#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 0.09 -0.62 1.12 -4.23 -1.26 -5.11 115.64 105.63 1yxr s THR 2 Ca 0.00 -1.96 -0.26 0.00 -1.18 0.00 0.00 61.69 58.30 1yxr s THR 2 Cb 0.00 -2.26 0.04 0.00 1.34 0.00 0.00 72.50 71.62 1yxr s THR 2 CO 0.00 -0.25 1.09 -0.89 -0.54 0.00 0.00 174.62 174.03 1yxr s THR 3 N -4.08 4.12 0.88 3.99 2.01 -1.26 -5.02 115.64 116.28 1yxr s THR 3 Ca 0.31 0.37 -0.10 0.00 0.31 0.00 0.00 61.69 62.58 1yxr s THR 3 Cb 0.07 -4.70 0.19 0.00 0.01 0.00 0.00 72.50 68.07 1yxr s THR 3 CO 0.07 -1.41 1.19 -1.20 -0.69 0.00 0.00 174.62 172.58 1yxr n SER 4 N 8.22 0.56 0.15 3.53 7.64 -1.26 -4.90 113.62 127.56 1yxr n SER 4 Ca 0.03 -1.72 0.01 0.00 1.01 0.00 0.00 58.87 58.20 1yxr n SER 4 Cb 0.48 -0.87 0.33 0.00 -1.01 0.00 0.00 64.21 63.14 1yxr n SER 4 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1yxr h THR 5 N -1.33 1.26 -0.02 0.44 2.02 -1.95 -2.41 112.91 110.92 1yxr h THR 5 Ca -0.39 -1.26 -0.01 0.00 0.77 0.00 0.00 66.41 65.52 1yxr h THR 5 Cb 1.19 1.61 -0.00 0.00 -1.74 0.00 0.00 68.15 69.21 1yxr h THR 5 CO 0.32 0.37 -0.03 -0.07 0.37 0.00 0.00 175.52 176.47 1yxr h LEU 6 N 0.09 0.07 -1.65 2.58 -0.00 -1.93 -2.53 115.31 111.93 1yxr h LEU 6 Ca 0.01 -0.54 -0.00 0.00 -0.00 0.00 0.00 57.88 57.35 1yxr h LEU 6 Cb 0.65 -0.02 -0.02 0.00 -0.00 0.00 0.00 40.66 41.28 1yxr h LEU 6 CO 0.05 0.60 0.19 -0.61 -0.00 0.00 0.00 178.44 178.67 1yxr h GLN 7 N -0.46 0.42 -0.39 1.13 5.75 -1.92 -1.65 115.11 117.99 1yxr h GLN 7 Ca 0.00 -0.03 -0.15 0.00 -0.15 0.00 0.00 58.65 58.32 1yxr h GLN 7 Cb 0.58 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 29.03 1yxr h GLN 7 CO 0.01 0.30 -0.34 0.87 -2.65 0.00 0.00 178.83 177.01 1yxr h LYS 8 N 0.43 0.89 -0.32 1.69 1.57 -1.41 -1.75 116.57 117.67 1yxr h LYS 8 Ca 0.11 -0.44 -0.12 0.00 -1.87 0.00 0.00 60.65 58.33 1yxr h LYS 8 Cb -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1yxr h LYS 8 CO -0.02 1.09 -0.30 0.00 -0.57 0.00 0.00 179.45 179.64 1yxr h ALA 9 N 0.86 0.86 -0.03 3.86 0.00 -0.92 -0.61 119.26 123.28 1yxr h ALA 9 Ca 0.07 -0.40 -0.15 0.00 0.00 0.00 0.00 54.91 54.43 1yxr h ALA 9 Cb 0.92 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1yxr h ALA 9 CO 0.08 0.63 -0.65 0.82 0.00 0.00 0.00 179.25 180.14 1yxr h ILE 10 N 0.58 1.43 0.01 0.00 2.04 -1.25 -2.63 117.51 117.69 1yxr h ILE 10 Ca 0.07 -2.15 -0.22 0.00 1.00 0.00 0.00 64.86 63.56 1yxr h ILE 10 Cb 0.81 2.14 -0.03 0.00 -0.74 0.00 0.00 36.82 39.00 1yxr h ILE 10 CO 0.07 0.62 -1.03 0.44 0.00 0.00 0.00 178.15 178.26 1yxr h ASP 11 N 0.08 0.04 -0.17 1.72 5.19 -1.16 -3.10 116.42 119.02 1yxr h ASP 11 Ca -0.01 -0.04 -0.08 0.00 -0.62 0.00 0.00 57.03 56.28 1yxr h ASP 11 Cb 1.16 -0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.66 1yxr h ASP 11 CO 0.09 1.03 -0.21 -0.07 -3.12 0.00 0.00 179.24 176.97 1yxr h LEU 12 N 0.01 0.48 -1.57 1.55 -0.00 -1.05 -2.40 115.31 112.31 1yxr h LEU 12 Ca -0.02 -0.50 -0.05 0.00 -0.00 0.00 0.00 57.88 57.31 1yxr h LEU 12 Cb 1.79 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 42.31 1yxr h LEU 12 CO 0.14 0.88 -0.23 -0.37 -0.00 0.00 0.00 178.44 178.86 1yxr h VAL 13 N 0.08 1.05 -0.02 1.22 -1.51 -1.57 -2.25 116.25 113.25 1yxr h VAL 13 Ca 0.02 -0.81 -0.20 0.00 -1.23 0.00 0.00 66.70 64.49 1yxr h VAL 13 Cb 0.76 1.45 -0.01 0.00 -2.13 0.00 0.00 31.29 31.37 1yxr h VAL 13 CO 0.05 0.22 -0.84 0.74 -1.23 0.00 0.00 177.57 176.51 1yxr h THR 14 N 0.00 1.44 0.00 7.19 2.02 -1.46 -2.57 112.91 119.53 1yxr h THR 14 Ca -0.00 -2.44 -0.13 0.00 0.77 0.00 0.00 66.41 64.61 1yxr h THR 14 Cb 0.43 2.35 -0.02 0.00 -1.74 0.00 0.00 68.15 69.17 1yxr h THR 14 CO 0.03 0.72 -0.64 0.50 0.37 0.00 0.00 175.52 176.50 1yxr h LYS 15 N 0.17 0.00 -0.01 6.66 3.64 -0.98 -2.85 116.57 123.21 1yxr h LYS 15 Ca -0.05 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.25 1yxr h LYS 15 Cb 1.45 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.28 1yxr h LYS 15 CO 0.14 0.64 -0.31 0.00 -2.27 0.00 0.00 179.45 177.65 1yxr h ALA 16 N 1.36 0.05 -0.40 5.00 0.00 -1.40 -2.15 119.26 121.72 1yxr h ALA 16 Ca -0.01 -0.48 0.03 0.00 0.00 0.00 0.00 54.91 54.46 1yxr h ALA 16 Cb 1.15 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 1yxr h ALA 16 CO 0.08 0.13 0.20 0.00 0.00 0.00 0.00 179.25 179.66 1yxr h THR 17 N -0.41 0.97 -0.45 0.00 1.03 -1.50 0.13 112.91 112.68 1yxr h THR 17 Ca -0.04 -0.14 -0.07 0.00 -0.01 0.00 0.00 66.41 66.15 1yxr h THR 17 Cb 1.04 0.54 -0.02 0.00 -1.07 0.00 0.00 68.15 68.64 1yxr h THR 17 CO 0.06 0.07 -0.01 1.05 -0.01 0.00 0.00 175.52 176.69 1yxr h GLU 18 N 0.40 0.80 -0.67 0.00 4.11 -1.60 -3.03 114.58 114.58 1yxr h GLU 18 Ca 0.17 -0.26 -0.02 0.00 0.07 0.00 0.00 59.36 59.32 1yxr h GLU 18 Cb 0.08 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1yxr h GLU 18 CO -0.12 0.86 0.33 0.93 0.07 0.00 0.00 179.01 181.08 1yxr h GLU 19 N 0.64 0.97 -0.74 1.06 4.39 -1.01 -2.28 114.58 117.61 1yxr h GLU 19 Ca 0.13 -0.14 0.16 0.00 0.34 0.00 0.00 59.36 59.85 1yxr h GLU 19 Cb 0.51 -0.18 -0.05 0.00 -0.10 0.00 0.00 28.75 28.93 1yxr h GLU 19 CO 0.02 0.76 0.50 0.22 -1.16 0.00 0.00 179.01 179.35 1yxr h ASP 20 N 0.93 0.29 1.26 1.42 3.58 -0.64 0.36 116.42 123.62 1yxr h ASP 20 Ca 0.23 0.02 -0.05 0.00 0.42 0.00 0.00 57.03 57.65 1yxr h ASP 20 Cb 0.10 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.11 1yxr h ASP 20 CO -0.03 0.14 -0.25 0.11 -2.88 0.00 0.00 179.24 176.34 1yxr h LYS 21 N 0.30 0.00 -0.87 0.28 1.57 -1.35 -3.07 116.57 113.44 1yxr h LYS 21 Ca 0.36 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.90 1yxr h LYS 21 Cb 0.98 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.14 1yxr h LYS 21 CO -0.09 0.25 0.31 0.00 -0.57 0.00 0.00 179.45 179.34 1yxr n ALA 22 N -2.19 4.41 -3.56 3.86 0.00 0.12 -4.88 120.51 118.26 1yxr n ALA 22 Ca 0.01 -1.98 -0.26 0.00 0.00 0.00 0.00 53.44 51.22 1yxr n ALA 22 Cb 0.52 -1.25 0.05 0.00 0.00 0.00 0.00 19.45 18.77 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 -0.28 -6.28 -1.94 0.00 5.02 -1.15 -4.89 118.16 108.64 1yxr n LYS 23 Ca 0.37 0.75 -0.33 0.00 -2.02 0.00 0.00 58.31 57.08 1yxr n LYS 23 Cb 1.26 -5.69 0.04 0.00 -0.02 0.00 0.00 35.03 30.61 1yxr n LYS 23 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1yxr n ASN 24 N -2.81 6.49 -0.13 4.39 4.13 -0.71 -4.76 115.26 121.86 1yxr n ASN 24 Ca -0.01 -3.79 0.26 0.00 1.68 0.00 0.00 54.58 52.72 1yxr n ASN 24 Cb 0.56 -0.79 0.70 0.00 -1.54 0.00 0.00 39.78 38.71 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 2.54 0.04 -0.08 3.10 -1.99 -1.86 0.48 116.97 119.20 1yxr h TYR 25 Ca 0.48 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 61.18 1yxr h TYR 25 Cb 0.66 -0.01 -0.00 0.00 2.00 0.00 0.00 36.73 39.37 1yxr h TYR 25 CO 1.10 0.01 -0.08 0.93 -0.00 0.00 0.00 178.16 180.12 1yxr h GLU 26 N 0.03 0.20 -0.16 4.88 4.39 -1.93 -2.49 114.58 119.51 1yxr h GLU 26 Ca 0.38 -0.11 -0.21 0.00 0.34 0.00 0.00 59.36 59.76 1yxr h GLU 26 Cb 1.47 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.13 1yxr h GLU 26 CO -0.02 0.63 -0.73 1.49 -1.16 0.00 0.00 179.01 179.22 1yxr h GLU 27 N -0.21 0.73 -0.69 2.33 4.57 -1.50 -3.17 114.58 116.63 1yxr h GLU 27 Ca 0.01 -0.57 0.03 0.00 -1.18 0.00 0.00 59.36 57.66 1yxr h GLU 27 Cb 0.59 0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 29.25 1yxr h GLU 27 CO 0.02 1.18 0.46 0.00 -1.18 0.00 0.00 179.01 179.49 1yxr h ALA 28 N 0.66 1.60 -0.01 2.92 0.00 -0.16 0.59 119.26 124.86 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 1.34 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1yxr h ALA 28 CO 0.15 0.32 0.01 1.25 0.00 0.00 0.00 179.25 180.98 1yxr h LEU 29 N 0.84 0.02 -0.80 0.00 5.85 -1.41 0.18 115.31 119.98 1yxr h LEU 29 Ca 0.28 -0.12 -0.11 0.00 0.84 0.00 0.00 57.88 58.77 1yxr h LEU 29 Cb 0.06 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1yxr h LEU 29 CO -0.08 0.14 -0.26 0.03 -0.34 0.00 0.00 178.44 177.93 1yxr h ARG 30 N -0.10 0.62 -0.01 1.25 2.47 -1.47 -1.99 114.38 115.15 1yxr h ARG 30 Ca 0.00 -0.25 -0.12 0.00 -1.26 0.00 0.00 59.98 58.36 1yxr h ARG 30 Cb 0.12 -0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.40 1yxr h ARG 30 CO -0.00 0.82 -0.55 -0.07 0.56 0.00 0.00 179.97 180.73 1yxr h LEU 31 N 0.54 0.02 0.12 3.04 -0.00 -0.71 -2.37 115.31 115.95 1yxr h LEU 31 Ca 0.07 -0.01 -0.01 0.00 -0.00 0.00 0.00 57.88 57.93 1yxr h LEU 31 Cb 0.73 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.38 1yxr h LEU 31 CO 0.06 0.57 -0.06 1.88 -0.00 0.00 0.00 178.44 180.89 1yxr h TYR 32 N 0.02 -0.15 -0.21 1.13 0.05 -0.40 -2.86 116.97 114.55 1yxr h TYR 32 Ca -0.00 -0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.81 1yxr h TYR 32 Cb 0.97 0.05 -0.01 0.00 1.01 0.00 0.00 36.73 38.75 1yxr h TYR 32 CO 0.00 0.33 0.15 -0.56 -1.05 0.00 0.00 178.16 177.03 1yxr h GLN 33 N -0.88 0.10 -0.21 4.88 3.07 -1.42 -1.17 115.11 119.48 1yxr h GLN 33 Ca -0.02 -0.01 -0.14 0.00 0.09 0.00 0.00 58.65 58.57 1yxr h GLN 33 Cb 0.54 -0.02 -0.01 0.00 0.08 0.00 0.00 27.48 28.07 1yxr h GLN 33 CO 0.03 0.07 -0.47 0.45 0.09 0.00 0.00 178.83 178.99 1yxr h HIS 34 N 0.10 0.67 -0.01 0.06 3.86 -1.47 -2.45 115.15 115.91 1yxr h HIS 34 Ca 0.09 -0.21 -0.12 0.00 -1.16 0.00 0.00 60.37 58.97 1yxr h HIS 34 Cb 0.24 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.56 1yxr h HIS 34 CO -0.00 0.92 -0.55 0.00 0.86 0.00 0.00 177.93 179.16 1yxr h ALA 35 N 1.05 1.08 0.00 2.45 0.00 -0.99 -2.98 119.26 119.88 1yxr h ALA 35 Ca 0.02 -0.50 -0.19 0.00 0.00 0.00 0.00 54.91 54.25 1yxr h ALA 35 Cb 0.99 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1yxr h ALA 35 CO 0.09 0.69 -0.86 0.28 0.00 0.00 0.00 179.25 179.44 1yxr h VAL 36 N 0.02 1.55 -0.04 0.00 2.07 -1.30 -3.08 116.25 115.47 1yxr h VAL 36 Ca -0.00 -2.75 -0.10 0.00 0.82 0.00 0.00 66.70 64.66 1yxr h VAL 36 Cb 0.97 2.51 -0.01 0.00 -1.52 0.00 0.00 31.29 33.25 1yxr h VAL 36 CO 0.07 0.79 -0.45 -0.33 0.02 0.00 0.00 177.57 177.67 1yxr h GLU 37 N 0.05 0.10 -0.18 1.57 4.39 -1.31 -2.68 114.58 116.52 1yxr h GLU 37 Ca -0.03 -0.05 -0.21 0.00 0.34 0.00 0.00 59.36 59.41 1yxr h GLU 37 Cb 1.50 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.16 1yxr h GLU 37 CO 0.12 0.54 -0.70 1.88 -1.16 0.00 0.00 179.01 179.69 1yxr h TYR 38 N 0.08 1.05 -0.47 4.33 0.05 -1.51 -2.61 116.97 117.89 1yxr h TYR 38 Ca 0.00 -0.44 -0.03 0.00 0.05 0.00 0.00 58.73 58.31 1yxr h TYR 38 Cb 0.84 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 38.39 1yxr h TYR 38 CO 0.01 1.27 0.19 0.74 -1.05 0.00 0.00 178.16 179.32 1yxr h PHE 39 N 0.52 0.72 -0.55 4.88 0.04 -1.44 -0.88 116.94 120.22 1yxr h PHE 39 Ca -0.04 -0.05 -0.04 0.00 2.80 0.00 0.00 57.97 60.64 1yxr h PHE 39 Cb 1.33 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 39.24 1yxr h PHE 39 CO 0.09 0.61 0.20 -0.07 -0.60 0.00 0.00 178.31 178.53 1yxr h LEU 40 N 0.62 0.78 -1.25 1.54 3.38 -1.52 -2.39 115.31 116.46 1yxr h LEU 40 Ca 0.16 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 1yxr h LEU 40 Cb 0.19 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1yxr h LEU 40 CO -0.01 0.76 -0.33 -0.74 0.09 0.00 0.00 178.44 178.21 1yxr h HIS 41 N 0.76 0.09 -0.39 1.13 2.76 -1.29 -2.08 115.15 116.12 1yxr h HIS 41 Ca 0.18 -0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.21 1yxr h HIS 41 Cb 0.24 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.17 1yxr h HIS 41 CO 0.01 0.40 -0.26 0.00 -1.30 0.00 0.00 177.93 176.78 1yxr h ALA 42 N 1.60 0.79 -0.11 5.26 0.00 -0.76 -2.04 119.26 124.01 1yxr h ALA 42 Ca 0.01 -0.39 -0.12 0.00 0.00 0.00 0.00 54.91 54.40 1yxr h ALA 42 Cb 0.62 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1yxr h ALA 42 CO 0.05 0.65 -0.42 0.82 0.00 0.00 0.00 179.25 180.35 1yxr h ILE 43 N 0.71 1.37 0.27 0.00 2.04 -1.18 0.26 117.51 120.98 1yxr h ILE 43 Ca 0.09 -1.74 -0.01 0.00 1.00 0.00 0.00 64.86 64.20 1yxr h ILE 43 Cb 0.80 2.16 0.00 0.00 -0.74 0.00 0.00 36.82 39.04 1yxr h ILE 43 CO 0.07 0.52 -0.14 0.50 0.00 0.00 0.00 178.15 179.10 1yxr h LYS 44 N 0.07 -0.36 0.11 2.37 3.64 -1.37 -3.12 116.57 117.90 1yxr h LYS 44 Ca -0.02 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1yxr h LYS 44 Cb 1.05 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1yxr h LYS 44 CO 0.09 -0.24 -0.05 1.88 -2.27 0.00 0.00 179.45 178.85 1yxr h TYR 45 N -0.38 -0.13 -3.06 1.91 -1.99 -1.46 -3.40 116.97 108.46 1yxr h TYR 45 Ca -0.03 -0.00 -0.74 0.00 2.00 0.00 0.00 58.73 59.96 1yxr h TYR 45 Cb 0.30 0.04 -0.21 0.00 2.00 0.00 0.00 36.73 38.86 1yxr h TYR 45 CO -0.07 -0.08 0.50 -1.21 -0.00 0.00 0.00 178.16 177.30 1yxr s GLU 46 N -1.94 3.61 -0.18 4.88 2.02 0.91 -5.02 118.70 122.99 1yxr s GLU 46 Ca -0.02 -2.10 -0.21 0.00 0.02 0.00 0.00 54.97 52.66 1yxr s GLU 46 Cb 0.00 -4.70 -0.03 0.00 0.10 0.00 0.00 34.13 29.51 1yxr s GLU 46 CO 0.06 -1.55 0.64 0.00 0.02 0.00 0.00 175.26 174.43 1yxr s ALA 47 N 1.50 3.52 0.00 5.21 0.00 -1.18 -3.99 121.76 126.82 1yxr s ALA 47 Ca 0.26 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.02 1yxr s ALA 47 Cb -0.07 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.08 1yxr s ALA 47 CO -0.09 -0.48 0.00 0.72 0.00 0.00 0.00 175.76 175.91 1yxr n HIS 48 N 4.85 -1.87 -0.66 0.00 8.25 -1.26 -5.09 115.22 119.44 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 0.50 0.00 0.25 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 -0.95 0.84 0.35 0.41 0.01 -1.26 -4.49 113.70 108.62 1yxr s SER 49 Ca 0.00 1.27 0.02 0.00 1.31 0.00 0.00 55.95 58.55 1yxr s SER 49 Cb 0.00 -1.95 0.65 0.00 0.21 0.00 0.00 66.02 64.93 1yxr s SER 49 CO 0.00 -4.25 2.01 0.44 0.41 0.00 0.00 173.24 171.85 1yxr h ASP 50 N -2.66 0.72 0.12 2.44 3.32 -1.99 0.67 116.42 119.03 1yxr h ASP 50 Ca -0.57 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.45 1yxr h ASP 50 Cb 1.34 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1yxr h ASP 50 CO 0.48 0.52 -0.06 0.50 -1.72 0.00 0.00 179.24 178.96 1yxr h LYS 51 N 0.85 -0.15 -0.05 3.56 3.11 -1.99 0.22 116.57 122.12 1yxr h LYS 51 Ca 0.23 0.01 -0.18 0.00 -2.81 0.00 0.00 60.65 57.90 1yxr h LYS 51 Cb -0.08 0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 31.17 1yxr h LYS 51 CO -0.05 0.02 -0.76 0.00 -2.81 0.00 0.00 179.45 175.85 1yxr h ALA 52 N 0.57 0.60 -0.15 5.00 0.00 -1.82 -2.53 119.26 120.92 1yxr h ALA 52 Ca -0.02 -0.63 -0.12 0.00 0.00 0.00 0.00 54.91 54.15 1yxr h ALA 52 Cb 0.24 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1yxr h ALA 52 CO 0.03 0.79 -0.43 -0.22 0.00 0.00 0.00 179.25 179.42 1yxr h LYS 53 N 0.23 0.35 -0.09 0.00 3.64 0.41 -2.64 116.57 118.45 1yxr h LYS 53 Ca -0.03 -0.18 -0.18 0.00 -1.27 0.00 0.00 60.65 58.99 1yxr h LYS 53 Cb 1.34 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.17 1yxr h LYS 53 CO 0.13 0.72 -0.66 0.93 -2.27 0.00 0.00 179.45 178.30 1yxr h GLU 54 N 0.29 0.61 -0.56 1.90 4.39 -0.52 -2.08 114.58 118.60 1yxr h GLU 54 Ca 0.02 -0.53 0.01 0.00 0.34 0.00 0.00 59.36 59.21 1yxr h GLU 54 Cb 0.88 0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.61 1yxr h GLU 54 CO 0.07 1.15 0.36 0.77 -1.16 0.00 0.00 179.01 180.20 1yxr h SER 55 N 0.25 0.61 0.08 1.42 0.02 -1.41 -0.39 113.55 114.13 1yxr h SER 55 Ca -0.06 -0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 60.74 1yxr h SER 55 Cb 1.31 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 1yxr h SER 55 CO 0.13 0.43 -0.50 0.40 -1.14 0.00 0.00 176.83 176.16 1yxr h ILE 56 N 0.72 1.32 -0.53 3.27 2.04 -1.53 -0.90 117.51 121.91 1yxr h ILE 56 Ca 0.21 -1.72 -0.08 0.00 1.00 0.00 0.00 64.86 64.26 1yxr h ILE 56 Cb -0.05 1.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 1yxr h ILE 56 CO -0.06 0.53 -0.00 -0.09 0.00 0.00 0.00 178.15 178.53 1yxr h ARG 57 N 0.37 0.94 0.00 2.37 9.65 -0.93 -2.34 114.38 124.45 1yxr h ARG 57 Ca 0.02 -0.30 -0.14 0.00 -1.10 0.00 0.00 59.98 58.46 1yxr h ARG 57 Cb 1.00 -0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 29.48 1yxr h ARG 57 CO 0.09 0.95 -0.68 0.00 2.80 0.00 0.00 179.97 183.13 1yxr h ALA 58 N 0.95 0.63 0.06 2.80 0.00 -1.04 -3.18 119.26 119.48 1yxr h ALA 58 Ca 0.15 -0.62 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1yxr h ALA 58 Cb 0.53 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1yxr h ALA 58 CO 0.03 0.85 -0.03 0.87 0.00 0.00 0.00 179.25 180.97 1yxr h LYS 59 N 0.00 -0.07 -0.61 0.00 1.79 -1.00 -2.74 116.57 113.93 1yxr h LYS 59 Ca -0.01 0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.49 1yxr h LYS 59 Cb 1.43 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 32.06 1yxr h LYS 59 CO 0.09 0.29 0.40 0.00 -1.08 0.00 0.00 179.45 179.15 1yxr h VAL 61 N 0.76 1.23 -0.06 0.00 2.07 -1.52 -0.68 116.25 118.05 1yxr h VAL 61 Ca 0.23 -0.88 -0.20 0.00 0.82 0.00 0.00 66.70 66.67 1yxr h VAL 61 Cb 0.01 0.77 -0.00 0.00 -1.52 0.00 0.00 31.29 30.54 1yxr h VAL 61 CO -0.06 0.32 -0.81 -0.61 0.02 0.00 0.00 177.57 176.43 1yxr h GLN 62 N 0.76 0.46 -0.19 1.57 5.75 -1.03 -3.09 115.11 119.33 1yxr h GLN 62 Ca 0.16 -0.41 -0.16 0.00 -0.15 0.00 0.00 58.65 58.09 1yxr h GLN 62 Cb 0.36 0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.00 1yxr h GLN 62 CO 0.01 1.06 -0.54 1.88 -2.65 0.00 0.00 178.83 178.59 1yxr h TYR 63 N 0.30 0.69 -0.01 3.99 0.05 -1.06 -2.99 116.97 117.92 1yxr h TYR 63 Ca -0.05 -0.24 -0.05 0.00 0.05 0.00 0.00 58.73 58.44 1yxr h TYR 63 Cb 1.41 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 39.02 1yxr h TYR 63 CO 0.06 0.97 -0.23 -0.07 -1.05 0.00 0.00 178.16 177.83 1yxr h LEU 64 N 0.43 0.02 -0.48 3.88 3.38 -1.14 -2.51 115.31 118.88 1yxr h LEU 64 Ca 0.01 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.81 1yxr h LEU 64 Cb 1.07 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 1yxr h LEU 64 CO 0.10 0.26 -0.58 -0.78 0.09 0.00 0.00 178.44 177.53 1yxr h ASP 65 N 0.02 0.62 -0.39 -0.43 3.58 -1.44 -2.89 116.42 115.49 1yxr h ASP 65 Ca 0.00 -0.34 -0.12 0.00 0.42 0.00 0.00 57.03 56.99 1yxr h ASP 65 Cb 0.43 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 1yxr h ASP 65 CO 0.03 1.07 -0.22 -0.09 -2.88 0.00 0.00 179.24 177.15 1yxr h ARG 66 N 0.42 0.84 -0.43 0.28 9.65 -1.38 -2.98 114.38 120.78 1yxr h ARG 66 Ca 0.00 -0.38 -0.00 0.00 -1.10 0.00 0.00 59.98 58.50 1yxr h ARG 66 Cb 1.13 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 29.67 1yxr h ARG 66 CO 0.11 1.02 0.26 0.00 2.80 0.00 0.00 179.97 184.15 1yxr h ALA 67 N 0.80 0.54 -0.32 2.80 0.00 -1.46 -2.14 119.26 119.49 1yxr h ALA 67 Ca 0.08 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1yxr h ALA 67 Cb 0.78 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1yxr h ALA 67 CO 0.06 0.04 0.22 0.93 0.00 0.00 0.00 179.25 180.49 1yxr h GLU 68 N 0.56 0.28 0.00 0.00 4.39 -1.49 -0.76 114.58 117.57 1yxr h GLU 68 Ca 0.15 -0.02 -0.14 0.00 0.34 0.00 0.00 59.36 59.70 1yxr h GLU 68 Cb -0.00 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 1yxr h GLU 68 CO -0.03 0.19 -0.65 -0.22 -1.16 0.00 0.00 179.01 177.14 1yxr h LYS 69 N 0.29 0.00 0.00 2.33 3.11 -1.25 -2.55 116.57 118.51 1yxr h LYS 69 Ca 0.13 0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.97 1yxr h LYS 69 Cb 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.40 1yxr h LYS 69 CO -0.03 0.65 -0.00 -0.07 -2.81 0.00 0.00 179.45 177.19 1yxr h LEU 70 N 0.00 -0.00 -1.38 5.20 3.38 -0.61 -2.79 115.31 119.11 1yxr h LEU 70 Ca -0.01 -0.57 -0.06 0.00 0.09 0.00 0.00 57.88 57.34 1yxr h LEU 70 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1yxr h LEU 70 CO 0.08 0.57 -0.19 0.07 0.09 0.00 0.00 178.44 179.06 1yxr h LYS 71 N -0.57 0.17 0.00 1.13 2.10 -1.48 -2.21 116.57 115.72 1yxr h LYS 71 Ca -0.00 -0.05 -0.09 0.00 -2.00 0.00 0.00 60.65 58.52 1yxr h LYS 71 Cb 0.57 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 31.87 1yxr h LYS 71 CO 0.00 0.37 -0.41 -0.44 -2.00 0.00 0.00 179.45 176.97 1yxr h ASP 72 N 0.16 0.00 0.01 7.07 5.19 -1.46 -0.41 116.42 126.98 1yxr h ASP 72 Ca 0.03 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.43 1yxr h ASP 72 Cb 0.44 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.95 1yxr h ASP 72 CO 0.03 0.41 -0.06 0.22 -3.12 0.00 0.00 179.24 176.72 1yxr h TYR 73 N 0.00 0.05 -0.59 4.55 5.03 -1.13 -2.47 116.97 122.42 1yxr h TYR 73 Ca -0.00 -0.03 -0.11 0.00 2.58 0.00 0.00 58.73 61.17 1yxr h TYR 73 Cb 0.77 -0.00 -0.02 0.00 1.55 0.00 0.00 36.73 39.03 1yxr h TYR 73 CO 0.00 0.92 -0.05 1.37 -1.32 0.00 0.00 178.16 179.08 1yxr h LEU 74 N -0.84 1.06 -0.41 2.82 8.10 -1.46 -0.03 115.31 124.55 1yxr h LEU 74 Ca -0.01 -0.32 -0.05 0.00 0.11 0.00 0.00 57.88 57.61 1yxr h LEU 74 Cb 0.94 -0.29 -0.02 0.00 -0.44 0.00 0.00 40.66 40.86 1yxr h LEU 74 CO 0.01 1.13 0.05 0.03 -4.11 0.00 0.00 178.44 175.55 1yxr h ARG 75 N 0.96 0.69 -0.28 0.17 3.08 -1.19 -3.13 114.38 114.69 1yxr h ARG 75 Ca 0.16 -0.19 -0.08 0.00 0.07 0.00 0.00 59.98 59.94 1yxr h ARG 75 Cb 0.61 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.58 1yxr h ARG 75 CO 0.04 0.74 -0.16 0.66 -1.07 0.00 0.00 179.97 180.18 1yxr h SER 76 N 0.53 0.62 -0.01 7.04 4.64 -1.36 -3.51 113.55 121.51 1yxr h SER 76 Ca 0.12 -0.42 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1yxr h SER 76 Cb 0.39 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1yxr h SER 76 CO 0.01 0.90 0.00 1.17 -0.87 0.00 0.00 176.83 178.04