#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yxr s THR 2 N 0.00 3.87 0.20 2.03 2.01 -1.26 -5.09 115.64 117.40 1yxr s THR 2 Ca 0.00 -0.36 -0.30 0.00 0.31 0.00 0.00 61.69 61.35 1yxr s THR 2 Cb 0.00 -2.71 -0.08 0.00 0.01 0.00 0.00 72.50 69.72 1yxr s THR 2 CO 0.00 0.47 1.08 -0.89 -0.69 0.00 0.00 174.62 174.59 1yxr s THR 3 N 0.59 3.84 0.48 -0.82 2.01 -1.26 -5.05 115.64 115.43 1yxr s THR 3 Ca -0.02 1.66 0.06 0.00 0.31 0.00 0.00 61.69 63.70 1yxr s THR 3 Cb -0.14 -4.06 0.03 0.00 0.01 0.00 0.00 72.50 68.33 1yxr s THR 3 CO 0.02 0.32 0.66 -0.44 -0.69 0.00 0.00 174.62 174.49 1yxr s SER 4 N -0.37 5.46 0.16 3.53 0.01 -1.26 -5.02 113.70 116.20 1yxr s SER 4 Ca 0.47 -0.36 0.02 0.00 1.31 0.00 0.00 55.95 57.39 1yxr s SER 4 Cb -0.29 -0.59 -0.02 0.00 0.21 0.00 0.00 66.02 65.33 1yxr s SER 4 CO 0.36 -0.96 1.37 0.74 0.41 0.00 0.00 173.24 175.15 1yxr h THR 5 N 0.40 1.49 -0.05 1.44 2.02 -1.96 -2.84 112.91 113.40 1yxr h THR 5 Ca -0.39 -2.62 -0.10 0.00 0.77 0.00 0.00 66.41 64.06 1yxr h THR 5 Cb 1.28 2.47 0.01 0.00 -1.74 0.00 0.00 68.15 70.17 1yxr h THR 5 CO 0.46 0.77 -0.37 -0.07 0.37 0.00 0.00 175.52 176.67 1yxr h LEU 6 N 0.11 0.42 -1.68 2.58 -0.00 -1.96 -2.94 115.31 111.85 1yxr h LEU 6 Ca -0.05 -0.68 -0.03 0.00 -0.00 0.00 0.00 57.88 57.13 1yxr h LEU 6 Cb 1.52 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 42.05 1yxr h LEU 6 CO 0.14 1.04 -0.08 -0.61 -0.00 0.00 0.00 178.44 178.93 1yxr h GLN 7 N -0.16 0.10 -0.33 1.13 5.75 -1.97 -2.42 115.11 117.21 1yxr h GLN 7 Ca -0.03 -0.02 -0.13 0.00 -0.15 0.00 0.00 58.65 58.32 1yxr h GLN 7 Cb 1.04 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.57 1yxr h GLN 7 CO 0.08 0.19 -0.30 0.87 -2.65 0.00 0.00 178.83 177.02 1yxr h LYS 8 N 0.10 0.78 -0.28 1.69 1.57 -1.50 -2.79 116.57 116.14 1yxr h LYS 8 Ca 0.02 -0.40 -0.05 0.00 -1.87 0.00 0.00 60.65 58.35 1yxr h LYS 8 Cb 0.21 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 1yxr h LYS 8 CO 0.01 1.03 -0.06 0.00 -0.57 0.00 0.00 179.45 179.86 1yxr h ALA 9 N 0.74 1.38 0.00 3.86 0.00 -1.26 -2.16 119.26 121.82 1yxr h ALA 9 Ca 0.06 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 1yxr h ALA 9 Cb 0.88 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1yxr h ALA 9 CO 0.08 0.43 -0.49 0.82 0.00 0.00 0.00 179.25 180.08 1yxr h ILE 10 N 0.42 1.30 0.00 0.00 2.04 -1.36 -2.42 117.51 117.49 1yxr h ILE 10 Ca 0.09 -1.71 -0.20 0.00 1.00 0.00 0.00 64.86 64.04 1yxr h ILE 10 Cb 0.38 1.93 -0.03 0.00 -0.74 0.00 0.00 36.82 38.36 1yxr h ILE 10 CO 0.02 0.48 -0.93 0.44 0.00 0.00 0.00 178.15 178.16 1yxr h ASP 11 N 0.00 0.02 -0.08 1.72 3.32 -1.15 -2.99 116.42 117.26 1yxr h ASP 11 Ca -0.00 -0.02 -0.12 0.00 0.02 0.00 0.00 57.03 56.91 1yxr h ASP 11 Cb 0.89 -0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.44 1yxr h ASP 11 CO 0.06 0.93 -0.41 -0.07 -1.72 0.00 0.00 179.24 178.03 1yxr h LEU 12 N 0.00 0.50 -1.56 1.55 -0.00 -1.24 -2.73 115.31 111.83 1yxr h LEU 12 Ca -0.01 -0.65 -0.05 0.00 -0.00 0.00 0.00 57.88 57.17 1yxr h LEU 12 Cb 1.64 -0.15 -0.01 0.00 -0.00 0.00 0.00 40.66 42.14 1yxr h LEU 12 CO 0.12 1.07 -0.23 -0.37 -0.00 0.00 0.00 178.44 179.03 1yxr h VAL 13 N -0.04 1.07 -0.09 1.22 -1.51 -1.53 -2.06 116.25 113.30 1yxr h VAL 13 Ca -0.03 -0.83 -0.21 0.00 -1.23 0.00 0.00 66.70 64.41 1yxr h VAL 13 Cb 1.06 1.46 0.00 0.00 -2.13 0.00 0.00 31.29 31.69 1yxr h VAL 13 CO 0.09 0.23 -0.78 0.74 -1.23 0.00 0.00 177.57 176.61 1yxr h THR 14 N 0.00 1.34 0.00 7.19 2.02 -1.51 -2.38 112.91 119.57 1yxr h THR 14 Ca -0.00 -2.12 -0.11 0.00 0.77 0.00 0.00 66.41 64.95 1yxr h THR 14 Cb 0.44 2.11 -0.02 0.00 -1.74 0.00 0.00 68.15 68.94 1yxr h THR 14 CO 0.03 0.65 -0.53 0.50 0.37 0.00 0.00 175.52 176.54 1yxr h LYS 15 N 0.37 0.00 0.00 6.66 3.64 -1.15 -2.80 116.57 123.29 1yxr h LYS 15 Ca -0.05 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.27 1yxr h LYS 15 Cb 1.39 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.21 1yxr h LYS 15 CO 0.15 0.53 -0.25 0.00 -2.27 0.00 0.00 179.45 177.60 1yxr h ALA 16 N 1.47 0.03 -0.19 5.00 0.00 -1.35 -2.67 119.26 121.55 1yxr h ALA 16 Ca -0.01 -0.47 0.01 0.00 0.00 0.00 0.00 54.91 54.44 1yxr h ALA 16 Cb 1.06 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1yxr h ALA 16 CO 0.07 0.09 0.08 0.00 0.00 0.00 0.00 179.25 179.49 1yxr h THR 17 N -0.52 0.98 0.00 0.00 1.03 -1.47 -1.37 112.91 111.57 1yxr h THR 17 Ca -0.03 -0.06 -0.04 0.00 -0.01 0.00 0.00 66.41 66.26 1yxr h THR 17 Cb 1.02 0.78 -0.01 0.00 -1.07 0.00 0.00 68.15 68.88 1yxr h THR 17 CO 0.05 0.03 -0.20 1.05 -0.01 0.00 0.00 175.52 176.44 1yxr h GLU 18 N 0.18 0.00 -0.23 0.00 -0.00 -1.61 -2.78 114.58 110.14 1yxr h GLU 18 Ca 0.08 0.00 -0.08 0.00 -0.00 0.00 0.00 59.36 59.35 1yxr h GLU 18 Cb 0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 28.77 1yxr h GLU 18 CO -0.06 0.20 -0.18 0.93 -0.00 0.00 0.00 179.01 179.90 1yxr h GLU 19 N 0.00 0.53 -0.74 1.06 4.39 -1.01 -3.01 114.58 115.81 1yxr h GLU 19 Ca -0.00 -0.26 0.16 0.00 0.34 0.00 0.00 59.36 59.60 1yxr h GLU 19 Cb 0.36 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.97 1yxr h GLU 19 CO 0.03 0.84 0.50 0.22 -1.16 0.00 0.00 179.01 179.44 1yxr h ASP 20 N 0.24 0.30 1.08 1.42 3.58 -0.99 0.30 116.42 122.36 1yxr h ASP 20 Ca 0.04 0.02 -0.09 0.00 0.42 0.00 0.00 57.03 57.42 1yxr h ASP 20 Cb 0.72 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.72 1yxr h ASP 20 CO 0.05 0.15 -0.42 0.11 -2.88 0.00 0.00 179.24 176.25 1yxr h LYS 21 N 0.32 0.00 -0.90 0.28 1.57 -1.49 -3.09 116.57 113.26 1yxr h LYS 21 Ca 0.37 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.84 1yxr h LYS 21 Cb 0.97 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 33.10 1yxr h LYS 21 CO -0.10 0.42 0.39 0.00 -0.57 0.00 0.00 179.45 179.58 1yxr n ALA 22 N -2.26 4.66 -3.62 3.86 0.00 0.93 -4.89 120.51 119.19 1yxr n ALA 22 Ca 0.01 -2.16 -0.22 0.00 0.00 0.00 0.00 53.44 51.07 1yxr n ALA 22 Cb 0.59 -1.29 0.06 0.00 0.00 0.00 0.00 19.45 18.81 1yxr n ALA 22 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1yxr n LYS 23 N -0.46 -6.26 -2.34 0.00 4.76 -1.10 -4.92 118.16 107.85 1yxr n LYS 23 Ca 0.42 0.74 -0.24 0.00 -2.87 0.00 0.00 58.31 56.36 1yxr n LYS 23 Cb 1.35 -5.61 0.01 0.00 -1.84 0.00 0.00 35.03 28.94 1yxr n LYS 23 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1yxr n ASN 24 N -3.04 4.51 -0.29 4.39 4.13 -0.44 -4.85 115.26 119.67 1yxr n ASN 24 Ca -0.18 -3.62 0.08 0.00 1.68 0.00 0.00 54.58 52.54 1yxr n ASN 24 Cb 0.63 -0.42 0.23 0.00 -1.54 0.00 0.00 39.78 38.68 1yxr n ASN 24 CO 0.00 0.00 0.00 1.88 0.28 0.00 0.00 177.26 179.42 1yxr h TYR 25 N 2.46 0.71 -0.70 3.10 -1.99 -1.85 0.40 116.97 119.10 1yxr h TYR 25 Ca 0.29 0.04 -0.01 0.00 2.00 0.00 0.00 58.73 61.05 1yxr h TYR 25 Cb 1.16 -0.19 -0.03 0.00 2.00 0.00 0.00 36.73 39.67 1yxr h TYR 25 CO 0.80 0.12 0.41 1.05 -0.00 0.00 0.00 178.16 180.55 1yxr h GLU 26 N 0.56 0.96 -0.21 4.88 -0.00 -1.88 -1.46 114.58 117.42 1yxr h GLU 26 Ca 0.47 -0.09 -0.14 0.00 -0.00 0.00 0.00 59.36 59.60 1yxr h GLU 26 Cb 0.72 -0.20 0.00 0.00 -0.00 0.00 0.00 28.75 29.28 1yxr h GLU 26 CO -0.40 0.69 -0.42 1.49 -0.00 0.00 0.00 179.01 180.37 1yxr h GLU 27 N 0.95 0.66 -0.28 1.06 4.57 -1.45 -3.10 114.58 117.00 1yxr h GLU 27 Ca 0.25 -0.42 0.03 0.00 -1.18 0.00 0.00 59.36 58.04 1yxr h GLU 27 Cb -0.01 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 1yxr h GLU 27 CO -0.05 1.04 0.19 0.00 -1.18 0.00 0.00 179.01 179.02 1yxr h ALA 28 N 0.61 1.94 0.33 2.92 0.00 -0.06 -0.81 119.26 124.20 1yxr h ALA 28 Ca 0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1yxr h ALA 28 Cb 1.02 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1yxr h ALA 28 CO 0.09 0.02 -0.16 1.25 0.00 0.00 0.00 179.25 180.45 1yxr h LEU 29 N 0.26 -0.38 -0.96 0.00 5.85 -1.19 0.39 115.31 119.28 1yxr h LEU 29 Ca 0.12 -0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.71 1yxr h LEU 29 Cb 0.14 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1yxr h LEU 29 CO -0.02 -0.21 -0.21 0.03 -0.34 0.00 0.00 178.44 177.69 1yxr h ARG 30 N -0.52 0.51 -0.18 1.25 -0.00 -1.49 -0.26 114.38 113.68 1yxr h ARG 30 Ca -0.05 -0.18 -0.15 0.00 -0.50 0.00 0.00 59.98 59.10 1yxr h ARG 30 Cb 0.39 -0.04 -0.01 0.00 0.00 0.00 0.00 29.97 30.31 1yxr h ARG 30 CO 0.07 0.69 -0.52 -0.07 0.00 0.00 0.00 179.97 180.14 1yxr h LEU 31 N 0.45 0.57 0.00 3.04 -0.00 -0.98 -1.41 115.31 116.98 1yxr h LEU 31 Ca 0.07 -0.29 -0.27 0.00 -0.00 0.00 0.00 57.88 57.39 1yxr h LEU 31 Cb 0.62 -0.16 0.02 0.00 -0.00 0.00 0.00 40.66 41.14 1yxr h LEU 31 CO 0.04 0.99 -1.06 1.88 -0.00 0.00 0.00 178.44 180.29 1yxr h TYR 32 N 0.40 1.05 -0.30 1.13 0.05 0.02 -2.90 116.97 116.41 1yxr h TYR 32 Ca 0.01 -0.57 -0.12 0.00 0.05 0.00 0.00 58.73 58.10 1yxr h TYR 32 Cb 1.05 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 38.66 1yxr h TYR 32 CO 0.04 1.41 -0.31 1.96 -1.05 0.00 0.00 178.16 180.22 1yxr h GLN 33 N 0.39 0.64 -0.30 4.88 4.20 -1.05 -2.89 115.11 120.98 1yxr h GLN 33 Ca -0.13 -0.28 -0.04 0.00 0.06 0.00 0.00 58.65 58.26 1yxr h GLN 33 Cb 1.71 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 29.47 1yxr h GLN 33 CO 0.21 0.87 0.04 0.45 -0.67 0.00 0.00 178.83 179.73 1yxr h HIS 34 N 0.54 0.53 -0.81 2.96 3.86 -1.30 -2.79 115.15 118.15 1yxr h HIS 34 Ca 0.06 -0.08 0.04 0.00 -1.16 0.00 0.00 60.37 59.24 1yxr h HIS 34 Cb 0.80 -0.14 -0.05 0.00 1.06 0.00 0.00 27.41 29.08 1yxr h HIS 34 CO 0.03 0.59 0.53 0.00 0.86 0.00 0.00 177.93 179.95 1yxr h ALA 35 N 0.87 1.53 -0.08 2.45 0.00 -1.46 -1.21 119.26 121.37 1yxr h ALA 35 Ca 0.09 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1yxr h ALA 35 Cb 0.35 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1yxr h ALA 35 CO 0.01 0.39 -0.26 0.28 0.00 0.00 0.00 179.25 179.67 1yxr h VAL 36 N 0.98 1.22 -0.20 0.00 2.07 -1.33 -2.16 116.25 116.83 1yxr h VAL 36 Ca 0.33 -1.03 -0.14 0.00 0.82 0.00 0.00 66.70 66.68 1yxr h VAL 36 Cb 0.07 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 1yxr h VAL 36 CO -0.10 0.31 -0.46 -0.33 0.02 0.00 0.00 177.57 177.01 1yxr h GLU 37 N 0.12 0.51 -0.20 1.57 4.39 -0.96 -2.47 114.58 117.53 1yxr h GLU 37 Ca 0.02 -0.28 -0.21 0.00 0.34 0.00 0.00 59.36 59.23 1yxr h GLU 37 Cb 0.53 0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.20 1yxr h GLU 37 CO 0.04 0.86 -0.70 1.88 -1.16 0.00 0.00 179.01 179.93 1yxr h TYR 38 N 0.41 1.06 0.01 4.33 0.05 -1.13 -2.63 116.97 119.08 1yxr h TYR 38 Ca 0.03 -0.44 -0.00 0.00 0.05 0.00 0.00 58.73 58.37 1yxr h TYR 38 Cb 0.96 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 38.52 1yxr h TYR 38 CO 0.04 1.27 -0.00 0.74 -1.05 0.00 0.00 178.16 179.15 1yxr h PHE 39 N 0.58 -0.01 -0.59 4.88 0.04 -1.36 -1.67 116.94 118.81 1yxr h PHE 39 Ca -0.03 -0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.76 1yxr h PHE 39 Cb 1.32 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.43 1yxr h PHE 39 CO 0.08 0.13 0.37 -0.07 -0.60 0.00 0.00 178.31 178.22 1yxr h LEU 40 N -0.16 0.60 -1.69 1.54 3.38 -1.51 -1.56 115.31 115.91 1yxr h LEU 40 Ca -0.00 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1yxr h LEU 40 Cb 0.15 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1yxr h LEU 40 CO 0.00 0.42 -0.09 -0.74 0.09 0.00 0.00 178.44 178.12 1yxr h HIS 41 N 0.72 0.08 -0.00 1.13 2.76 -1.35 -1.72 115.15 116.77 1yxr h HIS 41 Ca 0.23 -0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 58.26 1yxr h HIS 41 Cb 0.00 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 28.92 1yxr h HIS 41 CO -0.05 0.18 -0.64 0.00 -1.30 0.00 0.00 177.93 176.11 1yxr h ALA 42 N 1.83 0.93 0.02 5.26 0.00 -0.33 -2.29 119.26 124.68 1yxr h ALA 42 Ca 0.02 -0.58 -0.00 0.00 0.00 0.00 0.00 54.91 54.34 1yxr h ALA 42 Cb 0.22 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1yxr h ALA 42 CO 0.01 0.80 -0.01 0.82 0.00 0.00 0.00 179.25 180.87 1yxr h ILE 43 N 0.01 1.42 0.27 0.00 2.04 -0.72 -0.34 117.51 120.20 1yxr h ILE 43 Ca -0.01 -1.80 -0.01 0.00 1.00 0.00 0.00 64.86 64.04 1yxr h ILE 43 Cb 1.14 2.57 -0.00 0.00 -0.74 0.00 0.00 36.82 39.78 1yxr h ILE 43 CO 0.08 0.44 -0.17 0.50 0.00 0.00 0.00 178.15 179.00 1yxr h LYS 44 N -0.87 -0.41 0.29 2.37 3.64 -1.42 -2.64 116.57 117.52 1yxr h LYS 44 Ca -0.00 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1yxr h LYS 44 Cb 0.74 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 1yxr h LYS 44 CO 0.01 -0.28 -0.14 1.88 -2.27 0.00 0.00 179.45 178.65 1yxr h TYR 45 N -0.43 -0.36 -3.38 1.91 -1.99 -1.56 -3.38 116.97 107.78 1yxr h TYR 45 Ca -0.03 -0.01 -0.78 0.00 2.00 0.00 0.00 58.73 59.91 1yxr h TYR 45 Cb 0.36 0.12 -0.26 0.00 2.00 0.00 0.00 36.73 38.95 1yxr h TYR 45 CO -0.09 -0.22 0.51 -1.21 -0.00 0.00 0.00 178.16 177.14 1yxr s GLU 46 N -3.01 4.02 -0.28 4.88 0.41 -0.14 -5.02 118.70 119.57 1yxr s GLU 46 Ca -0.06 -2.89 -0.28 0.00 -0.41 0.00 0.00 54.97 51.34 1yxr s GLU 46 Cb 0.01 -4.61 0.01 0.00 -1.78 0.00 0.00 34.13 27.75 1yxr s GLU 46 CO 0.17 -1.35 1.01 0.00 -0.49 0.00 0.00 175.26 174.60 1yxr s ALA 47 N -0.35 3.58 0.00 5.21 0.00 -0.99 -4.16 121.76 125.04 1yxr s ALA 47 Ca 0.29 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.24 1yxr s ALA 47 Cb -0.09 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.47 1yxr s ALA 47 CO -0.07 -1.26 0.00 0.72 0.00 0.00 0.00 175.76 175.15 1yxr n HIS 48 N 6.54 -2.33 -0.64 0.00 8.25 -1.26 -5.09 115.22 120.68 1yxr n HIS 48 Ca 0.11 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.28 1yxr n HIS 48 Cb 0.47 0.00 0.25 0.00 1.12 0.00 0.00 29.99 31.83 1yxr n HIS 48 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1yxr s SER 49 N -1.00 0.80 0.36 0.41 0.01 -1.26 -4.53 113.70 108.48 1yxr s SER 49 Ca 0.00 1.28 0.04 0.00 1.31 0.00 0.00 55.95 58.57 1yxr s SER 49 Cb 0.00 -1.96 0.68 0.00 0.21 0.00 0.00 66.02 64.95 1yxr s SER 49 CO 0.00 -4.28 2.00 0.44 0.41 0.00 0.00 173.24 171.81 1yxr h ASP 50 N -2.68 0.70 -0.30 2.44 5.19 -1.99 0.16 116.42 119.94 1yxr h ASP 50 Ca -0.58 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 55.82 1yxr h ASP 50 Cb 1.34 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 40.67 1yxr h ASP 50 CO 0.48 0.49 0.19 0.50 -3.12 0.00 0.00 179.24 177.78 1yxr h LYS 51 N 0.81 0.40 -0.08 3.56 3.64 -1.98 0.24 116.57 123.16 1yxr h LYS 51 Ca 0.26 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 59.45 1yxr h LYS 51 Cb 0.02 -0.09 0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1yxr h LYS 51 CO -0.07 0.28 -0.55 0.00 -2.27 0.00 0.00 179.45 176.85 1yxr h ALA 52 N 1.09 0.18 -0.67 5.00 0.00 -1.77 -1.66 119.26 121.43 1yxr h ALA 52 Ca 0.11 -0.53 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 1yxr h ALA 52 Cb -0.02 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1yxr h ALA 52 CO -0.02 0.40 0.41 -0.22 0.00 0.00 0.00 179.25 179.81 1yxr h LYS 53 N 0.10 0.91 -0.28 0.00 3.64 -0.61 -1.18 116.57 119.15 1yxr h LYS 53 Ca -0.05 -0.08 -0.17 0.00 -1.27 0.00 0.00 60.65 59.08 1yxr h LYS 53 Cb 1.21 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 1yxr h LYS 53 CO 0.11 0.64 -0.50 0.93 -2.27 0.00 0.00 179.45 178.36 1yxr h GLU 54 N 0.91 0.83 -0.56 1.90 5.08 -0.57 -1.41 114.58 120.77 1yxr h GLU 54 Ca 0.24 -0.52 0.01 0.00 -1.00 0.00 0.00 59.36 58.09 1yxr h GLU 54 Cb -0.04 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1yxr h GLU 54 CO -0.05 1.15 0.37 0.77 -1.00 0.00 0.00 179.01 180.26 1yxr h SER 55 N 0.61 0.64 -0.20 1.42 0.02 -1.04 -0.08 113.55 114.92 1yxr h SER 55 Ca 0.02 -0.02 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 1yxr h SER 55 Cb 1.10 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.48 1yxr h SER 55 CO 0.11 0.46 -0.36 0.40 -1.14 0.00 0.00 176.83 176.31 1yxr h ILE 56 N 0.75 1.33 -0.81 3.27 2.04 -1.22 -2.60 117.51 120.27 1yxr h ILE 56 Ca 0.20 -1.58 0.02 0.00 1.00 0.00 0.00 64.86 64.50 1yxr h ILE 56 Cb -0.09 1.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.79 1yxr h ILE 56 CO -0.04 0.49 0.53 -0.09 0.00 0.00 0.00 178.15 179.04 1yxr h ARG 57 N 0.28 1.03 0.00 2.37 9.65 -1.05 -1.30 114.38 125.35 1yxr h ARG 57 Ca 0.01 -0.06 -0.09 0.00 -1.10 0.00 0.00 59.98 58.74 1yxr h ARG 57 Cb 0.95 -0.23 -0.01 0.00 -1.39 0.00 0.00 29.97 29.29 1yxr h ARG 57 CO 0.08 0.68 -0.41 0.00 2.80 0.00 0.00 179.97 183.12 1yxr h ALA 58 N 1.31 1.32 -0.07 2.80 0.00 -1.01 -2.86 119.26 120.75 1yxr h ALA 58 Ca 0.31 -0.37 -0.19 0.00 0.00 0.00 0.00 54.91 54.66 1yxr h ALA 58 Cb -0.07 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1yxr h ALA 58 CO -0.08 0.51 -0.76 0.87 0.00 0.00 0.00 179.25 179.79 1yxr h LYS 59 N 0.00 0.39 -0.62 0.00 1.57 -0.93 -3.06 116.57 113.92 1yxr h LYS 59 Ca -0.00 -0.34 -0.09 0.00 -1.87 0.00 0.00 60.65 58.35 1yxr h LYS 59 Cb 0.73 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.09 1yxr h LYS 59 CO 0.05 0.98 0.04 0.00 -0.57 0.00 0.00 179.45 179.95 1yxr h VAL 61 N 0.98 1.23 -0.20 0.00 2.07 -1.53 0.65 116.25 119.46 1yxr h VAL 61 Ca 0.18 -0.89 -0.20 0.00 0.82 0.00 0.00 66.70 66.61 1yxr h VAL 61 Cb 0.52 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1yxr h VAL 61 CO 0.03 0.32 -0.66 -0.61 0.02 0.00 0.00 177.57 176.67 1yxr h GLN 62 N 0.78 0.77 -0.25 1.57 4.15 -1.41 -2.77 115.11 117.95 1yxr h GLN 62 Ca 0.16 -0.56 -0.15 0.00 0.77 0.00 0.00 58.65 58.88 1yxr h GLN 62 Cb 0.35 0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.14 1yxr h GLN 62 CO 0.01 1.18 -0.43 1.88 -1.93 0.00 0.00 178.83 179.53 1yxr h TYR 63 N 0.56 0.92 -0.99 3.99 0.05 -1.07 -2.61 116.97 117.82 1yxr h TYR 63 Ca -0.02 -0.32 0.01 0.00 0.05 0.00 0.00 58.73 58.45 1yxr h TYR 63 Cb 1.27 -0.18 -0.05 0.00 1.01 0.00 0.00 36.73 38.79 1yxr h TYR 63 CO 0.07 1.11 0.65 1.25 -1.05 0.00 0.00 178.16 180.19 1yxr h LEU 64 N 0.47 1.15 -0.76 3.88 7.12 -0.91 -1.59 115.31 124.67 1yxr h LEU 64 Ca 0.02 -0.04 -0.12 0.00 0.13 0.00 0.00 57.88 57.87 1yxr h LEU 64 Cb 1.03 -0.29 -0.01 0.00 -0.53 0.00 0.00 40.66 40.86 1yxr h LEU 64 CO 0.10 0.84 -0.41 -0.78 -0.13 0.00 0.00 178.44 178.06 1yxr h ASP 65 N 1.35 0.47 -0.13 1.25 1.82 -1.47 -2.84 116.42 116.87 1yxr h ASP 65 Ca 0.36 -0.21 -0.02 0.00 -0.39 0.00 0.00 57.03 56.77 1yxr h ASP 65 Cb -0.14 -0.13 -0.00 0.00 0.68 0.00 0.00 39.33 39.73 1yxr h ASP 65 CO -0.08 0.83 -0.00 0.03 -1.61 0.00 0.00 179.24 178.42 1yxr h ARG 66 N 0.37 0.23 -0.01 0.28 2.47 -1.00 -2.87 114.38 113.86 1yxr h ARG 66 Ca 0.03 -0.08 -0.00 0.00 -1.26 0.00 0.00 59.98 58.67 1yxr h ARG 66 Cb 0.88 -0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 29.18 1yxr h ARG 66 CO 0.07 0.47 -0.01 0.00 0.56 0.00 0.00 179.97 181.07 1yxr h ALA 67 N 0.75 1.98 -0.42 0.04 0.00 -1.29 -2.16 119.26 118.15 1yxr h ALA 67 Ca 0.04 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1yxr h ALA 67 Cb 0.37 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1yxr h ALA 67 CO 0.01 0.02 0.09 1.49 0.00 0.00 0.00 179.25 180.86 1yxr h GLU 68 N 0.01 0.68 0.00 0.00 4.57 -1.28 -2.57 114.58 115.98 1yxr h GLU 68 Ca 0.00 -0.17 -0.10 0.00 -1.18 0.00 0.00 59.36 57.92 1yxr h GLU 68 Cb 0.02 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.51 1yxr h GLU 68 CO 0.00 0.70 -0.47 -0.22 -1.18 0.00 0.00 179.01 177.84 1yxr h LYS 69 N 0.54 0.00 -0.57 1.92 3.64 -1.27 -2.75 116.57 118.09 1yxr h LYS 69 Ca 0.13 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.43 1yxr h LYS 69 Cb 0.33 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 1yxr h LYS 69 CO 0.00 0.47 0.06 -0.07 -2.27 0.00 0.00 179.45 177.64 1yxr h LEU 70 N 0.00 0.93 -0.29 5.20 3.38 -1.17 -0.63 115.31 122.73 1yxr h LEU 70 Ca -0.00 -0.28 -0.09 0.00 0.09 0.00 0.00 57.88 57.59 1yxr h LEU 70 Cb 0.84 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1yxr h LEU 70 CO 0.06 0.98 -0.18 0.50 0.09 0.00 0.00 178.44 179.89 1yxr h LYS 71 N 0.85 0.64 0.00 1.13 3.64 -1.34 -2.62 116.57 118.87 1yxr h LYS 71 Ca 0.17 -0.30 -0.08 0.00 -1.27 0.00 0.00 60.65 59.18 1yxr h LYS 71 Cb 0.47 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1yxr h LYS 71 CO 0.02 0.89 -0.36 0.22 -2.27 0.00 0.00 179.45 177.94 1yxr h ASP 72 N 0.39 0.00 0.02 4.20 3.58 -1.42 -0.84 116.42 122.35 1yxr h ASP 72 Ca 0.06 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.51 1yxr h ASP 72 Cb 0.71 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.76 1yxr h ASP 72 CO 0.05 0.36 -0.01 0.22 -2.88 0.00 0.00 179.24 176.98 1yxr h TYR 73 N 0.00 -0.02 0.00 0.28 5.03 -0.98 -1.32 116.97 119.96 1yxr h TYR 73 Ca -0.00 -0.00 -0.12 0.00 2.58 0.00 0.00 58.73 61.18 1yxr h TYR 73 Cb 0.67 0.01 -0.02 0.00 1.55 0.00 0.00 36.73 38.94 1yxr h TYR 73 CO 0.00 0.41 -0.59 1.37 -1.32 0.00 0.00 178.16 178.02 1yxr h LEU 74 N -0.45 0.00 0.26 2.82 8.10 -1.41 -2.46 115.31 122.17 1yxr h LEU 74 Ca -0.00 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.97 1yxr h LEU 74 Cb 0.44 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.66 1yxr h LEU 74 CO 0.00 0.59 -0.13 0.03 -4.11 0.00 0.00 178.44 174.83 1yxr h ARG 75 N 0.00 -0.34 0.67 0.17 3.08 -1.15 -3.33 114.38 113.48 1yxr h ARG 75 Ca -0.01 0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 1yxr h ARG 75 Cb 1.05 0.08 -0.00 0.00 0.08 0.00 0.00 29.97 31.18 1yxr h ARG 75 CO 0.08 0.01 -0.42 1.03 -1.07 0.00 0.00 179.97 179.61 1yxr h SER 76 N -0.82 -1.05 0.00 7.04 0.87 -1.29 -3.51 113.55 114.79 1yxr h SER 76 Ca -0.04 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1yxr h SER 76 Cb 0.51 0.31 0.00 0.00 -0.44 0.00 0.00 62.40 62.78 1yxr h SER 76 CO 0.06 -0.64 0.00 1.17 -0.53 0.00 0.00 176.83 176.89