ca 0.30 -0.16 -0.07 0.00 0.11 0.00 0.00 66.00 66.17 1xz7 h PRO 125 Cb 0.40 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.33 1xz7 h PRO 125 CO -0.34 0.78 0.12 0.28 -0.21 0.00 0.00 178.00 178.63 1xz7 h VAL 126 N 0.91 1.26 -0.05 3.15 2.07 -1.66 -2.70 116.25 119.23 1xz7 h VAL 126 Ca 0.21 -1.01 0.01 0.00 0.82 0.00 0.00 66.70 66.73 1xz7 h VAL 126 Cb 0.21 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1xz7 h VAL 126 CO -0.01 0.38 -0.01 -0.61 0.02 0.00 0.00 177.57 177.33 1xz7 h GLN 127 N 0.99 0.00 -0.69 1.57 4.15 -0.51 -2.07 115.11 118.55 1xz7 h GLN 127 Ca 0.20 -0.00 0.11 0.00 0.77 0.00 0.00 58.65 59.73 1xz7 h GLN 127 Cb 0.42 -0.00 -0.08 0.00 0.21 0.00 0.00 27.48 28.03 1xz7 h GLN 127 CO 0.01 0.00 0.29 0.00 -1.93 0.00 0.00 178.83 177.20 1xz7 h ALA 128 N 1.05 0.94 -0.32 3.38 0.00 -1.06 0.20 119.26 123.45 1xz7 h ALA 128 Ca 0.03 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1xz7 h ALA 128 Cb 0.04 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1xz7 h ALA 128 CO -0.05 -0.16 0.20 0.00 0.00 0.00 0.00 179.25 179.24 1xz7 h ALA 129 N 1.47 0.40 -0.22 0.00 0.00 -1.18 -2.31 119.26 117.43 1xz7 h ALA 129 Ca 0.36 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.18 1xz7 h ALA 129 Cb 0.47 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1xz7 h ALA 129 CO -0.33 -0.14 -0.15 1.88 0.00 0.00 0.00 179.25 180.50 1xz7 h TYR 130 N 0.42 0.40 -0.73 0.00 0.05 -0.39 -1.79 116.97 114.93 1xz7 h TYR 130 Ca 0.12 -0.06 -0.04 0.00 0.05 0.00 0.00 58.73 58.80 1xz7 h TYR 130 Cb -0.04 -0.11 -0.03 0.00 1.01 0.00 0.00 36.73 37.56 1xz7 h TYR 130 CO -0.06 0.52 0.28 1.96 -1.05 0.00 0.00 178.16 179.81 1xz7 h GLN 131 N 0.34 1.08 -0.53 4.88 1.08 -0.28 0.97 115.11 122.66 1xz7 h GLN 131 Ca 0.06 -0.19 -0.06 0.00 -1.45 0.00 0.00 58.65 57.01 1xz7 h GLN 131 Cb 0.48 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.71 1xz7 h GLN 131 CO 0.03 0.88 0.10 0.87 -0.95 0.00 0.00 178.83 179.76 1xz7 h LYS 132 N 1.06 0.86 -0.13 1.46 1.57 -0.85 -1.77 116.57 118.76 1xz7 h LYS 132 Ca 0.24 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1xz7 h LYS 132 Cb 0.21 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1xz7 h LYS 132 CO -0.02 0.83 0.07 0.28 -0.57 0.00 0.00 179.45 180.04 1xz7 h VAL 133 N 0.75 1.11 -0.65 0.50 2.07 -0.78 -0.93 116.25 118.32 1xz7 h VAL 133 Ca 0.16 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.33 1xz7 h VAL 133 Cb 0.38 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 1xz7 h VAL 133 CO 0.01 0.10 0.27 0.58 0.02 0.00 0.00 177.57 178.55 1xz7 h VAL 134 N 0.10 1.22 -0.32 2.57 2.07 -0.75 -0.28 116.25 120.86 1xz7 h VAL 134 Ca 0.05 -0.68 -0.15 0.00 0.82 0.00 0.00 66.70 66.74 1xz7 h VAL 134 Cb 0.10 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1xz7 h VAL 134 CO -0.01 0.27 -0.40 0.00 0.02 0.00 0.00 177.57 177.46 1xz7 h ALA 135 N 1.37 0.69 -0.65 1.67 0.00 -1.19 -1.52 119.26 119.63 1xz7 h ALA 135 Ca 0.22 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 1xz7 h ALA 135 Cb 0.16 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1xz7 h ALA 135 CO -0.02 0.67 0.13 0.78 0.00 0.00 0.00 179.25 180.81 1xz7 h GLY 136 N 0.90 1.15 0.93 0.00 0.00 -0.47 -0.52 103.07 105.06 1xz7 h GLY 136 Ca 0.05 -0.74 -0.04 0.00 0.00 0.00 0.00 47.33 46.61 1xz7 h GLY 136 CO 0.09 0.69 0.10 -2.08 0.00 0.00 0.00 176.54 175.34 1xz7 h VAL 137 N 0.98 1.22 -0.09 4.60 2.07 -1.02 -0.83 116.25 123.19 1xz7 h VAL 137 Ca 0.20 -0.75 0.03 0.00 0.82 0.00 0.00 66.70 67.00 1xz7 h VAL 137 Cb 0.40 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 1xz7 h VAL 137 CO 0.01 0.26 -0.10 0.00 0.02 0.00 0.00 177.57 177.76 1xz7 h ALA 138 N 0.95 -0.03 -0.44 1.67 0.00 -1.05 -0.34 119.26 120.01 1xz7 h ALA 138 Ca 0.12 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1xz7 h ALA 138 Cb 0.29 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1xz7 h ALA 138 CO -0.00 -0.56 0.17 -0.91 0.00 0.00 0.00 179.25 177.95 1xz7 h ASN 139 N -0.12 0.57 -0.40 0.00 -0.26 -0.94 -1.91 115.58 112.51 1xz7 h ASN 139 Ca 0.07 -0.06 -0.12 0.00 -0.56 0.00 0.00 56.30 55.62 1xz7 h ASN 139 Cb 0.22 -0.15 -0.01 0.00 -1.06 0.00 0.00 38.32 37.32 1xz7 h ASN 139 CO -0.16 0.53 -0.23 0.00 -1.06 0.00 0.00 177.43 176.51 1xz7 h ALA 140 N 1.56 0.57 0.00 -0.83 0.00 -0.65 -2.37 119.26 117.54 1xz7 h ALA 140 Ca 0.15 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1xz7 h ALA 140 Cb 0.14 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1xz7 h ALA 140 CO -0.01 0.56 -0.03 -0.07 0.00 0.00 0.00 179.25 179.69 1xz7 h LEU 141 N 0.68 0.00 -0.23 0.00 3.38 -0.70 -2.65 115.31 115.79 1xz7 h LEU 141 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1xz7 h LEU 141 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1xz7 h LEU 141 CO 0.07 0.03 -0.45 0.00 0.09 0.00 0.00 178.44 178.18 1xz7 n ALA 142 N -2.12 3.47 -0.11 1.53 0.00 -0.75 -4.40 120.51 118.13 1xz7 n ALA 142 Ca 0.00 -0.40 -0.04 0.00 0.00 0.00 0.00 53.44 53.00 1xz7 n ALA 142 Cb 0.30 -1.08 0.17 0.00 0.00 0.00 0.00 19.45 18.84 1xz7 n ALA 142 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1xz7 h HIS 143 N 0.57 0.83 -0.50 0.00 6.17 -1.05 -2.66 115.15 118.51 1xz7 h HIS 143 Ca 0.00 -0.11 0.00 0.00 0.71 0.00 0.00 60.37 60.97 1xz7 h HIS 143 Cb 0.51 -0.23 0.00 0.00 2.52 0.00 0.00 27.41 30.21 1xz7 h HIS 143 CO 0.00 0.76 0.00 1.63 0.71 0.00 0.00 177.93 181.03 1xz7 n LYS 144 N -4.23 2.44 -2.20 5.26 4.76 -1.26 -4.93 118.16 117.99 1xz7 n LYS 144 Ca 0.03 -1.91 -0.38 0.00 -2.87 0.00 0.00 58.31 53.18 1xz7 n LYS 144 Cb 0.28 -1.50 -0.01 0.00 -1.84 0.00 0.00 35.03 31.96 1xz7 n LYS 144 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1xz7 s TYR 145 N -1.46 2.87 0.00 2.13 1.51 -1.01 -4.72 117.35 116.68 1xz7 s TYR 145 Ca 0.35 1.51 0.00 0.00 -1.01 0.00 0.00 57.07 57.92 1xz7 s TYR 145 Cb 0.20 -3.45 0.00 0.00 -0.11 0.00 0.00 41.96 38.59 1xz7 s TYR 145 CO 0.21 -1.64 0.00 -2.39 -1.11 0.00 0.00 175.55 170.62