#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 3.11 0.75 2.03 -1.32 -1.26 -5.11 115.64 113.84 1yxr s THR 2 Ca 0.00 -0.58 -0.11 0.00 -1.21 0.00 0.00 61.69 59.79 1yxr s THR 2 Cb 0.00 -2.39 0.04 0.00 -1.51 0.00 0.00 72.50 68.64 1yxr s THR 2 CO 0.00 0.45 1.08 -0.89 -2.21 0.00 0.00 174.62 173.05 1yxr s THR 3 N 1.39 3.54 0.22 5.08 2.01 -1.26 -5.08 115.64 121.54 1yxr s THR 3 Ca 0.05 0.50 0.00 0.00 0.31 0.00 0.00 61.69 62.55 1yxr s THR 3 Cb -0.14 -3.13 -0.05 0.00 0.01 0.00 0.00 72.50 69.19 1yxr s THR 3 CO -0.05 -0.65 0.10 -0.44 -0.69 0.00 0.00 174.62 172.88 1yxr s SER 4 N -3.63 0.75 0.11 3.53 0.01 -1.26 -5.06 113.70 108.14 1yxr s SER 4 Ca 0.60 -1.35 -0.05 0.00 1.31 0.00 0.00 55.95 56.46 1yxr s SER 4 Cb -0.16 0.25 -0.17 0.00 0.21 0.00 0.00 66.02 66.15 1yxr s SER 4 CO 0.55 -0.75 1.23 0.74 0.41 0.00 0.00 173.24 175.42 1yxr h THR 5 N 2.53 1.43 -0.10 1.44 2.02 -1.98 -2.80 112.91 115.46 1yxr h THR 5 Ca -0.37 -2.66 -0.22 0.00 0.77 0.00 0.00 66.41 63.93 1yxr h THR 5 Cb 1.24 2.62 0.01 0.00 -1.74 0.00 0.00 68.15 70.28 1yxr h THR 5 CO 0.58 0.79 -0.80 -0.07 0.37 0.00 0.00 175.52 176.38 1yxr h LEU 6 N 0.18 0.75 -0.98 2.58 -0.00 -1.97 -2.82 115.31 113.05 1yxr h LEU 6 Ca -0.11 -0.51 -0.10 0.00 -0.00 0.00 0.00 57.88 57.16 1yxr h LEU 6 Cb 1.74 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 42.16 1yxr h LEU 6 CO 0.18 1.29 -0.35 -0.61 -0.00 0.00 0.00 178.44 178.95 1yxr h GLN 7 N 0.41 0.30 -0.07 1.13 5.75 -1.98 -1.95 115.11 118.71 1yxr h GLN 7 Ca -0.06 -0.13 -0.14 0.00 -0.15 0.00 0.00 58.65 58.17 1yxr h GLN 7 Cb 1.42 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.95 1yxr h GLN 7 CO 0.15 0.62 -0.60 0.87 -2.65 0.00 0.00 178.83 177.22 1yxr h LYS 8 N 0.26 0.22 -0.08 1.69 1.79 -1.48 -2.17 116.57 116.81 1yxr h LYS 8 Ca 0.03 -0.15 -0.25 0.00 -2.18 0.00 0.00 60.65 58.10 1yxr h LYS 8 Cb 0.75 0.02 0.02 0.00 -1.58 0.00 0.00 32.23 31.43 1yxr h LYS 8 CO 0.06 0.75 -0.91 0.00 -1.08 0.00 0.00 179.45 178.27 1yxr h ALA 9 N 1.21 0.22 -0.00 3.86 0.00 -1.24 -2.24 119.26 121.08 1yxr h ALA 9 Ca -0.01 -0.65 -0.11 0.00 0.00 0.00 0.00 54.91 54.15 1yxr h ALA 9 Cb 1.09 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1yxr h ALA 9 CO 0.09 0.69 -0.51 0.82 0.00 0.00 0.00 179.25 180.34 1yxr h ILE 10 N 0.47 1.37 0.01 0.00 2.04 -1.34 -2.50 117.51 117.55 1yxr h ILE 10 Ca -0.09 -1.74 -0.21 0.00 1.00 0.00 0.00 64.86 63.82 1yxr h ILE 10 Cb 1.56 1.94 -0.02 0.00 -0.74 0.00 0.00 36.82 39.55 1yxr h ILE 10 CO 0.18 0.50 -0.99 -0.78 0.00 0.00 0.00 178.15 177.06 1yxr h ASP 11 N 0.00 0.06 0.35 1.72 3.58 -1.40 -2.86 116.42 117.88 1yxr h ASP 11 Ca -0.01 -0.06 -0.17 0.00 0.42 0.00 0.00 57.03 57.21 1yxr h ASP 11 Cb 0.90 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.92 1yxr h ASP 11 CO 0.07 1.01 -0.69 -0.07 -2.88 0.00 0.00 179.24 176.67 1yxr h LEU 12 N 0.01 0.35 -0.33 2.28 -0.00 -1.24 -2.66 115.31 113.73 1yxr h LEU 12 Ca -0.03 -0.22 -0.18 0.00 -0.00 0.00 0.00 57.88 57.45 1yxr h LEU 12 Cb 1.72 -0.10 -0.02 0.00 -0.00 0.00 0.00 40.66 42.25 1yxr h LEU 12 CO 0.13 0.94 -0.85 -0.37 -0.00 0.00 0.00 178.44 178.29 1yxr h VAL 13 N 0.21 1.56 -0.19 1.22 -1.51 -1.50 -2.76 116.25 113.28 1yxr h VAL 13 Ca -0.02 -2.77 -0.18 0.00 -1.23 0.00 0.00 66.70 62.51 1yxr h VAL 13 Cb 1.24 2.51 -0.00 0.00 -2.13 0.00 0.00 31.29 32.91 1yxr h VAL 13 CO 0.11 0.79 -0.61 0.74 -1.23 0.00 0.00 177.57 177.38 1yxr h THR 14 N 0.03 1.31 -0.00 7.19 2.02 -1.46 -2.10 112.91 119.90 1yxr h THR 14 Ca -0.02 -1.85 -0.14 0.00 0.77 0.00 0.00 66.41 65.17 1yxr h THR 14 Cb 1.48 1.81 -0.02 0.00 -1.74 0.00 0.00 68.15 69.68 1yxr h THR 14 CO 0.12 0.58 -0.66 0.50 0.37 0.00 0.00 175.52 176.43 1yxr h LYS 15 N 0.48 0.02 -0.04 6.66 3.64 -1.50 -2.81 116.57 123.02 1yxr h LYS 15 Ca -0.00 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.30 1yxr h LYS 15 Cb 1.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1yxr h LYS 15 CO 0.12 0.67 -0.22 0.00 -2.27 0.00 0.00 179.45 177.75 1yxr h ALA 16 N 1.33 0.07 -0.37 5.00 0.00 -1.42 -2.28 119.26 121.59 1yxr h ALA 16 Ca -0.01 -0.42 0.02 0.00 0.00 0.00 0.00 54.91 54.51 1yxr h ALA 16 Cb 1.16 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 1yxr h ALA 16 CO 0.09 0.07 0.20 0.00 0.00 0.00 0.00 179.25 179.60 1yxr h THR 17 N -0.37 1.01 -0.39 0.00 1.03 -1.42 -0.27 112.91 112.50 1yxr h THR 17 Ca -0.02 -0.14 -0.06 0.00 -0.01 0.00 0.00 66.41 66.18 1yxr h THR 17 Cb 0.89 0.57 -0.02 0.00 -1.07 0.00 0.00 68.15 68.52 1yxr h THR 17 CO 0.04 0.08 -0.02 1.05 -0.01 0.00 0.00 175.52 176.66 1yxr h GLU 18 N 0.41 0.63 -0.42 0.00 4.11 -1.58 -2.74 114.58 114.99 1yxr h GLU 18 Ca 0.15 -0.16 -0.12 0.00 0.07 0.00 0.00 59.36 59.30 1yxr h GLU 18 Cb 0.03 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1yxr h GLU 18 CO -0.08 0.67 -0.22 0.93 0.07 0.00 0.00 179.01 180.38 1yxr h GLU 19 N 0.60 0.85 -0.98 1.06 5.08 -0.79 -2.95 114.58 117.45 1yxr h GLU 19 Ca 0.12 -0.35 0.14 0.00 -1.00 0.00 0.00 59.36 58.27 1yxr h GLU 19 Cb 0.41 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.54 1yxr h GLU 19 CO 0.02 0.98 0.62 0.22 -1.00 0.00 0.00 179.01 179.85 1yxr h ASP 20 N 0.74 0.84 1.42 1.42 1.82 -0.75 0.25 116.42 122.15 1yxr h ASP 20 Ca 0.10 0.05 -0.02 0.00 -0.39 0.00 0.00 57.03 56.77 1yxr h ASP 20 Cb 0.75 -0.11 -0.00 0.00 0.68 0.00 0.00 39.33 40.65 1yxr h ASP 20 CO 0.06 0.42 -0.09 0.11 -1.61 0.00 0.00 179.24 178.13 1yxr h LYS 21 N 0.89 0.00 -0.81 0.28 6.56 -1.51 -3.05 116.57 118.93 1yxr h LYS 21 Ca 0.50 0.00 -0.16 0.00 -1.06 0.00 0.00 60.65 59.93 1yxr h LYS 21 Cb 0.61 0.00 -0.09 0.00 -0.57 0.00 0.00 32.23 32.18 1yxr h LYS 21 CO -0.27 0.09 0.20 0.00 -2.06 0.00 0.00 179.45 177.41 1yxr n ALA 22 N -2.13 4.07 -3.74 3.86 0.00 0.73 -4.89 120.51 118.41 1yxr n ALA 22 Ca 0.02 -1.75 -0.27 0.00 0.00 0.00 0.00 53.44 51.45 1yxr n ALA 22 Cb 0.45 -1.19 0.05 0.00 0.00 0.00 0.00 19.45 18.76 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 -0.01 -6.72 -2.00 0.00 4.76 -1.08 -4.90 118.16 108.21 1yxr n LYS 23 Ca 0.31 0.72 -0.32 0.00 -2.87 0.00 0.00 58.31 56.15 1yxr n LYS 23 Cb 1.14 -5.68 0.03 0.00 -1.84 0.00 0.00 35.03 28.68 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 -2.94 6.16 -0.34 4.39 5.03 -0.39 -4.78 115.26 122.39 1yxr n ASN 24 Ca 0.00 -3.77 0.13 0.00 0.87 0.00 0.00 54.58 51.81 1yxr n ASN 24 Cb 0.55 -0.71 0.34 0.00 -1.02 0.00 0.00 39.78 38.94 1yxr n ASN 24 CO 0.00 0.00 0.00 1.88 -1.83 0.00 0.00 177.26 177.31 1yxr h TYR 25 N 2.51 1.00 -0.43 3.10 -1.99 -1.86 0.65 116.97 119.95 1yxr h TYR 25 Ca 0.45 0.03 -0.06 0.00 2.00 0.00 0.00 58.73 61.16 1yxr h TYR 25 Cb 0.76 -0.30 -0.02 0.00 2.00 0.00 0.00 36.73 39.17 1yxr h TYR 25 CO 1.05 0.25 0.05 0.93 -0.00 0.00 0.00 178.16 180.44 1yxr h GLU 26 N 0.74 0.73 -0.18 4.88 4.39 -1.90 -2.20 114.58 121.03 1yxr h GLU 26 Ca 0.55 -0.21 -0.21 0.00 0.34 0.00 0.00 59.36 59.83 1yxr h GLU 26 Cb 0.89 -0.08 0.01 0.00 -0.10 0.00 0.00 28.75 29.47 1yxr h GLU 26 CO -0.33 0.77 -0.73 1.49 -1.16 0.00 0.00 179.01 179.05 1yxr h GLU 27 N 0.58 0.79 -0.51 2.33 4.57 -1.48 -3.16 114.58 117.71 1yxr h GLU 27 Ca 0.13 -0.61 0.02 0.00 -1.18 0.00 0.00 59.36 57.71 1yxr h GLU 27 Cb 0.41 0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 29.09 1yxr h GLU 27 CO 0.01 1.23 0.34 0.00 -1.18 0.00 0.00 179.01 179.41 1yxr h ALA 28 N 0.61 1.70 -0.46 2.92 0.00 0.30 0.68 119.26 125.01 1yxr h ALA 28 Ca -0.04 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1yxr h ALA 28 Cb 1.35 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1yxr h ALA 28 CO 0.15 0.26 0.12 1.25 0.00 0.00 0.00 179.25 181.02 1yxr h LEU 29 N 0.63 0.69 -0.34 0.00 5.85 -1.36 0.11 115.31 120.89 1yxr h LEU 29 Ca 0.20 -0.23 -0.20 0.00 0.84 0.00 0.00 57.88 58.49 1yxr h LEU 29 Cb 0.02 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 40.86 1yxr h LEU 29 CO -0.05 0.74 -0.78 0.03 -0.34 0.00 0.00 178.44 178.04 1yxr h ARG 30 N 0.61 0.43 -0.14 1.25 -0.00 -1.41 -2.25 114.38 112.88 1yxr h ARG 30 Ca 0.14 -0.38 -0.14 0.00 -0.50 0.00 0.00 59.98 59.10 1yxr h ARG 30 Cb 0.31 0.09 -0.01 0.00 0.00 0.00 0.00 29.97 30.36 1yxr h ARG 30 CO 0.00 1.02 -0.53 -0.07 0.00 0.00 0.00 179.97 180.39 1yxr h LEU 31 N 0.29 0.44 -0.06 3.04 -0.00 -0.75 -2.62 115.31 115.65 1yxr h LEU 31 Ca -0.04 -0.23 -0.07 0.00 -0.00 0.00 0.00 57.88 57.54 1yxr h LEU 31 Cb 1.37 -0.13 0.00 0.00 -0.00 0.00 0.00 40.66 41.91 1yxr h LEU 31 CO 0.14 0.89 -0.24 1.88 -0.00 0.00 0.00 178.44 181.10 1yxr h TYR 32 N 0.31 0.36 -0.69 1.13 0.05 -0.77 -2.92 116.97 114.44 1yxr h TYR 32 Ca 0.01 -0.15 0.03 0.00 0.05 0.00 0.00 58.73 58.67 1yxr h TYR 32 Cb 1.04 -0.06 -0.04 0.00 1.01 0.00 0.00 36.73 38.68 1yxr h TYR 32 CO 0.03 0.87 0.46 1.96 -1.05 0.00 0.00 178.16 180.42 1yxr h GLN 33 N -0.25 0.82 -0.60 4.88 4.20 -1.43 -1.97 115.11 120.76 1yxr h GLN 33 Ca -0.01 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.55 1yxr h GLN 33 Cb 0.89 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 1yxr h GLN 33 CO 0.05 0.54 -0.01 0.45 -0.67 0.00 0.00 178.83 179.19 1yxr h HIS 34 N 0.84 1.17 -0.01 2.96 3.86 -1.48 -2.70 115.15 119.78 1yxr h HIS 34 Ca 0.27 -0.21 -0.04 0.00 -1.16 0.00 0.00 60.37 59.23 1yxr h HIS 34 Cb 0.05 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.21 1yxr h HIS 34 CO -0.00 1.03 -0.20 0.00 0.86 0.00 0.00 177.93 179.62 1yxr h ALA 35 N 0.98 1.64 -0.05 2.45 0.00 -1.17 -2.34 119.26 120.77 1yxr h ALA 35 Ca 0.17 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 1yxr h ALA 35 Cb 0.57 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1yxr h ALA 35 CO 0.03 0.27 -0.68 0.28 0.00 0.00 0.00 179.25 179.15 1yxr h VAL 36 N 0.02 1.42 -0.29 0.00 2.07 -1.15 -2.50 116.25 115.82 1yxr h VAL 36 Ca 0.00 -2.17 -0.15 0.00 0.82 0.00 0.00 66.70 65.20 1yxr h VAL 36 Cb 0.37 2.14 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1yxr h VAL 36 CO 0.03 0.64 -0.43 -0.33 0.02 0.00 0.00 177.57 177.49 1yxr h GLU 37 N 0.16 0.74 -0.05 1.57 4.39 -1.16 -1.84 114.58 118.40 1yxr h GLU 37 Ca -0.02 -0.40 -0.16 0.00 0.34 0.00 0.00 59.36 59.12 1yxr h GLU 37 Cb 1.23 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.88 1yxr h GLU 37 CO 0.11 1.02 -0.66 1.88 -1.16 0.00 0.00 179.01 180.20 1yxr h TYR 38 N 0.60 0.28 -0.17 4.33 -1.99 -1.46 -2.52 116.97 116.03 1yxr h TYR 38 Ca 0.04 -0.12 -0.16 0.00 2.00 0.00 0.00 58.73 60.49 1yxr h TYR 38 Cb 0.99 -0.05 0.00 0.00 2.00 0.00 0.00 36.73 39.67 1yxr h TYR 38 CO 0.05 0.81 -0.53 0.74 -0.00 0.00 0.00 178.16 179.24 1yxr h PHE 39 N 0.15 0.85 -0.28 4.88 0.04 -1.36 -2.38 116.94 118.84 1yxr h PHE 39 Ca -0.01 -0.34 -0.03 0.00 2.80 0.00 0.00 57.97 60.38 1yxr h PHE 39 Cb 1.19 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 39.19 1yxr h PHE 39 CO 0.02 1.13 0.06 -0.07 -0.60 0.00 0.00 178.31 178.86 1yxr h LEU 40 N 0.33 0.44 -1.16 1.54 3.38 -1.35 -2.49 115.31 115.99 1yxr h LEU 40 Ca -0.02 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.67 1yxr h LEU 40 Cb 1.15 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 1yxr h LEU 40 CO 0.11 0.56 0.17 -0.74 0.09 0.00 0.00 178.44 178.64 1yxr h HIS 41 N 0.29 0.76 -0.73 1.13 2.76 -1.51 -2.07 115.15 115.78 1yxr h HIS 41 Ca 0.09 -0.05 -0.05 0.00 -2.20 0.00 0.00 60.37 58.16 1yxr h HIS 41 Cb 0.30 -0.23 -0.03 0.00 1.55 0.00 0.00 27.41 29.00 1yxr h HIS 41 CO 0.02 0.62 0.27 0.00 -1.30 0.00 0.00 177.93 177.54 1yxr h ALA 42 N 1.45 0.95 0.08 5.26 0.00 -1.22 -0.48 119.26 125.29 1yxr h ALA 42 Ca 0.17 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1yxr h ALA 42 Cb 0.20 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1yxr h ALA 42 CO -0.01 0.59 -0.04 0.82 0.00 0.00 0.00 179.25 180.61 1yxr h ILE 43 N 1.05 1.14 0.21 0.00 2.04 -1.06 0.75 117.51 121.64 1yxr h ILE 43 Ca 0.24 -0.85 -0.00 0.00 1.00 0.00 0.00 64.86 65.24 1yxr h ILE 43 Cb 0.24 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 1yxr h ILE 43 CO -0.02 0.21 -0.14 0.50 0.00 0.00 0.00 178.15 178.70 1yxr h LYS 44 N -0.50 -0.34 0.19 2.37 3.11 -1.34 -3.10 116.57 116.96 1yxr h LYS 44 Ca -0.01 0.02 -0.01 0.00 -2.81 0.00 0.00 60.65 57.84 1yxr h LYS 44 Cb 0.42 0.08 0.00 0.00 -1.00 0.00 0.00 32.23 31.73 1yxr h LYS 44 CO 0.02 -0.23 -0.09 1.88 -2.81 0.00 0.00 179.45 178.22 1yxr h TYR 45 N -0.35 -0.23 -2.85 1.91 -1.99 -1.15 -3.40 116.97 108.90 1yxr h TYR 45 Ca -0.01 -0.01 -0.73 0.00 2.00 0.00 0.00 58.73 59.98 1yxr h TYR 45 Cb 0.30 0.08 -0.21 0.00 2.00 0.00 0.00 36.73 38.90 1yxr h TYR 45 CO -0.10 -0.15 0.65 -1.21 -0.00 0.00 0.00 178.16 177.36 1yxr s GLU 46 N -2.38 3.68 -0.74 4.88 0.41 0.26 -4.98 118.70 119.83 1yxr s GLU 46 Ca -0.04 -2.12 -0.21 0.00 -0.41 0.00 0.00 54.97 52.19 1yxr s GLU 46 Cb 0.00 -4.77 0.09 0.00 -1.78 0.00 0.00 34.13 27.67 1yxr s GLU 46 CO 0.11 -1.61 0.99 0.00 -0.49 0.00 0.00 175.26 174.27 1yxr s ALA 47 N 1.64 3.22 1.00 5.21 0.00 -1.17 -4.01 121.76 127.64 1yxr s ALA 47 Ca 0.29 -2.17 0.00 0.00 0.00 0.00 0.00 51.96 50.09 1yxr s ALA 47 Cb -0.06 -3.89 0.00 0.00 0.00 0.00 0.00 23.12 19.17 1yxr s ALA 47 CO -0.08 -2.80 0.00 0.72 0.00 0.00 0.00 175.76 173.59 1yxr n HIS 48 N 7.23 -3.14 -0.58 0.00 8.25 -1.26 -5.04 115.22 120.68 1yxr n HIS 48 Ca 0.04 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.21 1yxr n HIS 48 Cb 0.46 0.00 0.26 0.00 1.12 0.00 0.00 29.99 31.84 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 -1.13 0.05 0.41 0.41 0.01 -1.26 -4.53 113.70 107.67 1yxr s SER 49 Ca 0.00 1.05 0.11 0.00 1.31 0.00 0.00 55.95 58.42 1yxr s SER 49 Cb 0.00 -1.56 0.88 0.00 0.21 0.00 0.00 66.02 65.55 1yxr s SER 49 CO 0.00 -4.71 1.95 0.44 0.41 0.00 0.00 173.24 171.33 1yxr h ASP 50 N -2.97 0.14 -0.13 2.44 5.19 -1.97 0.13 116.42 119.24 1yxr h ASP 50 Ca -0.51 -0.03 -0.02 0.00 -0.62 0.00 0.00 57.03 55.86 1yxr h ASP 50 Cb 1.33 -0.04 -0.00 0.00 0.18 0.00 0.00 39.33 40.80 1yxr h ASP 50 CO 0.39 0.30 0.01 0.50 -3.12 0.00 0.00 179.24 177.32 1yxr h LYS 51 N 0.14 0.22 -0.06 3.56 3.64 -1.99 -0.82 116.57 121.26 1yxr h LYS 51 Ca 0.03 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.23 1yxr h LYS 51 Cb 0.34 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.14 1yxr h LYS 51 CO 0.02 0.43 -0.42 0.00 -2.27 0.00 0.00 179.45 177.22 1yxr h ALA 52 N 0.78 0.14 -0.33 5.00 0.00 -1.84 -2.67 119.26 120.34 1yxr h ALA 52 Ca 0.04 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 54.48 1yxr h ALA 52 Cb 0.32 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1yxr h ALA 52 CO 0.00 0.27 0.22 0.87 0.00 0.00 0.00 179.25 180.61 1yxr h LYS 53 N -0.08 0.40 -0.09 0.00 1.57 -0.80 -1.45 116.57 116.12 1yxr h LYS 53 Ca -0.03 -0.02 -0.22 0.00 -1.87 0.00 0.00 60.65 58.50 1yxr h LYS 53 Cb 1.08 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 33.31 1yxr h LYS 53 CO 0.09 0.26 -0.82 0.93 -0.57 0.00 0.00 179.45 179.33 1yxr h GLU 54 N 0.41 0.64 -0.65 3.15 5.08 -1.15 -2.30 114.58 119.77 1yxr h GLU 54 Ca 0.12 -0.56 -0.09 0.00 -1.00 0.00 0.00 59.36 57.84 1yxr h GLU 54 Cb 0.00 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1yxr h GLU 54 CO -0.03 1.18 0.06 0.77 -1.00 0.00 0.00 179.01 179.99 1yxr h SER 55 N 0.42 1.07 0.06 1.42 0.02 -1.01 -1.10 113.55 114.43 1yxr h SER 55 Ca -0.06 -0.28 -0.16 0.00 -0.84 0.00 0.00 61.79 60.45 1yxr h SER 55 Cb 1.44 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 1yxr h SER 55 CO 0.16 1.08 -0.55 0.40 -1.14 0.00 0.00 176.83 176.78 1yxr h ILE 56 N 1.01 1.33 -0.31 3.27 2.04 -1.32 -1.45 117.51 122.08 1yxr h ILE 56 Ca 0.19 -1.80 -0.10 0.00 1.00 0.00 0.00 64.86 64.15 1yxr h ILE 56 Cb 0.49 1.78 -0.01 0.00 -0.74 0.00 0.00 36.82 38.35 1yxr h ILE 56 CO 0.02 0.56 -0.21 -0.09 0.00 0.00 0.00 178.15 178.43 1yxr h ARG 57 N 0.40 0.69 -0.10 2.37 9.65 -1.22 -1.96 114.38 124.21 1yxr h ARG 57 Ca 0.01 -0.33 -0.14 0.00 -1.10 0.00 0.00 59.98 58.43 1yxr h ARG 57 Cb 1.08 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.64 1yxr h ARG 57 CO 0.10 0.93 -0.54 0.00 2.80 0.00 0.00 179.97 183.27 1yxr h ALA 58 N 0.75 0.91 -0.17 2.80 0.00 -1.20 -3.06 119.26 119.28 1yxr h ALA 58 Ca 0.06 -0.50 -0.14 0.00 0.00 0.00 0.00 54.91 54.33 1yxr h ALA 58 Cb 0.75 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1yxr h ALA 58 CO 0.06 0.68 -0.49 0.87 0.00 0.00 0.00 179.25 180.37 1yxr h LYS 59 N 0.22 0.46 -0.62 0.00 1.57 -1.20 -3.02 116.57 113.98 1yxr h LYS 59 Ca 0.00 -0.26 -0.03 0.00 -1.87 0.00 0.00 60.65 58.49 1yxr h LYS 59 Cb 1.02 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.31 1yxr h LYS 59 CO 0.09 0.85 0.26 0.00 -0.57 0.00 0.00 179.45 180.07 1yxr h VAL 61 N 0.89 1.27 -0.04 0.00 2.07 -1.49 -1.01 116.25 117.95 1yxr h VAL 61 Ca 0.21 -1.32 -0.21 0.00 0.82 0.00 0.00 66.70 66.20 1yxr h VAL 61 Cb 0.16 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1yxr h VAL 61 CO -0.02 0.45 -0.86 1.56 0.02 0.00 0.00 177.57 178.72 1yxr h GLN 62 N 0.76 0.43 -0.21 1.57 4.20 -1.35 -2.76 115.11 117.76 1yxr h GLN 62 Ca 0.11 -0.41 -0.16 0.00 0.06 0.00 0.00 58.65 58.25 1yxr h GLN 62 Cb 0.72 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.60 1yxr h GLN 62 CO 0.06 1.07 -0.52 1.88 -0.67 0.00 0.00 178.83 180.65 1yxr h TYR 63 N 0.27 0.72 0.00 2.96 0.05 -0.87 -2.84 116.97 117.26 1yxr h TYR 63 Ca -0.06 -0.25 -0.11 0.00 0.05 0.00 0.00 58.73 58.37 1yxr h TYR 63 Cb 1.47 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 39.05 1yxr h TYR 63 CO 0.06 0.98 -0.52 -0.07 -1.05 0.00 0.00 178.16 177.55 1yxr h LEU 64 N 0.45 0.00 -0.59 3.88 3.38 -1.20 -2.66 115.31 118.57 1yxr h LEU 64 Ca 0.02 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 1yxr h LEU 64 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1yxr h LEU 64 CO 0.10 0.52 -0.65 -0.78 0.09 0.00 0.00 178.44 177.72 1yxr h ASP 65 N 0.00 0.27 0.60 -0.43 1.82 -1.37 -3.02 116.42 114.29 1yxr h ASP 65 Ca -0.01 -0.16 -0.18 0.00 -0.39 0.00 0.00 57.03 56.29 1yxr h ASP 65 Cb 0.94 -0.08 -0.01 0.00 0.68 0.00 0.00 39.33 40.86 1yxr h ASP 65 CO 0.07 0.84 -0.81 -0.09 -1.61 0.00 0.00 179.24 177.64 1yxr h ARG 66 N 0.16 0.15 0.00 0.28 9.65 -1.35 -3.14 114.38 120.13 1yxr h ARG 66 Ca -0.01 -0.15 -0.09 0.00 -1.10 0.00 0.00 59.98 58.63 1yxr h ARG 66 Cb 1.17 0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.78 1yxr h ARG 66 CO 0.10 0.87 -0.42 0.00 2.80 0.00 0.00 179.97 183.33 1yxr h ALA 67 N 1.08 1.30 -0.14 2.80 0.00 -1.41 -2.74 119.26 120.14 1yxr h ALA 67 Ca -0.03 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.42 1yxr h ALA 67 Cb 1.41 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 1yxr h ALA 67 CO 0.12 0.52 -0.22 0.93 0.00 0.00 0.00 179.25 180.60 1yxr h GLU 68 N 0.00 0.40 -0.04 0.00 5.08 -1.49 -2.97 114.58 115.57 1yxr h GLU 68 Ca -0.00 -0.24 -0.03 0.00 -1.00 0.00 0.00 59.36 58.08 1yxr h GLU 68 Cb 0.74 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 1yxr h GLU 68 CO 0.05 0.83 -0.12 -0.22 -1.00 0.00 0.00 179.01 178.56 1yxr h LYS 69 N 0.01 0.05 -0.00 2.33 1.63 -1.50 -0.89 116.57 118.19 1yxr h LYS 69 Ca 0.01 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1yxr h LYS 69 Cb 0.80 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.42 1yxr h LYS 69 CO 0.05 0.17 -0.00 -0.07 -3.45 0.00 0.00 179.45 176.16 1yxr h LEU 70 N 0.05 0.00 -0.84 5.20 3.38 -1.42 -1.19 115.31 120.49 1yxr h LEU 70 Ca 0.01 -0.31 -0.11 0.00 0.09 0.00 0.00 57.88 57.55 1yxr h LEU 70 Cb 0.24 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1yxr h LEU 70 CO 0.02 0.31 -0.37 0.07 0.09 0.00 0.00 178.44 178.56 1yxr h LYS 71 N -0.31 0.42 -0.02 1.13 2.10 -1.35 -2.66 116.57 115.88 1yxr h LYS 71 Ca 0.00 -0.19 -0.09 0.00 -2.00 0.00 0.00 60.65 58.36 1yxr h LYS 71 Cb 0.31 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.62 1yxr h LYS 71 CO 0.00 0.73 -0.43 -0.44 -2.00 0.00 0.00 179.45 177.32 1yxr h ASP 72 N 0.35 0.05 0.02 7.07 5.19 -1.11 0.32 116.42 128.32 1yxr h ASP 72 Ca 0.04 -0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.42 1yxr h ASP 72 Cb 0.82 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.31 1yxr h ASP 72 CO 0.07 0.48 -0.01 0.22 -3.12 0.00 0.00 179.24 176.87 1yxr h TYR 73 N 0.04 -0.02 -0.11 4.55 5.03 -0.97 -1.92 116.97 123.57 1yxr h TYR 73 Ca 0.00 -0.00 -0.12 0.00 2.58 0.00 0.00 58.73 61.19 1yxr h TYR 73 Cb 0.77 0.01 -0.01 0.00 1.55 0.00 0.00 36.73 39.05 1yxr h TYR 73 CO 0.00 0.57 -0.45 1.37 -1.32 0.00 0.00 178.16 178.34 1yxr h LEU 74 N -0.65 0.28 -0.11 2.82 8.10 -1.47 -2.08 115.31 122.20 1yxr h LEU 74 Ca -0.00 -0.12 -0.03 0.00 0.11 0.00 0.00 57.88 57.83 1yxr h LEU 74 Cb 0.61 -0.08 -0.00 0.00 -0.44 0.00 0.00 40.66 40.75 1yxr h LEU 74 CO 0.00 0.69 -0.05 0.03 -4.11 0.00 0.00 178.44 175.01 1yxr h ARG 75 N 0.21 0.23 0.07 0.17 3.08 -0.98 -3.26 114.38 113.90 1yxr h ARG 75 Ca 0.02 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 1yxr h ARG 75 Cb 0.88 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.92 1yxr h ARG 75 CO 0.07 0.57 -0.03 1.03 -1.07 0.00 0.00 179.97 180.54 1yxr h SER 76 N -0.12 -0.07 0.00 7.04 0.87 -1.33 -3.51 113.55 116.44 1yxr h SER 76 Ca 0.03 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 1yxr h SER 76 Cb 0.49 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1yxr h SER 76 CO 0.02 0.10 0.00 1.17 -0.53 0.00 0.00 176.83 177.58