#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hue n ASN 2 N 0.00 0.00 0.00 6.12 0.23 -1.26 -4.94 115.26 115.41 1hue n ASN 2 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1hue n ASN 2 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1hue n ASN 2 CO 0.00 0.00 0.00 1.17 -0.93 0.00 0.00 177.26 177.50 1hue n LYS 3 N -0.34 0.00 -0.08 -3.83 4.81 -1.26 -4.97 118.16 112.49 1hue n LYS 3 Ca 0.00 0.00 -0.21 0.00 -0.87 0.00 0.00 58.31 57.23 1hue n LYS 3 Cb 0.00 0.00 -0.12 0.00 0.02 0.00 0.00 35.03 34.93 1hue n LYS 3 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1hue n THR 4 N 0.00 1.61 0.32 3.15 -1.04 -1.26 -3.64 114.28 113.42 1hue n THR 4 Ca 0.00 -0.52 0.20 0.00 -2.04 0.00 0.00 64.05 61.69 1hue n THR 4 Cb 0.00 -1.66 1.08 0.00 -1.82 0.00 0.00 70.33 67.93 1hue n THR 4 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1hue h GLU 5 N -0.21 0.00 0.38 -2.82 4.57 -1.93 -1.66 114.58 112.91 1hue h GLU 5 Ca -0.52 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 57.66 1hue h GLU 5 Cb 1.85 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.42 1hue h GLU 5 CO -0.08 0.00 -0.31 1.25 -1.18 0.00 0.00 179.01 178.69 1hue h LEU 6 N 0.00 -0.80 -0.51 1.64 6.46 -1.96 -2.84 115.31 117.30 1hue h LEU 6 Ca 0.01 0.06 0.10 0.00 -0.12 0.00 0.00 57.88 57.93 1hue h LEU 6 Cb 0.12 0.26 -0.09 0.00 -0.73 0.00 0.00 40.66 40.22 1hue h LEU 6 CO -0.00 -0.45 -0.02 0.40 -0.62 0.00 0.00 178.44 177.74 1hue h ILE 7 N -0.69 0.58 0.00 4.05 2.04 -1.37 -1.21 117.51 120.91 1hue h ILE 7 Ca -0.03 -0.03 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1hue h ILE 7 Cb 0.60 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1hue h ILE 7 CO -0.01 0.02 -0.16 0.78 0.00 0.00 0.00 178.15 178.78 1hue h ASN 8 N 0.09 0.00 -0.28 1.72 2.35 -1.60 -2.28 115.58 115.58 1hue h ASN 8 Ca 0.26 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.96 1hue h ASN 8 Cb 0.39 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.75 1hue h ASN 8 CO -0.45 0.16 -0.00 0.00 -1.65 0.00 0.00 177.43 175.49 1hue h ALA 9 N 1.84 0.38 0.21 -0.83 0.00 -0.97 -2.77 119.26 117.13 1hue h ALA 9 Ca -0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1hue h ALA 9 Cb 0.39 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1hue h ALA 9 CO 0.02 0.13 -0.10 0.28 0.00 0.00 0.00 179.25 179.58 1hue h VAL 10 N 0.29 0.85 0.00 0.00 2.07 -1.36 -0.91 116.25 117.19 1hue h VAL 10 Ca 0.08 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 1hue h VAL 10 Cb 0.43 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1hue h VAL 10 CO 0.02 0.18 -0.06 0.00 0.02 0.00 0.00 177.57 177.72 1hue h ALA 11 N -0.13 1.22 0.04 1.67 0.00 -1.58 -0.58 119.26 119.90 1hue h ALA 11 Ca -0.03 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1hue h ALA 11 Cb 0.50 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1hue h ALA 11 CO 0.05 0.08 -0.02 1.49 0.00 0.00 0.00 179.25 180.85 1hue h GLU 12 N 0.00 -0.05 -0.16 0.00 4.81 -1.43 -2.90 114.58 114.85 1hue h GLU 12 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1hue h GLU 12 Cb 0.25 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.64 1hue h GLU 12 CO 0.01 0.51 0.00 -2.37 -0.73 0.00 0.00 179.01 176.43 1hue n THR 13 N -4.74 0.21 0.00 0.32 5.66 -0.35 -4.18 114.28 111.20 1hue n THR 13 Ca -0.07 -0.24 0.00 0.00 -3.05 0.00 0.00 64.05 60.70 1hue n THR 13 Cb 0.29 0.11 0.00 0.00 -1.55 0.00 0.00 70.33 69.18 1hue n THR 13 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1hue n SER 14 N -0.01 1.88 -2.58 1.09 2.88 -0.24 -5.04 113.62 111.60 1hue n SER 14 Ca 0.09 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.53 1hue n SER 14 Cb 0.17 0.13 0.05 0.00 -0.75 0.00 0.00 64.21 63.81 1hue n SER 14 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1hue n GLY 15 N 1.82 -0.31 0.00 0.46 0.00 -1.09 -5.04 105.19 101.03 1hue n GLY 15 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1hue n GLY 15 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1hue n LEU 16 N -2.69 0.00 -4.24 0.99 -0.00 -1.26 -5.10 117.00 104.71 1hue n LEU 16 Ca -0.08 0.00 -0.14 0.00 -0.00 0.00 0.00 56.01 55.79 1hue n LEU 16 Cb 0.58 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.90 1hue n LEU 16 CO 0.37 0.00 -0.39 -0.44 -0.00 0.00 0.00 177.39 176.93 1hue s SER 17 N -0.56 1.63 0.10 1.45 0.01 -1.26 -5.00 113.70 110.07 1hue s SER 17 Ca 0.00 -1.04 -0.21 0.00 1.31 0.00 0.00 55.95 56.01 1hue s SER 17 Cb 0.00 0.02 -0.10 0.00 0.21 0.00 0.00 66.02 66.15 1hue s SER 17 CO 0.00 -0.39 1.69 0.11 0.41 0.00 0.00 173.24 175.06 1hue h LYS 18 N 2.78 0.20 -0.96 12.44 1.79 -1.96 0.11 116.57 130.96 1hue h LYS 18 Ca -0.36 -0.02 0.01 0.00 -2.18 0.00 0.00 60.65 58.10 1hue h LYS 18 Cb 1.19 -0.04 -0.05 0.00 -1.58 0.00 0.00 32.23 31.75 1hue h LYS 18 CO 0.64 0.21 0.64 0.87 -1.08 0.00 0.00 179.45 180.72 1hue h LYS 19 N 0.13 1.25 -0.23 3.15 1.57 -1.98 -1.78 116.57 118.69 1hue h LYS 19 Ca 0.05 -0.08 -0.09 0.00 -1.87 0.00 0.00 60.65 58.66 1hue h LYS 19 Cb 0.07 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 1hue h LYS 19 CO -0.01 0.83 -0.25 -0.44 -0.57 0.00 0.00 179.45 179.01 1hue h ASP 20 N 1.29 0.43 -0.37 0.86 5.19 -1.89 -2.51 116.42 119.42 1hue h ASP 20 Ca 0.36 -0.14 -0.17 0.00 -0.62 0.00 0.00 57.03 56.46 1hue h ASP 20 Cb -0.13 -0.12 -0.00 0.00 0.18 0.00 0.00 39.33 39.26 1hue h ASP 20 CO -0.08 0.69 -0.42 0.00 -3.12 0.00 0.00 179.24 176.31 1hue h ALA 21 N 1.35 0.54 -0.24 3.45 0.00 -0.84 -1.90 119.26 121.62 1hue h ALA 21 Ca 0.06 -0.47 0.01 0.00 0.00 0.00 0.00 54.91 54.51 1hue h ALA 21 Cb 0.65 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1hue h ALA 21 CO 0.05 0.67 0.13 1.15 0.00 0.00 0.00 179.25 181.24 1hue h THR 22 N 0.74 1.00 0.28 0.00 2.02 -1.32 -2.47 112.91 113.17 1hue h THR 22 Ca 0.05 -0.09 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 1hue h THR 22 Cb 1.02 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 1hue h THR 22 CO 0.10 0.05 -0.26 0.11 0.37 0.00 0.00 175.52 175.89 1hue h LYS 23 N 0.26 -0.54 -0.66 6.66 1.57 -1.52 -2.81 116.57 119.54 1hue h LYS 23 Ca 0.10 0.04 0.09 0.00 -1.87 0.00 0.00 60.65 59.01 1hue h LYS 23 Cb 0.02 0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.41 1hue h LYS 23 CO -0.06 -0.36 0.44 0.00 -0.57 0.00 0.00 179.45 178.90 1hue h ALA 24 N 0.07 1.92 0.56 3.86 0.00 -1.31 -0.06 119.26 124.30 1hue h ALA 24 Ca -0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1hue h ALA 24 Cb 0.51 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1hue h ALA 24 CO -0.04 -0.06 -0.27 0.28 0.00 0.00 0.00 179.25 179.16 1hue h VAL 25 N 0.52 0.38 0.00 0.00 2.07 -1.50 -1.69 116.25 116.03 1hue h VAL 25 Ca 0.30 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.57 1hue h VAL 25 Cb 0.49 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1hue h VAL 25 CO -0.09 0.03 0.00 -0.67 0.02 0.00 0.00 177.57 176.86 1hue n ASP 26 N -5.35 2.47 0.00 0.57 2.03 -0.67 -0.96 116.55 114.63 1hue n ASP 26 Ca -0.12 -1.59 0.00 0.00 0.52 0.00 0.00 54.79 53.60 1hue n ASP 26 Cb 0.33 -0.43 0.00 0.00 -0.72 0.00 0.00 41.12 40.31 1hue n ASP 26 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1hue n ALA 27 N 0.69 2.44 -0.24 -1.67 0.00 -0.12 -4.27 120.51 117.34 1hue n ALA 27 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1hue n ALA 27 Cb 0.39 0.46 0.00 0.00 0.00 0.00 0.00 19.45 20.30 1hue n ALA 27 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1hue n VAL 28 N -2.66 0.00 0.69 0.00 0.31 -0.65 -3.29 118.33 112.74 1hue n VAL 28 Ca 0.00 1.09 0.00 0.00 -0.01 0.00 0.00 64.34 65.42 1hue n VAL 28 Cb 0.46 -2.02 0.00 0.00 -0.91 0.00 0.00 33.84 31.37 1hue n VAL 28 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1hue n PHE 29 N -1.64 0.00 -0.05 3.52 3.72 -0.14 -2.10 117.46 120.77 1hue n PHE 29 Ca 0.00 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.29 1hue n PHE 29 Cb 0.00 -0.06 -0.04 0.00 -0.94 0.00 0.00 39.48 38.44 1hue n PHE 29 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1hue n ASP 30 N 0.11 1.30 0.24 4.37 -0.08 -1.26 -4.48 116.55 116.75 1hue n ASP 30 Ca 0.00 0.09 0.07 0.00 -1.51 0.00 0.00 54.79 53.44 1hue n ASP 30 Cb 0.14 -0.29 0.57 0.00 2.34 0.00 0.00 41.12 43.88 1hue n ASP 30 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1hue h SER 31 N -0.31 0.00 0.58 1.67 0.02 -1.47 -2.25 113.55 111.79 1hue h SER 31 Ca -0.27 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.65 1hue h SER 31 Cb 1.27 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.81 1hue h SER 31 CO -0.14 0.12 -0.28 0.40 -1.14 0.00 0.00 176.83 175.79 1hue h ILE 32 N 0.00 0.00 -0.28 3.27 2.04 -1.70 -0.80 117.51 120.04 1hue h ILE 32 Ca -0.00 -0.39 0.08 0.00 1.00 0.00 0.00 64.86 65.55 1hue h ILE 32 Cb 0.22 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.28 1hue h ILE 32 CO 0.02 0.00 0.23 0.00 0.00 0.00 0.00 178.15 178.40 1hue h THR 33 N -1.18 0.69 -0.26 -0.27 1.03 -1.78 0.16 112.91 111.30 1hue h THR 33 Ca -0.08 0.00 -0.13 0.00 -0.01 0.00 0.00 66.41 66.19 1hue h THR 33 Cb 0.60 0.83 -0.01 0.00 -1.07 0.00 0.00 68.15 68.50 1hue h THR 33 CO 0.13 0.00 -0.39 -0.33 -0.01 0.00 0.00 175.52 174.92 1hue h GLU 34 N 0.00 0.61 0.77 0.00 5.08 -1.41 -0.37 114.58 119.26 1hue h GLU 34 Ca 0.13 -0.31 -0.03 0.00 -1.00 0.00 0.00 59.36 58.15 1hue h GLU 34 Cb 0.59 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1hue h GLU 34 CO -0.00 0.90 -0.50 0.00 -1.00 0.00 0.00 179.01 178.41 1hue h ALA 35 N 1.06 -1.26 -0.11 3.43 0.00 0.75 -2.44 119.26 120.68 1hue h ALA 35 Ca 0.04 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1hue h ALA 35 Cb 0.90 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1hue h ALA 35 CO 0.08 -1.23 0.05 -0.07 0.00 0.00 0.00 179.25 178.08 1hue h LEU 36 N -1.20 0.15 -1.70 0.00 3.38 -0.99 0.12 115.31 115.07 1hue h LEU 36 Ca -0.10 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 1hue h LEU 36 Cb 0.97 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 1hue h LEU 36 CO 0.09 0.23 -0.09 0.08 0.09 0.00 0.00 178.44 178.84 1hue h ARG 37 N 0.06 0.08 -0.01 1.13 0.11 -1.19 -3.08 114.38 111.48 1hue h ARG 37 Ca 0.04 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.11 1hue h ARG 37 Cb 0.12 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.18 1hue h ARG 37 CO -0.00 0.17 -0.12 1.17 0.10 0.00 0.00 179.97 181.29 1hue n LYS 38 N -4.39 1.19 -2.25 0.08 4.81 -0.92 -4.98 118.16 111.71 1hue n LYS 38 Ca -0.02 -0.65 -0.01 0.00 -0.87 0.00 0.00 58.31 56.76 1hue n LYS 38 Cb 0.19 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 33.76 1hue n LYS 38 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1hue n GLY 39 N 1.25 0.58 3.04 3.14 0.00 -0.90 -5.07 105.19 107.23 1hue n GLY 39 Ca 0.16 -0.52 -0.20 0.00 0.00 0.00 0.00 46.02 45.46 1hue n GLY 39 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1hue s ASP 40 N -3.05 1.26 0.33 1.61 1.11 0.38 -5.02 116.67 113.29 1hue s ASP 40 Ca 0.01 -0.19 -0.21 0.00 0.18 0.00 0.00 52.55 52.34 1hue s ASP 40 Cb -0.00 -0.18 -0.10 0.00 1.07 0.00 0.00 42.92 43.71 1hue s ASP 40 CO 0.04 0.12 0.86 -0.54 1.18 0.00 0.00 175.17 176.83 1hue s LYS 41 N -0.16 4.30 0.00 8.23 1.02 -1.26 -3.60 119.74 128.27 1hue s LYS 41 Ca 0.03 1.04 0.00 0.00 0.02 0.00 0.00 55.97 57.06 1hue s LYS 41 Cb -0.05 -2.56 0.00 0.00 -0.52 0.00 0.00 37.83 34.70 1hue s LYS 41 CO -0.00 0.19 0.00 0.28 -0.92 0.00 0.00 175.35 174.89 1hue n VAL 42 N 0.05 0.00 0.00 3.17 0.31 -0.97 -5.03 118.33 115.86 1hue n VAL 42 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 1hue n VAL 42 Cb 0.52 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.45 1hue n VAL 42 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1hue n GLN 43 N 0.00 0.00 -3.40 5.55 6.02 -1.26 -4.89 117.38 119.40 1hue n GLN 43 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.86 1hue n GLN 43 Cb 0.00 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.16 1hue n GLN 43 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1hue s LEU 44 N 0.00 -0.42 0.22 1.08 1.43 -0.59 -4.95 118.68 115.45 1hue s LEU 44 Ca 0.00 -0.16 -0.30 0.00 -1.03 0.00 0.00 54.13 52.64 1hue s LEU 44 Cb 0.00 0.78 -0.09 0.00 0.03 0.00 0.00 46.19 46.91 1hue s LEU 44 CO 0.00 -0.33 1.21 -0.51 0.23 0.00 0.00 176.35 176.95 1hue s ILE 45 N 2.44 3.40 -2.04 -0.59 2.07 -1.26 -1.55 121.20 123.68 1hue s ILE 45 Ca 0.10 1.23 0.00 0.00 -1.41 0.00 0.00 60.65 60.57 1hue s ILE 45 Cb -0.15 -3.79 0.00 0.00 0.13 0.00 0.00 42.46 38.65 1hue s ILE 45 CO -0.20 0.22 0.00 0.61 -1.91 0.00 0.00 174.94 173.67 1hue n GLY 46 N 1.90 1.64 0.32 1.50 0.00 -1.26 -4.74 105.19 104.54 1hue n GLY 46 Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1hue n GLY 46 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1hue n PHE 47 N -2.60 -0.31 -3.73 1.61 7.35 -1.19 -3.98 117.46 114.61 1hue n PHE 47 Ca -0.20 0.00 -0.00 0.00 -0.76 0.00 0.00 57.45 56.49 1hue n PHE 47 Cb 0.65 0.08 -0.00 0.00 0.35 0.00 0.00 39.48 40.55 1hue n PHE 47 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1hue s GLY 48 N -1.65 -0.26 -0.29 7.13 0.00 -0.60 -2.77 107.32 108.89 1hue s GLY 48 Ca 0.00 0.32 0.03 0.00 0.00 0.00 0.00 44.72 45.07 1hue s GLY 48 CO 0.00 0.90 0.55 0.21 0.00 0.00 0.00 173.10 174.75 1hue s ASN 49 N -3.10 -1.12 0.18 1.64 2.47 -1.15 -1.54 114.94 112.32 1hue s ASN 49 Ca 0.16 0.29 -0.16 0.00 0.42 0.00 0.00 52.86 53.57 1hue s ASN 49 Cb 0.01 1.86 -0.07 0.00 -1.45 0.00 0.00 41.25 41.60 1hue s ASN 49 CO -0.00 -0.30 0.62 -0.36 -3.72 0.00 0.00 177.10 173.34 1hue s PHE 50 N 2.77 3.62 0.09 0.43 0.40 -1.26 -1.88 117.98 122.14 1hue s PHE 50 Ca 0.13 1.19 -0.23 0.00 -0.60 0.00 0.00 56.93 57.41 1hue s PHE 50 Cb -0.12 -2.46 0.06 0.00 0.51 0.00 0.00 43.02 41.00 1hue s PHE 50 CO -0.25 0.39 0.57 -1.83 0.70 0.00 0.00 175.22 174.80 1hue s GLU 51 N -1.98 1.15 0.64 0.44 4.04 -1.05 -2.30 118.70 119.64 1hue s GLU 51 Ca 0.40 -0.31 -0.07 0.00 0.04 0.00 0.00 54.97 55.03 1hue s GLU 51 Cb -0.16 0.53 0.02 0.00 0.02 0.00 0.00 34.13 34.54 1hue s GLU 51 CO 0.20 -0.45 0.96 0.54 -1.84 0.00 0.00 175.26 174.66 1hue s VAL 52 N -2.96 3.27 -0.27 1.83 0.11 -1.26 -1.58 120.40 119.53 1hue s VAL 52 Ca -0.03 -0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.01 1hue s VAL 52 Cb -0.00 -3.34 0.09 0.00 -1.53 0.00 0.00 36.38 31.59 1hue s VAL 52 CO -0.06 -0.37 0.07 -0.60 -3.33 0.00 0.00 175.10 170.82 1hue s ARG 53 N -5.11 0.69 -0.60 1.54 6.06 -0.30 -4.73 118.95 116.50 1hue s ARG 53 Ca 0.56 -0.82 -0.26 0.00 -2.50 0.00 0.00 55.73 52.71 1hue s ARG 53 Cb -0.11 -1.98 -0.03 0.00 0.06 0.00 0.00 34.95 32.89 1hue s ARG 53 CO 0.46 -0.87 1.99 -2.00 -2.50 0.00 0.00 175.30 172.38 1hue s GLU 54 N 1.73 2.50 0.45 5.12 2.12 -1.26 -1.25 118.70 128.11 1hue s GLU 54 Ca 0.06 0.74 -0.21 0.00 0.36 0.00 0.00 54.97 55.91 1hue s GLU 54 Cb -0.17 -4.46 -0.09 0.00 0.26 0.00 0.00 34.13 29.66 1hue s GLU 54 CO -0.20 -2.90 1.02 0.50 -0.54 0.00 0.00 175.26 173.14 1hue s ARG 55 N 7.33 3.98 -0.47 4.30 3.52 -0.81 -5.02 118.95 131.79 1hue s ARG 55 Ca 0.74 1.33 -0.15 0.00 -0.13 0.00 0.00 55.73 57.52 1hue s ARG 55 Cb -0.13 -2.21 0.07 0.00 -1.56 0.00 0.00 34.95 31.12 1hue s ARG 55 CO 0.21 -0.27 0.38 0.00 -0.81 0.00 0.00 175.30 174.81 1hue s ALA 56 N -1.96 3.54 0.03 6.12 0.00 -1.26 -4.52 121.76 123.70 1hue s ALA 56 Ca 0.64 -2.12 -0.24 0.00 0.00 0.00 0.00 51.96 50.24 1hue s ALA 56 Cb -0.16 -3.03 -0.13 0.00 0.00 0.00 0.00 23.12 19.80 1hue s ALA 56 CO 0.20 -1.72 0.62 0.00 0.00 0.00 0.00 175.76 174.85 1hue n ALA 57 N 5.18 -2.49 -2.31 0.00 0.00 -1.26 -4.94 120.51 114.68 1hue n ALA 57 Ca -0.12 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1hue n ALA 57 Cb 0.44 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.76 1hue n ALA 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1hue n ARG 58 N 0.91 2.71 -3.67 0.00 5.12 -0.37 -4.92 116.66 116.43 1hue n ARG 58 Ca 0.13 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.96 1hue n ARG 58 Cb 0.08 0.00 -0.09 0.00 -1.16 0.00 0.00 32.46 31.28 1hue n ARG 58 CO 0.00 0.00 0.00 -1.59 -1.93 0.00 0.00 177.63 174.11 1hue s LYS 59 N 1.82 0.46 -0.71 5.56 -2.85 -1.26 -1.59 119.74 121.16 1hue s LYS 59 Ca 0.00 0.97 0.05 0.00 -1.00 0.00 0.00 55.97 55.99 1hue s LYS 59 Cb 0.00 0.13 0.19 0.00 -2.06 0.00 0.00 37.83 36.09 1hue s LYS 59 CO 0.00 -0.18 0.57 0.41 0.10 0.00 0.00 175.35 176.25 1hue n GLY 60 N 4.56 4.19 3.97 0.59 0.00 -0.80 -4.91 105.19 112.78 1hue n GLY 60 Ca -0.19 -2.63 -0.21 0.00 0.00 0.00 0.00 46.02 42.99 1hue n GLY 60 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1hue s ARG 61 N -1.66 3.42 0.57 1.61 3.52 -1.25 -3.99 118.95 121.17 1hue s ARG 61 Ca 0.28 -0.77 0.29 0.00 -0.13 0.00 0.00 55.73 55.39 1hue s ARG 61 Cb -0.01 -2.88 1.48 0.00 -1.56 0.00 0.00 34.95 31.98 1hue s ARG 61 CO -0.14 0.42 1.93 -2.95 -0.81 0.00 0.00 175.30 173.75 1hue h ASN 62 N 1.17 0.00 -0.93 -2.12 -1.07 -1.80 -2.63 115.58 108.19 1hue h ASN 62 Ca -0.52 0.00 0.14 0.00 0.07 0.00 0.00 56.30 56.00 1hue h ASN 62 Cb 1.23 0.00 -0.09 0.00 -2.07 0.00 0.00 38.32 37.39 1hue h ASN 62 CO 0.61 0.00 0.55 1.55 0.07 0.00 0.00 177.43 180.20 1hue h PRO 63 N 0.00 0.77 0.00 4.14 0.13 -1.95 -2.75 132.00 132.35 1hue h PRO 63 Ca 0.25 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 65.29 1hue h PRO 63 Cb 1.19 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 32.14 1hue h PRO 63 CO -0.00 0.51 -0.60 0.37 -0.23 0.00 0.00 178.00 178.05 1hue h GLN 64 N 0.79 0.00 0.00 0.86 5.75 -1.95 -3.45 115.11 117.11 1hue h GLN 64 Ca 0.50 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.98 1hue h GLN 64 Cb 0.63 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.18 1hue h GLN 64 CO -0.32 0.19 -1.45 0.25 -2.65 0.00 0.00 178.83 174.84 1hue n THR 65 N -4.60 0.40 0.00 2.39 -2.24 -1.00 -5.02 114.28 104.20 1hue n THR 65 Ca -0.11 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.13 1hue n THR 65 Cb 0.32 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 1hue n THR 65 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hue n GLY 66 N 1.23 2.77 3.16 3.38 0.00 -1.04 -4.94 105.19 109.75 1hue n GLY 66 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 1hue n GLY 66 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1hue s GLU 67 N -0.56 2.93 -0.61 1.61 2.12 -1.26 -4.74 118.70 118.19 1hue s GLU 67 Ca 0.00 -0.82 -0.22 0.00 0.36 0.00 0.00 54.97 54.29 1hue s GLU 67 Cb 0.00 -2.38 0.06 0.00 0.26 0.00 0.00 34.13 32.07 1hue s GLU 67 CO 0.00 -0.03 0.90 -2.00 -0.54 0.00 0.00 175.26 173.59 1hue s GLU 68 N 0.86 3.16 0.06 4.30 2.12 -1.26 -2.70 118.70 125.24 1hue s GLU 68 Ca -0.06 -0.73 -0.23 0.00 0.36 0.00 0.00 54.97 54.31 1hue s GLU 68 Cb -0.15 -4.17 0.06 0.00 0.26 0.00 0.00 34.13 30.13 1hue s GLU 68 CO -0.03 -1.64 0.56 0.00 -0.54 0.00 0.00 175.26 173.62 1hue s MET 69 N 3.76 1.10 -0.23 4.30 0.23 -1.26 -4.95 119.30 122.25 1hue s MET 69 Ca 0.23 -0.24 -0.14 0.00 -1.03 0.00 0.00 55.69 54.51 1hue s MET 69 Cb -0.17 0.50 -0.04 0.00 -1.53 0.00 0.00 34.83 33.60 1hue s MET 69 CO 0.12 -0.41 0.30 -2.00 -2.03 0.00 0.00 175.02 171.00 1hue s GLU 70 N -2.64 4.11 -0.33 3.16 2.12 -1.26 -1.91 118.70 121.94 1hue s GLU 70 Ca -0.04 -0.01 -0.27 0.00 0.36 0.00 0.00 54.97 55.01 1hue s GLU 70 Cb -0.00 -3.55 0.01 0.00 0.26 0.00 0.00 34.13 30.84 1hue s GLU 70 CO -0.03 -0.03 0.95 0.42 -0.54 0.00 0.00 175.26 176.03 1hue s ILE 71 N 1.31 4.61 0.85 -3.70 1.01 -0.62 -4.93 121.20 119.72 1hue s ILE 71 Ca 0.14 1.42 -0.11 0.00 0.00 0.00 0.00 60.65 62.10 1hue s ILE 71 Cb -0.14 -4.32 0.10 0.00 0.01 0.00 0.00 42.46 38.11 1hue s ILE 71 CO 0.07 -0.44 1.09 -2.16 0.00 0.00 0.00 174.94 173.50 1hue s PRO 72 N 3.42 1.66 0.89 2.79 0.04 -1.26 -1.24 135.00 141.29 1hue s PRO 72 Ca 0.40 0.89 -0.11 0.00 0.04 0.00 0.00 61.00 62.22 1hue s PRO 72 Cb -0.13 -1.85 0.12 0.00 0.04 0.00 0.00 34.50 32.69 1hue s PRO 72 CO 0.16 -1.98 1.09 0.00 0.04 0.00 0.00 177.00 176.31 1hue s ALA 73 N -2.96 1.56 0.06 8.56 0.00 -1.26 -4.75 121.76 122.97 1hue s ALA 73 Ca 0.62 0.05 -0.12 0.00 0.00 0.00 0.00 51.96 52.51 1hue s ALA 73 Cb -0.17 -3.23 0.01 0.00 0.00 0.00 0.00 23.12 19.73 1hue s ALA 73 CO 0.56 -2.36 0.26 -1.12 0.00 0.00 0.00 175.76 173.11 1hue s SER 74 N -3.31 -0.05 -0.50 0.00 0.01 -1.26 -5.00 113.70 103.60 1hue s SER 74 Ca 0.63 -0.33 -0.23 0.00 1.31 0.00 0.00 55.95 57.33 1hue s SER 74 Cb -0.19 0.35 0.04 0.00 0.21 0.00 0.00 66.02 66.43 1hue s SER 74 CO 0.57 -0.64 0.83 -0.54 0.41 0.00 0.00 173.24 173.87 1hue s LYS 75 N -2.92 3.34 -0.37 12.44 1.02 -1.26 -1.92 119.74 130.08 1hue s LYS 75 Ca -0.02 -0.28 -0.18 0.00 0.02 0.00 0.00 55.97 55.51 1hue s LYS 75 Cb 0.00 -4.01 0.00 0.00 -0.52 0.00 0.00 37.83 33.31 1hue s LYS 75 CO -0.06 -1.29 0.52 0.14 -0.92 0.00 0.00 175.35 173.74 1hue s VAL 76 N 3.49 5.00 0.07 3.17 -7.23 -0.38 -4.51 120.40 120.01 1hue s VAL 76 Ca 0.28 0.25 -0.30 0.00 -1.81 0.00 0.00 61.98 60.40 1hue s VAL 76 Cb -0.13 -4.00 -0.05 0.00 0.56 0.00 0.00 36.38 32.76 1hue s VAL 76 CO 0.20 -0.29 0.97 -2.16 -0.31 0.00 0.00 175.10 173.51 1hue s PRO 77 N 2.43 4.65 0.22 4.82 0.04 -1.26 -1.15 135.00 144.75 1hue s PRO 77 Ca 0.19 1.44 0.05 0.00 0.04 0.00 0.00 61.00 62.72 1hue s PRO 77 Cb -0.15 -3.40 -0.05 0.00 0.04 0.00 0.00 34.50 30.93 1hue s PRO 77 CO 0.14 0.12 -0.07 0.00 0.04 0.00 0.00 177.00 177.24 1hue s ALA 78 N 0.33 1.90 -0.06 8.56 0.00 -0.61 -5.02 121.76 126.86 1hue s ALA 78 Ca 0.49 -1.72 -0.02 0.00 0.00 0.00 0.00 51.96 50.71 1hue s ALA 78 Cb -0.23 0.20 0.04 0.00 0.00 0.00 0.00 23.12 23.14 1hue s ALA 78 CO 0.29 -0.11 0.11 0.12 0.00 0.00 0.00 175.76 176.18 1hue s PHE 79 N -3.21 -0.10 0.14 0.00 2.19 -1.26 -2.52 117.98 113.22 1hue s PHE 79 Ca 0.25 0.41 -0.18 0.00 0.33 0.00 0.00 56.93 57.74 1hue s PHE 79 Cb 0.03 -0.22 -0.07 0.00 -1.31 0.00 0.00 43.02 41.45 1hue s PHE 79 CO 0.07 -0.18 0.61 0.15 1.83 0.00 0.00 175.22 177.70 1hue s LYS 80 N 1.59 4.14 -0.01 10.12 1.02 -0.79 -4.95 119.74 130.86 1hue s LYS 80 Ca -0.04 0.69 0.00 0.00 0.02 0.00 0.00 55.97 56.64 1hue s LYS 80 Cb -0.12 -3.03 0.01 0.00 -0.52 0.00 0.00 37.83 34.17 1hue s LYS 80 CO -0.05 0.51 1.16 -0.35 -0.92 0.00 0.00 175.35 175.71 1hue n PRO 81 N 1.10 1.02 -0.63 -1.68 -0.04 -1.26 -2.93 135.00 130.58 1hue n PRO 81 Ca -0.06 -0.05 -0.02 0.00 -0.04 0.00 0.00 63.50 63.32 1hue n PRO 81 Cb 0.51 -1.02 -0.01 0.00 -0.04 0.00 0.00 33.50 32.94 1hue n PRO 81 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1hue n GLY 82 N 0.62 0.23 5.00 0.55 0.00 -1.12 -1.87 105.19 108.60 1hue n GLY 82 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1hue n GLY 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1hue n LYS 83 N -0.35 0.00 -0.24 1.61 5.02 -1.26 -4.64 118.16 118.31 1hue n LYS 83 Ca -0.02 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.31 1hue n LYS 83 Cb 0.17 0.00 0.16 0.00 -0.02 0.00 0.00 35.03 35.34 1hue n LYS 83 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1hue h ALA 84 N 0.00 0.90 -0.12 7.82 0.00 -1.87 -2.32 119.26 123.67 1hue h ALA 84 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1hue h ALA 84 Cb 0.00 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1hue h ALA 84 CO 0.00 -0.31 0.07 1.25 0.00 0.00 0.00 179.25 180.26 1hue h LEU 85 N 0.29 0.12 -1.02 0.00 5.85 -1.50 -2.61 115.31 116.44 1hue h LEU 85 Ca 0.39 -0.00 0.33 0.00 0.84 0.00 0.00 57.88 59.44 1hue h LEU 85 Cb 0.63 -0.03 -0.15 0.00 0.37 0.00 0.00 40.66 41.49 1hue h LEU 85 CO -0.47 0.09 0.58 0.50 -0.34 0.00 0.00 178.44 178.81 1hue h LYS 86 N 0.15 0.30 -0.82 1.25 3.11 -1.54 0.11 116.57 119.14 1hue h LYS 86 Ca 0.05 -0.02 -0.04 0.00 -2.81 0.00 0.00 60.65 57.83 1hue h LYS 86 Cb -0.01 -0.07 -0.04 0.00 -1.00 0.00 0.00 32.23 31.12 1hue h LYS 86 CO -0.02 0.20 0.37 0.22 -2.81 0.00 0.00 179.45 177.41 1hue h ASP 87 N 0.31 1.09 -0.83 4.20 3.58 -1.24 -0.63 116.42 122.90 1hue h ASP 87 Ca 0.74 -0.15 0.14 0.00 0.42 0.00 0.00 57.03 58.18 1hue h ASP 87 Cb 1.73 -0.28 -0.09 0.00 1.72 0.00 0.00 39.33 42.40 1hue h ASP 87 CO -0.60 0.94 0.43 0.00 -2.88 0.00 0.00 179.24 177.12 1hue h ALA 88 N 1.20 1.24 0.00 -0.78 0.00 -0.72 -3.35 119.26 116.85 1hue h ALA 88 Ca 0.28 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 1hue h ALA 88 Cb 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1hue h ALA 88 CO -0.03 -0.08 -0.20 1.55 0.00 0.00 0.00 179.25 180.49 1hue n VAL 89 N -4.87 1.80 1.29 0.00 3.14 -1.08 -5.14 118.33 113.47 1hue n VAL 89 Ca 0.16 -2.36 0.10 0.00 -2.96 0.00 0.00 64.34 59.29 1hue n VAL 89 Cb 0.41 -0.16 0.61 0.00 -1.06 0.00 0.00 33.84 33.64 1hue n VAL 89 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66