#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 3.57 -0.40 1.12 -4.23 -1.26 -5.10 115.64 109.34 1yxr s THR 2 Ca 0.00 -1.17 -0.05 0.00 -1.18 0.00 0.00 61.69 59.30 1yxr s THR 2 Cb 0.00 -2.68 0.10 0.00 1.34 0.00 0.00 72.50 71.26 1yxr s THR 2 CO 0.00 0.13 0.21 0.42 -0.54 0.00 0.00 174.62 174.83 1yxr s THR 3 N -1.23 3.54 0.53 3.99 -4.23 -1.26 -5.05 115.64 111.93 1yxr s THR 3 Ca 0.22 -1.81 -0.05 0.00 -1.18 0.00 0.00 61.69 58.87 1yxr s THR 3 Cb -0.11 -3.32 0.12 0.00 1.34 0.00 0.00 72.50 70.53 1yxr s THR 3 CO 0.15 -0.59 0.73 -0.24 -0.54 0.00 0.00 174.62 174.12 1yxr n SER 4 N 4.70 0.43 -0.05 3.99 2.88 -1.26 -4.90 113.62 119.40 1yxr n SER 4 Ca -0.06 -1.49 -0.16 0.00 -1.33 0.00 0.00 58.87 55.83 1yxr n SER 4 Cb 0.42 -0.52 -0.06 0.00 -0.75 0.00 0.00 64.21 63.29 1yxr n SER 4 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1yxr h THR 5 N -1.02 1.30 -0.28 2.46 2.02 -1.98 -2.27 112.91 113.13 1yxr h THR 5 Ca -0.24 -1.78 -0.09 0.00 0.77 0.00 0.00 66.41 65.08 1yxr h THR 5 Cb 0.75 1.86 -0.01 0.00 -1.74 0.00 0.00 68.15 69.01 1yxr h THR 5 CO 0.20 0.56 -0.17 -0.07 0.37 0.00 0.00 175.52 176.42 1yxr h LEU 6 N 0.47 0.63 -1.50 2.58 -0.00 -1.95 -2.60 115.31 112.95 1yxr h LEU 6 Ca -0.01 -0.42 -0.04 0.00 -0.00 0.00 0.00 57.88 57.40 1yxr h LEU 6 Cb 1.18 -0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 41.66 1yxr h LEU 6 CO 0.12 0.92 -0.13 -0.61 -0.00 0.00 0.00 178.44 178.74 1yxr h GLN 7 N 0.35 0.16 -0.13 1.13 -0.00 -1.94 -2.24 115.11 112.44 1yxr h GLN 7 Ca 0.06 -0.03 -0.15 0.00 -0.00 0.00 0.00 58.65 58.53 1yxr h GLN 7 Cb 0.70 -0.02 -0.01 0.00 0.00 0.00 0.00 27.48 28.14 1yxr h GLN 7 CO 0.05 0.30 -0.56 0.87 0.00 0.00 0.00 178.83 179.49 1yxr h LYS 8 N 0.16 0.38 -0.15 1.69 1.57 -1.26 -2.58 116.57 116.38 1yxr h LYS 8 Ca 0.03 -0.24 -0.15 0.00 -1.87 0.00 0.00 60.65 58.42 1yxr h LYS 8 Cb 0.33 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1yxr h LYS 8 CO 0.02 0.84 -0.55 0.00 -0.57 0.00 0.00 179.45 179.19 1yxr h ALA 9 N 1.11 0.77 -0.02 3.86 0.00 -1.02 -2.84 119.26 121.13 1yxr h ALA 9 Ca 0.00 -0.51 -0.13 0.00 0.00 0.00 0.00 54.91 54.27 1yxr h ALA 9 Cb 1.07 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1yxr h ALA 9 CO 0.09 0.69 -0.60 0.82 0.00 0.00 0.00 179.25 180.25 1yxr h ILE 10 N 0.35 1.42 -0.04 0.00 2.04 -1.36 -2.86 117.51 117.07 1yxr h ILE 10 Ca 0.01 -2.05 -0.14 0.00 1.00 0.00 0.00 64.86 63.68 1yxr h ILE 10 Cb 1.07 2.09 -0.01 0.00 -0.74 0.00 0.00 36.82 39.23 1yxr h ILE 10 CO 0.10 0.59 -0.61 0.44 0.00 0.00 0.00 178.15 178.67 1yxr h ASP 11 N 0.04 0.15 0.61 1.72 5.19 -1.35 -2.68 116.42 120.09 1yxr h ASP 11 Ca -0.01 -0.08 -0.16 0.00 -0.62 0.00 0.00 57.03 56.16 1yxr h ASP 11 Cb 1.08 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 40.53 1yxr h ASP 11 CO 0.08 0.72 -0.72 -0.07 -3.12 0.00 0.00 179.24 176.13 1yxr h LEU 12 N 0.09 0.11 -0.49 1.55 -0.00 -1.38 -2.74 115.31 112.45 1yxr h LEU 12 Ca -0.01 -0.08 -0.16 0.00 -0.00 0.00 0.00 57.88 57.64 1yxr h LEU 12 Cb 1.09 -0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 41.70 1yxr h LEU 12 CO 0.09 0.79 -0.75 0.58 -0.00 0.00 0.00 178.44 179.14 1yxr h VAL 13 N 0.06 1.53 -0.10 1.22 2.07 -1.39 -2.10 116.25 117.54 1yxr h VAL 13 Ca -0.01 -2.56 -0.22 0.00 0.82 0.00 0.00 66.70 64.73 1yxr h VAL 13 Cb 1.27 2.38 0.01 0.00 -1.52 0.00 0.00 31.29 33.44 1yxr h VAL 13 CO 0.10 0.73 -0.78 0.74 0.02 0.00 0.00 177.57 178.38 1yxr h THR 14 N 0.01 1.30 -0.01 2.57 2.02 -1.42 -2.24 112.91 115.14 1yxr h THR 14 Ca -0.01 -2.02 -0.14 0.00 0.77 0.00 0.00 66.41 65.01 1yxr h THR 14 Cb 1.33 2.15 -0.02 0.00 -1.74 0.00 0.00 68.15 69.87 1yxr h THR 14 CO 0.10 0.63 -0.66 0.11 0.37 0.00 0.00 175.52 176.07 1yxr h LYS 15 N 0.40 0.05 -0.02 6.66 6.56 -1.52 -2.70 116.57 126.00 1yxr h LYS 15 Ca -0.07 -0.04 -0.02 0.00 -1.06 0.00 0.00 60.65 59.47 1yxr h LYS 15 Cb 1.43 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 33.10 1yxr h LYS 15 CO 0.16 0.69 -0.05 0.00 -2.06 0.00 0.00 179.45 178.19 1yxr h ALA 16 N 1.30 0.04 -0.25 3.86 0.00 -1.39 -1.74 119.26 121.08 1yxr h ALA 16 Ca -0.01 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.60 1yxr h ALA 16 Cb 1.17 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1yxr h ALA 16 CO 0.09 -0.13 0.14 0.00 0.00 0.00 0.00 179.25 179.35 1yxr h THR 17 N -0.48 1.02 -0.78 0.00 1.03 -1.45 -1.08 112.91 111.18 1yxr h THR 17 Ca 0.00 -0.10 -0.04 0.00 -0.01 0.00 0.00 66.41 66.26 1yxr h THR 17 Cb 0.64 0.71 -0.04 0.00 -1.07 0.00 0.00 68.15 68.39 1yxr h THR 17 CO 0.01 0.05 0.34 1.05 -0.01 0.00 0.00 175.52 176.97 1yxr h GLU 18 N 0.29 1.15 -0.55 0.00 4.11 -1.56 -2.82 114.58 115.21 1yxr h GLU 18 Ca 0.10 -0.19 -0.01 0.00 0.07 0.00 0.00 59.36 59.32 1yxr h GLU 18 Cb -0.00 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.03 1yxr h GLU 18 CO -0.05 0.92 0.30 0.93 0.07 0.00 0.00 179.01 181.18 1yxr h GLU 19 N 1.12 0.77 -0.60 1.06 5.08 -0.94 -2.12 114.58 118.96 1yxr h GLU 19 Ca 0.27 -0.09 0.17 0.00 -1.00 0.00 0.00 59.36 58.70 1yxr h GLU 19 Cb 0.17 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1yxr h GLU 19 CO -0.03 0.59 0.43 0.22 -1.00 0.00 0.00 179.01 179.22 1yxr h ASP 20 N 0.74 0.04 1.07 1.42 3.58 -0.95 0.32 116.42 122.65 1yxr h ASP 20 Ca 0.19 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.56 1yxr h ASP 20 Cb 0.05 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.08 1yxr h ASP 20 CO -0.03 0.02 -0.43 0.11 -2.88 0.00 0.00 179.24 176.03 1yxr h LYS 21 N 0.04 0.00 -0.94 0.28 6.56 -1.32 -3.09 116.57 118.10 1yxr h LYS 21 Ca 0.29 0.00 -0.37 0.00 -1.06 0.00 0.00 60.65 59.51 1yxr h LYS 21 Cb 1.08 0.00 -0.22 0.00 -0.57 0.00 0.00 32.23 32.53 1yxr h LYS 21 CO -0.02 0.43 0.47 0.00 -2.06 0.00 0.00 179.45 178.27 1yxr n ALA 22 N -2.27 4.89 -3.38 3.86 0.00 0.11 -4.90 120.51 118.82 1yxr n ALA 22 Ca 0.01 -2.31 -0.18 0.00 0.00 0.00 0.00 53.44 50.96 1yxr n ALA 22 Cb 0.59 -1.34 0.07 0.00 0.00 0.00 0.00 19.45 18.78 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 -0.66 -3.65 -2.38 0.00 4.76 -1.15 -4.95 118.16 110.13 1yxr n LYS 23 Ca 0.46 0.80 -0.22 0.00 -2.87 0.00 0.00 58.31 56.49 1yxr n LYS 23 Cb 1.42 -5.63 0.01 0.00 -1.84 0.00 0.00 35.03 29.00 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 -3.13 4.15 -0.26 4.39 4.13 -0.90 -4.85 115.26 118.78 1yxr n ASN 24 Ca -0.16 -3.48 0.12 0.00 1.68 0.00 0.00 54.58 52.75 1yxr n ASN 24 Cb 0.64 -0.43 0.39 0.00 -1.54 0.00 0.00 39.78 38.84 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 2.50 0.79 -0.44 3.10 -1.99 -1.86 0.37 116.97 119.45 1yxr h TYR 25 Ca 0.24 0.02 -0.15 0.00 2.00 0.00 0.00 58.73 60.85 1yxr h TYR 25 Cb 1.18 -0.25 -0.01 0.00 2.00 0.00 0.00 36.73 39.65 1yxr h TYR 25 CO 0.77 0.29 -0.30 1.05 -0.00 0.00 0.00 178.16 179.96 1yxr h GLU 26 N 0.66 0.97 -0.17 4.88 -0.00 -1.90 -2.69 114.58 116.33 1yxr h GLU 26 Ca 0.44 -0.46 -0.21 0.00 -0.00 0.00 0.00 59.36 59.13 1yxr h GLU 26 Cb 0.74 -0.01 0.01 0.00 -0.00 0.00 0.00 28.75 29.49 1yxr h GLU 26 CO -0.20 1.13 -0.70 1.49 -0.00 0.00 0.00 179.01 180.73 1yxr h GLU 27 N 0.82 0.78 -0.62 1.06 4.57 -1.52 -3.17 114.58 116.49 1yxr h GLU 27 Ca 0.09 -0.61 0.04 0.00 -1.18 0.00 0.00 59.36 57.69 1yxr h GLU 27 Cb 0.89 0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 29.57 1yxr h GLU 27 CO 0.08 1.22 0.41 0.00 -1.18 0.00 0.00 179.01 179.54 1yxr h ALA 28 N 0.56 1.68 0.01 2.92 0.00 -0.31 0.17 119.26 124.29 1yxr h ALA 28 Ca -0.04 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1yxr h ALA 28 Cb 1.33 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1yxr h ALA 28 CO 0.15 0.25 -0.00 1.25 0.00 0.00 0.00 179.25 180.90 1yxr h LEU 29 N 0.72 -0.01 -0.71 0.00 5.85 -1.45 0.34 115.31 120.05 1yxr h LEU 29 Ca 0.25 -0.07 -0.14 0.00 0.84 0.00 0.00 57.88 58.76 1yxr h LEU 29 Cb 0.10 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1yxr h LEU 29 CO -0.07 0.07 -0.62 0.03 -0.34 0.00 0.00 178.44 177.50 1yxr h ARG 30 N -0.08 0.09 -0.08 1.25 2.47 -1.48 -1.99 114.38 114.56 1yxr h ARG 30 Ca -0.00 -0.07 -0.04 0.00 -1.26 0.00 0.00 59.98 58.61 1yxr h ARG 30 Cb 0.08 0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.41 1yxr h ARG 30 CO 0.00 0.68 -0.13 -0.07 0.56 0.00 0.00 179.97 181.02 1yxr h LEU 31 N 0.07 0.24 -0.54 3.04 -0.00 -0.45 -2.83 115.31 114.84 1yxr h LEU 31 Ca -0.01 -0.54 -0.08 0.00 -0.00 0.00 0.00 57.88 57.25 1yxr h LEU 31 Cb 1.11 -0.07 -0.02 0.00 -0.00 0.00 0.00 40.66 41.68 1yxr h LEU 31 CO 0.09 0.74 0.03 1.88 -0.00 0.00 0.00 178.44 181.18 1yxr h TYR 32 N -0.24 1.01 -0.15 1.13 0.05 -0.35 -2.65 116.97 115.77 1yxr h TYR 32 Ca 0.01 -0.16 0.02 0.00 0.05 0.00 0.00 58.73 58.64 1yxr h TYR 32 Cb 0.69 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 1yxr h TYR 32 CO 0.11 0.92 0.10 1.96 -1.05 0.00 0.00 178.16 180.19 1yxr h GLN 33 N 0.81 0.13 -0.04 4.88 4.20 -1.41 -2.22 115.11 121.46 1yxr h GLN 33 Ca 0.16 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.83 1yxr h GLN 33 Cb 0.49 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.24 1yxr h GLN 33 CO 0.02 0.08 -0.11 0.45 -0.67 0.00 0.00 178.83 178.61 1yxr h HIS 34 N 0.13 0.18 -0.14 2.96 3.86 -1.22 -2.85 115.15 118.08 1yxr h HIS 34 Ca 0.06 -0.07 0.04 0.00 -1.16 0.00 0.00 60.37 59.24 1yxr h HIS 34 Cb 0.08 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.51 1yxr h HIS 34 CO -0.00 0.71 0.10 0.00 0.86 0.00 0.00 177.93 179.60 1yxr h ALA 35 N 0.43 2.12 -0.04 2.45 0.00 -1.16 -1.13 119.26 121.93 1yxr h ALA 35 Ca -0.00 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 1yxr h ALA 35 Cb 0.71 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1yxr h ALA 35 CO 0.02 -0.17 -0.77 0.28 0.00 0.00 0.00 179.25 178.61 1yxr h VAL 36 N 0.00 1.42 -0.17 0.00 2.07 -1.38 -2.91 116.25 115.27 1yxr h VAL 36 Ca 0.07 -2.28 -0.13 0.00 0.82 0.00 0.00 66.70 65.17 1yxr h VAL 36 Cb 0.27 2.23 -0.01 0.00 -1.52 0.00 0.00 31.29 32.25 1yxr h VAL 36 CO -0.00 0.68 -0.46 -0.33 0.02 0.00 0.00 177.57 177.47 1yxr h GLU 37 N 0.20 0.44 -0.14 1.57 4.39 -0.98 -2.61 114.58 117.46 1yxr h GLU 37 Ca -0.04 -0.24 -0.14 0.00 0.34 0.00 0.00 59.36 59.29 1yxr h GLU 37 Cb 1.36 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 30.01 1yxr h GLU 37 CO 0.13 0.81 -0.51 1.88 -1.16 0.00 0.00 179.01 180.16 1yxr h TYR 38 N 0.35 0.47 -0.24 4.33 0.05 -1.41 -2.69 116.97 117.84 1yxr h TYR 38 Ca 0.02 -0.16 -0.09 0.00 0.05 0.00 0.00 58.73 58.55 1yxr h TYR 38 Cb 0.95 -0.09 -0.00 0.00 1.01 0.00 0.00 36.73 38.59 1yxr h TYR 38 CO 0.03 0.82 -0.20 0.74 -1.05 0.00 0.00 178.16 178.49 1yxr h PHE 39 N 0.30 0.67 -0.63 4.88 0.04 -1.39 -1.53 116.94 119.28 1yxr h PHE 39 Ca 0.01 -0.19 -0.01 0.00 2.80 0.00 0.00 57.97 60.58 1yxr h PHE 39 Cb 1.00 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.98 1yxr h PHE 39 CO 0.03 0.88 0.36 -0.07 -0.60 0.00 0.00 178.31 178.90 1yxr h LEU 40 N 0.28 0.78 -0.96 1.54 3.38 -1.45 -1.86 115.31 117.02 1yxr h LEU 40 Ca 0.04 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.82 1yxr h LEU 40 Cb 0.75 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1yxr h LEU 40 CO 0.05 0.64 -0.49 -0.74 0.09 0.00 0.00 178.44 177.99 1yxr h HIS 41 N 0.86 0.09 -0.29 1.13 2.76 -1.47 -2.52 115.15 115.70 1yxr h HIS 41 Ca 0.22 -0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.31 1yxr h HIS 41 Cb 0.02 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 28.95 1yxr h HIS 41 CO -0.01 0.55 -0.06 0.00 -1.30 0.00 0.00 177.93 177.11 1yxr h ALA 42 N 1.45 0.40 -0.11 5.26 0.00 -0.76 -1.43 119.26 124.06 1yxr h ALA 42 Ca -0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1yxr h ALA 42 Cb 0.89 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1yxr h ALA 42 CO 0.07 0.21 -0.01 0.82 0.00 0.00 0.00 179.25 180.34 1yxr h ILE 43 N 0.32 1.26 -0.04 0.00 2.04 -1.30 0.84 117.51 120.63 1yxr h ILE 43 Ca 0.08 -0.86 0.01 0.00 1.00 0.00 0.00 64.86 65.09 1yxr h ILE 43 Cb 0.53 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 1yxr h ILE 43 CO 0.03 0.25 -0.03 0.50 0.00 0.00 0.00 178.15 178.89 1yxr h LYS 44 N -0.09 -0.03 0.06 2.37 3.64 -1.48 -3.08 116.57 117.96 1yxr h LYS 44 Ca 0.03 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1yxr h LYS 44 Cb 0.38 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1yxr h LYS 44 CO 0.01 -0.02 -0.03 1.88 -2.27 0.00 0.00 179.45 179.02 1yxr h TYR 45 N -0.03 -0.07 -3.59 1.91 -1.99 -1.28 -3.41 116.97 108.50 1yxr h TYR 45 Ca 0.03 -0.00 -0.77 0.00 2.00 0.00 0.00 58.73 59.98 1yxr h TYR 45 Cb 0.07 0.02 -0.25 0.00 2.00 0.00 0.00 36.73 38.58 1yxr h TYR 45 CO -0.12 -0.04 0.14 -1.21 -0.00 0.00 0.00 178.16 176.92 1yxr s GLU 46 N -1.66 3.53 0.21 4.88 2.02 0.29 -5.05 118.70 122.92 1yxr s GLU 46 Ca -0.01 -2.29 -0.11 0.00 0.02 0.00 0.00 54.97 52.57 1yxr s GLU 46 Cb 0.00 -4.46 -0.07 0.00 0.10 0.00 0.00 34.13 29.70 1yxr s GLU 46 CO 0.03 -1.35 0.55 0.00 0.02 0.00 0.00 175.26 174.52 1yxr s ALA 47 N 0.61 3.56 0.00 5.21 0.00 -1.16 -3.94 121.76 126.04 1yxr s ALA 47 Ca 0.18 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 51.92 1yxr s ALA 47 Cb -0.12 -2.47 0.00 0.00 0.00 0.00 0.00 23.12 20.53 1yxr s ALA 47 CO -0.07 0.49 0.00 0.72 0.00 0.00 0.00 175.76 176.89 1yxr n HIS 48 N 0.15 0.00 -0.68 0.00 8.25 -1.26 -5.11 115.22 116.57 1yxr n HIS 48 Ca -0.01 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.16 1yxr n HIS 48 Cb 0.52 0.00 0.23 0.00 1.12 0.00 0.00 29.99 31.86 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 -0.63 1.47 0.45 0.41 0.01 -1.26 -4.57 113.70 109.58 1yxr s SER 49 Ca 0.00 1.53 0.12 0.00 1.31 0.00 0.00 55.95 58.91 1yxr s SER 49 Cb 0.00 -2.26 1.03 0.00 0.21 0.00 0.00 66.02 65.01 1yxr s SER 49 CO 0.00 -3.90 2.06 -0.78 0.41 0.00 0.00 173.24 171.03 1yxr h ASP 50 N -2.41 0.31 -0.02 2.44 3.58 -2.01 0.25 116.42 118.55 1yxr h ASP 50 Ca -0.58 -0.00 -0.00 0.00 0.42 0.00 0.00 57.03 56.86 1yxr h ASP 50 Cb 1.33 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 42.30 1yxr h ASP 50 CO 0.51 0.21 0.00 0.50 -2.88 0.00 0.00 179.24 177.58 1yxr h LYS 51 N 0.36 0.03 -0.01 0.28 3.64 -1.99 0.63 116.57 119.51 1yxr h LYS 51 Ca 0.16 -0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.38 1yxr h LYS 51 Cb 0.18 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 1yxr h LYS 51 CO -0.04 0.26 -0.69 0.00 -2.27 0.00 0.00 179.45 176.71 1yxr h ALA 52 N 0.77 0.82 -0.11 5.00 0.00 -1.78 -2.79 119.26 121.18 1yxr h ALA 52 Ca 0.01 -0.62 -0.16 0.00 0.00 0.00 0.00 54.91 54.14 1yxr h ALA 52 Cb 0.24 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1yxr h ALA 52 CO 0.00 0.84 -0.62 -0.22 0.00 0.00 0.00 179.25 179.25 1yxr h LYS 53 N 0.05 0.39 -0.24 0.00 3.64 -0.45 -2.89 116.57 117.08 1yxr h LYS 53 Ca -0.01 -0.28 -0.15 0.00 -1.27 0.00 0.00 60.65 58.94 1yxr h LYS 53 Cb 1.23 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 1yxr h LYS 53 CO 0.10 0.89 -0.45 0.93 -2.27 0.00 0.00 179.45 178.64 1yxr h GLU 54 N 0.29 0.73 -0.53 1.90 5.08 -0.82 -0.98 114.58 120.26 1yxr h GLU 54 Ca -0.01 -0.47 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1yxr h GLU 54 Cb 1.16 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.44 1yxr h GLU 54 CO 0.11 1.09 0.33 0.77 -1.00 0.00 0.00 179.01 180.31 1yxr h SER 55 N 0.46 0.62 -0.11 1.42 0.02 -1.50 0.11 113.55 114.57 1yxr h SER 55 Ca 0.01 -0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 60.86 1yxr h SER 55 Cb 1.06 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.44 1yxr h SER 55 CO 0.10 0.48 -0.19 0.40 -1.14 0.00 0.00 176.83 176.48 1yxr h ILE 56 N 0.71 1.38 -0.32 3.27 2.04 -1.53 -1.82 117.51 121.25 1yxr h ILE 56 Ca 0.19 -1.45 0.02 0.00 1.00 0.00 0.00 64.86 64.62 1yxr h ILE 56 Cb -0.04 2.08 -0.02 0.00 -0.74 0.00 0.00 36.82 38.09 1yxr h ILE 56 CO -0.04 0.42 0.17 -0.09 0.00 0.00 0.00 178.15 178.61 1yxr h ARG 57 N -0.12 0.34 -0.00 2.37 9.65 -1.05 -1.03 114.38 124.54 1yxr h ARG 57 Ca 0.01 -0.02 -0.08 0.00 -1.10 0.00 0.00 59.98 58.79 1yxr h ARG 57 Cb 0.76 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 29.25 1yxr h ARG 57 CO 0.04 0.22 -0.36 0.00 2.80 0.00 0.00 179.97 182.67 1yxr h ALA 58 N 1.16 1.40 -0.16 2.80 0.00 -0.84 -2.77 119.26 120.85 1yxr h ALA 58 Ca 0.13 -0.33 -0.15 0.00 0.00 0.00 0.00 54.91 54.56 1yxr h ALA 58 Cb 0.03 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1yxr h ALA 58 CO -0.08 0.45 -0.55 0.87 0.00 0.00 0.00 179.25 179.94 1yxr h LYS 59 N 0.00 0.48 -0.37 0.00 1.57 -0.64 -3.03 116.57 114.58 1yxr h LYS 59 Ca -0.00 -0.30 -0.08 0.00 -1.87 0.00 0.00 60.65 58.40 1yxr h LYS 59 Cb 0.64 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 1yxr h LYS 59 CO 0.05 0.90 -0.09 0.00 -0.57 0.00 0.00 179.45 179.75 1yxr h VAL 61 N 0.58 1.21 0.00 0.00 2.07 -1.44 -1.52 116.25 117.14 1yxr h VAL 61 Ca 0.11 -0.61 -0.10 0.00 0.82 0.00 0.00 66.70 66.91 1yxr h VAL 61 Cb 0.49 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1yxr h VAL 61 CO 0.03 0.16 -0.49 -0.61 0.02 0.00 0.00 177.57 176.68 1yxr h GLN 62 N -0.26 0.00 -0.24 1.57 4.15 -1.46 -2.73 115.11 116.14 1yxr h GLN 62 Ca -0.00 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.28 1yxr h GLN 62 Cb 0.26 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 1yxr h GLN 62 CO 0.00 0.49 -0.42 1.88 -1.93 0.00 0.00 178.83 178.85 1yxr h TYR 63 N 0.00 0.68 0.00 3.99 0.05 -0.92 -2.98 116.97 117.80 1yxr h TYR 63 Ca -0.00 -0.20 -0.14 0.00 0.05 0.00 0.00 58.73 58.44 1yxr h TYR 63 Cb 0.86 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 38.43 1yxr h TYR 63 CO 0.00 0.89 -0.66 -0.07 -1.05 0.00 0.00 178.16 177.27 1yxr h LEU 64 N 0.47 0.00 -1.10 3.88 3.38 -1.11 -2.98 115.31 117.84 1yxr h LEU 64 Ca 0.04 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1yxr h LEU 64 Cb 0.92 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 1yxr h LEU 64 CO 0.08 0.66 -0.17 0.44 0.09 0.00 0.00 178.44 179.54 1yxr h ASP 65 N 0.00 0.42 0.67 -0.43 5.19 -1.34 -2.76 116.42 118.16 1yxr h ASP 65 Ca -0.01 -0.11 -0.19 0.00 -0.62 0.00 0.00 57.03 56.09 1yxr h ASP 65 Cb 1.18 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 40.56 1yxr h ASP 65 CO 0.09 0.61 -0.88 -0.09 -3.12 0.00 0.00 179.24 175.84 1yxr h ARG 66 N 0.39 0.14 -0.76 3.56 9.65 -1.46 -3.07 114.38 122.84 1yxr h ARG 66 Ca 0.07 -0.16 0.00 0.00 -1.10 0.00 0.00 59.98 58.79 1yxr h ARG 66 Cb 0.53 0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 29.12 1yxr h ARG 66 CO 0.03 0.93 0.48 0.00 2.80 0.00 0.00 179.97 184.22 1yxr h ALA 67 N 1.01 1.42 -0.05 2.80 0.00 -1.34 -0.81 119.26 122.30 1yxr h ALA 67 Ca -0.04 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1yxr h ALA 67 Cb 1.53 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1yxr h ALA 67 CO 0.13 0.52 -0.24 0.93 0.00 0.00 0.00 179.25 180.59 1yxr h GLU 68 N 1.03 0.25 0.00 0.00 3.07 -1.56 -2.78 114.58 114.60 1yxr h GLU 68 Ca 0.28 -0.20 -0.01 0.00 -0.50 0.00 0.00 59.36 58.92 1yxr h GLU 68 Cb -0.09 0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 27.86 1yxr h GLU 68 CO -0.06 0.85 -0.05 -0.22 -1.40 0.00 0.00 179.01 178.14 1yxr h LYS 69 N -0.30 0.00 -0.00 2.33 3.64 -1.41 -0.32 116.57 120.52 1yxr h LYS 69 Ca -0.02 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1yxr h LYS 69 Cb 0.90 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 1yxr h LYS 69 CO 0.05 0.05 -0.00 -0.07 -2.27 0.00 0.00 179.45 177.20 1yxr h LEU 70 N 0.00 0.00 -1.27 5.20 3.38 -1.14 -2.45 115.31 119.03 1yxr h LEU 70 Ca -0.00 -0.65 -0.07 0.00 0.09 0.00 0.00 57.88 57.25 1yxr h LEU 70 Cb 0.08 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1yxr h LEU 70 CO 0.01 0.65 -0.27 0.07 0.09 0.00 0.00 178.44 178.99 1yxr h LYS 71 N -0.65 0.15 0.00 1.13 2.10 -1.21 -2.48 116.57 115.62 1yxr h LYS 71 Ca -0.00 -0.05 -0.12 0.00 -2.00 0.00 0.00 60.65 58.48 1yxr h LYS 71 Cb 0.65 -0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 31.95 1yxr h LYS 71 CO 0.00 0.42 -0.58 -0.44 -2.00 0.00 0.00 179.45 176.85 1yxr h ASP 72 N 0.14 0.00 -0.06 7.07 5.19 -1.10 -1.29 116.42 126.37 1yxr h ASP 72 Ca 0.02 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.39 1yxr h ASP 72 Cb 0.55 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.06 1yxr h ASP 72 CO 0.04 0.58 -0.14 0.22 -3.12 0.00 0.00 179.24 176.81 1yxr h TYR 73 N 0.00 0.26 -0.25 4.55 5.03 -0.99 -2.15 116.97 123.42 1yxr h TYR 73 Ca -0.01 -0.10 -0.15 0.00 2.58 0.00 0.00 58.73 61.06 1yxr h TYR 73 Cb 1.08 -0.05 -0.00 0.00 1.55 0.00 0.00 36.73 39.31 1yxr h TYR 73 CO 0.00 0.74 -0.42 1.37 -1.32 0.00 0.00 178.16 178.53 1yxr h LEU 74 N -0.29 0.81 0.36 2.82 8.10 -1.52 -2.00 115.31 123.59 1yxr h LEU 74 Ca 0.00 -0.53 -0.02 0.00 0.11 0.00 0.00 57.88 57.45 1yxr h LEU 74 Cb 0.74 -0.23 0.00 0.00 -0.44 0.00 0.00 40.66 40.73 1yxr h LEU 74 CO 0.03 1.18 -0.17 0.03 -4.11 0.00 0.00 178.44 175.40 1yxr h ARG 75 N 0.47 -0.47 0.64 0.17 3.08 -1.32 -3.21 114.38 113.74 1yxr h ARG 75 Ca 0.02 0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1yxr h ARG 75 Cb 1.02 0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.18 1yxr h ARG 75 CO 0.10 -0.31 -0.34 1.03 -1.07 0.00 0.00 179.97 179.38 1yxr h SER 76 N -0.50 -0.83 0.00 7.04 0.87 -1.45 -3.51 113.55 115.18 1yxr h SER 76 Ca -0.05 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1yxr h SER 76 Cb 0.38 0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 1yxr h SER 76 CO 0.08 -0.56 0.00 1.17 -0.53 0.00 0.00 176.83 176.99