#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 -0.13 0.00 7.83 6.94 -1.26 0.00 115.26 128.64 1hue n ASN 2 Ca 0.00 -0.02 0.00 0.00 -0.02 0.00 0.00 54.58 54.54 1hue n ASN 2 Cb 0.00 -0.12 0.00 0.00 -2.36 0.00 0.00 39.78 37.30 1hue n ASN 2 CO 0.00 0.00 0.00 1.17 -1.03 0.00 0.00 177.26 177.40 1hue n LYS 3 N -0.49 0.00 0.00 -3.83 4.81 -1.26 -4.69 118.16 112.70 1hue n LYS 3 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1hue n LYS 3 Cb 0.05 -4.44 0.00 0.00 0.02 0.00 0.00 35.03 30.65 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 -2.00 0.00 0.25 3.15 -1.04 -0.09 -4.17 114.28 110.38 1hue n THR 4 Ca 0.00 0.00 0.16 0.00 -2.04 0.00 0.00 64.05 62.17 1hue n THR 4 Cb 0.00 -1.17 0.85 0.00 -1.82 0.00 0.00 70.33 68.18 1hue n THR 4 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1hue h GLU 5 N 0.00 0.00 0.53 -2.82 4.39 -0.70 -2.04 114.58 113.94 1hue h GLU 5 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 1hue h GLU 5 Cb 1.00 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.65 1hue h GLU 5 CO 0.00 0.00 -0.25 1.25 -1.16 0.00 0.00 179.01 178.85 1hue h LEU 6 N 0.00 -0.60 -0.65 1.33 6.46 -1.04 -3.07 115.31 117.74 1hue h LEU 6 Ca 0.00 0.01 0.14 0.00 -0.12 0.00 0.00 57.88 57.91 1hue h LEU 6 Cb 0.05 0.15 -0.10 0.00 -0.73 0.00 0.00 40.66 40.03 1hue h LEU 6 CO 0.00 -0.42 0.06 0.40 -0.62 0.00 0.00 178.44 177.87 1hue h ILE 7 N -0.72 0.52 0.00 4.05 2.04 -1.53 -0.84 117.51 121.02 1hue h ILE 7 Ca -0.07 -0.06 -0.04 0.00 1.00 0.00 0.00 64.86 65.69 1hue h ILE 7 Cb 0.55 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1hue h ILE 7 CO 0.12 0.03 -0.17 0.78 0.00 0.00 0.00 178.15 178.91 1hue h ASN 8 N 0.17 0.00 -0.30 1.72 2.35 -1.61 -2.34 115.58 115.57 1hue h ASN 8 Ca 0.35 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 56.05 1hue h ASN 8 Cb 0.57 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 1hue h ASN 8 CO -0.51 0.17 0.02 0.00 -1.65 0.00 0.00 177.43 175.46 1hue h ALA 9 N 1.83 0.41 0.13 -0.83 0.00 -1.06 -2.78 119.26 116.96 1hue h ALA 9 Ca -0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1hue h ALA 9 Cb 0.39 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1hue h ALA 9 CO 0.02 0.14 -0.06 0.28 0.00 0.00 0.00 179.25 179.63 1hue h VAL 10 N 0.33 1.05 0.00 0.00 2.07 -1.37 -0.92 116.25 117.41 1hue h VAL 10 Ca 0.09 -0.85 -0.03 0.00 0.82 0.00 0.00 66.70 66.74 1hue h VAL 10 Cb 0.40 1.57 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 1hue h VAL 10 CO 0.01 0.20 -0.12 0.00 0.02 0.00 0.00 177.57 177.68 1hue h ALA 11 N 0.21 1.22 0.00 1.67 0.00 -1.58 -1.92 119.26 118.86 1hue h ALA 11 Ca -0.02 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1hue h ALA 11 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1hue h ALA 11 CO 0.03 0.15 -0.00 1.49 0.00 0.00 0.00 179.25 180.92 1hue h GLU 12 N 0.00 -0.00 0.00 0.00 4.81 -1.41 -2.79 114.58 115.19 1hue h GLU 12 Ca -0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1hue h GLU 12 Cb 0.38 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.76 1hue h GLU 12 CO 0.02 0.86 -0.05 1.79 -0.73 0.00 0.00 179.01 180.90 1hue h THR 13 N -0.88 0.16 0.00 0.32 1.35 -1.11 -3.37 112.91 109.38 1hue h THR 13 Ca -0.00 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 1hue h THR 13 Cb 0.87 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 1hue h THR 13 CO 0.00 0.05 -0.88 -0.24 -0.25 0.00 0.00 175.52 174.20 1hue n SER 14 N -3.21 4.42 -2.75 5.36 2.88 -0.73 -5.09 113.62 114.50 1hue n SER 14 Ca -0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 1hue n SER 14 Cb 0.28 0.57 0.06 0.00 -0.75 0.00 0.00 64.21 64.36 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 2.57 -0.28 0.00 0.46 0.00 -1.05 -5.05 105.19 101.84 1hue n GLY 15 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -3.09 0.00 -4.20 0.99 -0.00 -1.26 -5.10 117.00 104.34 1hue n LEU 16 Ca -0.16 0.00 -0.13 0.00 -0.00 0.00 0.00 56.01 55.72 1hue n LEU 16 Cb 0.61 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.93 1hue n LEU 16 CO 0.43 0.00 -0.41 -0.44 -0.00 0.00 0.00 177.39 176.98 1hue s SER 17 N -1.00 1.51 0.16 1.45 0.01 -1.26 -5.00 113.70 109.57 1hue s SER 17 Ca 0.00 -0.93 -0.14 0.00 1.31 0.00 0.00 55.95 56.19 1hue s SER 17 Cb 0.00 0.02 0.05 0.00 0.21 0.00 0.00 66.02 66.30 1hue s SER 17 CO 0.00 -0.34 1.76 0.11 0.41 0.00 0.00 173.24 175.19 1hue h LYS 18 N 3.13 0.73 -0.93 12.44 1.79 -1.96 0.76 116.57 132.53 1hue h LYS 18 Ca -0.37 -0.09 -0.01 0.00 -2.18 0.00 0.00 60.65 58.00 1hue h LYS 18 Cb 1.18 -0.14 -0.04 0.00 -1.58 0.00 0.00 32.23 31.65 1hue h LYS 18 CO 0.60 0.58 0.53 0.87 -1.08 0.00 0.00 179.45 180.95 1hue h LYS 19 N 0.69 1.28 -0.13 3.15 1.79 -1.98 -2.11 116.57 119.27 1hue h LYS 19 Ca 0.18 -0.13 -0.11 0.00 -2.18 0.00 0.00 60.65 58.41 1hue h LYS 19 Cb 0.07 -0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 30.45 1hue h LYS 19 CO -0.03 0.91 -0.40 -0.44 -1.08 0.00 0.00 179.45 178.42 1hue h ASP 20 N 1.29 0.31 -0.06 0.86 3.32 -1.88 -2.98 116.42 117.28 1hue h ASP 20 Ca 0.33 -0.13 -0.16 0.00 0.02 0.00 0.00 57.03 57.09 1hue h ASP 20 Cb -0.01 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1hue h ASP 20 CO -0.06 0.69 -0.49 0.00 -1.72 0.00 0.00 179.24 177.65 1hue h ALA 21 N 1.33 0.70 -0.01 3.45 0.00 -0.74 -1.62 119.26 122.37 1hue h ALA 21 Ca 0.02 -0.49 0.01 0.00 0.00 0.00 0.00 54.91 54.45 1hue h ALA 21 Cb 0.82 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1hue h ALA 21 CO 0.07 0.68 -0.04 1.15 0.00 0.00 0.00 179.25 181.10 1hue h THR 22 N 0.49 0.90 0.35 0.00 2.02 -1.41 -2.45 112.91 112.81 1hue h THR 22 Ca 0.02 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.20 1hue h THR 22 Cb 1.04 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 68.34 1hue h THR 22 CO 0.10 0.00 -0.29 0.11 0.37 0.00 0.00 175.52 175.81 1hue h LYS 23 N -0.06 -0.63 -0.84 6.66 1.57 -1.59 -2.96 116.57 118.73 1hue h LYS 23 Ca 0.02 0.04 0.13 0.00 -1.87 0.00 0.00 60.65 58.97 1hue h LYS 23 Cb 0.08 0.14 -0.06 0.00 0.08 0.00 0.00 32.23 32.48 1hue h LYS 23 CO -0.04 -0.42 0.54 0.00 -0.57 0.00 0.00 179.45 178.96 1hue h ALA 24 N -0.10 1.88 0.95 3.86 0.00 -1.30 -0.63 119.26 123.91 1hue h ALA 24 Ca -0.02 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1hue h ALA 24 Cb 0.57 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.25 1hue h ALA 24 CO -0.03 -0.09 -0.48 0.28 0.00 0.00 0.00 179.25 178.94 1hue h VAL 25 N 0.64 0.03 0.00 0.00 2.07 -1.49 -1.99 116.25 115.52 1hue h VAL 25 Ca 0.41 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.93 1hue h VAL 25 Cb 0.68 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1hue h VAL 25 CO -0.17 0.00 0.00 0.47 0.02 0.00 0.00 177.57 177.89 1hue n ASP 26 N -5.65 3.55 0.01 0.57 8.00 -0.57 -1.35 116.55 121.10 1hue n ASP 26 Ca -0.16 -1.95 0.00 0.00 0.71 0.00 0.00 54.79 53.39 1hue n ASP 26 Cb 0.52 -0.69 0.00 0.00 -0.02 0.00 0.00 41.12 40.92 1hue n ASP 26 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1hue n ALA 27 N 1.09 3.00 0.33 2.24 0.00 -0.35 -4.21 120.51 122.61 1hue n ALA 27 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1hue n ALA 27 Cb 0.42 0.40 -0.06 0.00 0.00 0.00 0.00 19.45 20.21 1hue n ALA 27 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1hue h VAL 28 N 0.00 0.00 0.00 0.00 2.07 -1.16 -3.02 116.25 114.14 1hue h VAL 28 Ca 0.00 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 1hue h VAL 28 Cb 0.72 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1hue h VAL 28 CO 0.00 0.00 -0.12 -0.26 0.02 0.00 0.00 177.57 177.21 1hue h PHE 29 N -0.95 0.00 -0.12 1.57 0.04 -1.48 -1.53 116.94 114.47 1hue h PHE 29 Ca -0.09 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.66 1hue h PHE 29 Cb 0.66 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.81 1hue h PHE 29 CO 0.06 0.12 -0.02 0.22 -0.60 0.00 0.00 178.31 178.08 1hue h ASP 30 N 0.00 0.23 0.43 2.17 1.82 -1.73 -2.67 116.42 116.67 1hue h ASP 30 Ca -0.00 -0.35 -0.09 0.00 -0.39 0.00 0.00 57.03 56.20 1hue h ASP 30 Cb 0.34 -0.06 -0.01 0.00 0.68 0.00 0.00 39.33 40.27 1hue h ASP 30 CO 0.01 0.53 -0.42 0.28 -1.61 0.00 0.00 179.24 178.03 1hue h SER 31 N -0.07 0.00 0.23 2.28 0.02 -1.32 -1.00 113.55 113.69 1hue h SER 31 Ca 0.03 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 1hue h SER 31 Cb 0.42 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.96 1hue h SER 31 CO 0.01 0.42 -0.13 0.40 -1.14 0.00 0.00 176.83 176.39 1hue h ILE 32 N 0.00 0.73 0.00 3.27 5.03 -1.37 -1.46 117.51 123.71 1hue h ILE 32 Ca -0.00 0.00 -0.00 0.00 -0.12 0.00 0.00 64.86 64.73 1hue h ILE 32 Cb 0.75 0.73 -0.00 0.00 -3.03 0.00 0.00 36.82 35.27 1hue h ILE 32 CO 0.05 0.00 -0.01 0.71 -0.68 0.00 0.00 178.15 178.23 1hue h THR 33 N -0.34 0.05 0.00 -0.27 1.35 -1.08 0.76 112.91 113.38 1hue h THR 33 Ca -0.03 -0.14 -0.05 0.00 -0.55 0.00 0.00 66.41 65.64 1hue h THR 33 Cb 0.27 1.13 -0.01 0.00 -1.73 0.00 0.00 68.15 67.82 1hue h THR 33 CO 0.04 0.01 -0.37 -0.33 -0.25 0.00 0.00 175.52 174.62 1hue h GLU 34 N 0.00 0.00 0.03 4.72 3.07 -1.11 -2.39 114.58 118.90 1hue h GLU 34 Ca -0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1hue h GLU 34 Cb 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 1hue h GLU 34 CO 0.00 0.20 -0.01 0.00 -1.40 0.00 0.00 179.01 177.80 1hue h ALA 35 N 1.78 -0.41 -0.48 3.43 0.00 0.12 -3.18 119.26 120.53 1hue h ALA 35 Ca -0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1hue h ALA 35 Cb 1.18 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1hue h ALA 35 CO 0.03 -0.40 0.21 -0.07 0.00 0.00 0.00 179.25 179.01 1hue h LEU 36 N -0.08 0.65 -1.47 0.00 -0.00 -0.95 0.11 115.31 113.56 1hue h LEU 36 Ca -0.00 -0.15 -0.06 0.00 -0.00 0.00 0.00 57.88 57.67 1hue h LEU 36 Cb 0.03 -0.17 -0.01 0.00 -0.00 0.00 0.00 40.66 40.51 1hue h LEU 36 CO 0.01 0.62 -0.27 -0.09 -0.00 0.00 0.00 178.44 178.71 1hue h ARG 37 N 0.63 0.00 -0.63 1.13 2.43 -1.63 -3.20 114.38 113.11 1hue h ARG 37 Ca 0.16 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1hue h ARG 37 Cb 0.16 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1hue h ARG 37 CO -0.02 0.27 0.00 1.17 -1.51 0.00 0.00 179.97 179.88 1hue n LYS 38 N -3.95 3.06 -2.85 0.20 4.81 -0.94 -4.96 118.16 113.52 1hue n LYS 38 Ca -0.02 -2.39 -0.10 0.00 -0.87 0.00 0.00 58.31 54.93 1hue n LYS 38 Cb 0.34 -1.70 0.05 0.00 0.02 0.00 0.00 35.03 33.74 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 1.18 -0.01 3.07 3.14 0.00 -1.12 -5.04 105.19 106.42 1hue n GLY 39 Ca 0.22 -0.15 -0.07 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.71 0.44 0.06 1.61 1.11 0.34 -5.03 116.67 111.49 1hue s ASP 40 Ca 0.04 -0.90 0.01 0.00 0.18 0.00 0.00 52.55 51.88 1hue s ASP 40 Cb -0.02 0.18 -0.04 0.00 1.07 0.00 0.00 42.92 44.11 1hue s ASP 40 CO 0.42 -0.54 0.15 -0.54 1.18 0.00 0.00 175.17 175.84 1hue s LYS 41 N -3.41 3.20 0.00 8.23 1.02 -1.26 -3.36 119.74 124.16 1hue s LYS 41 Ca 0.02 -0.54 0.00 0.00 0.02 0.00 0.00 55.97 55.48 1hue s LYS 41 Cb 0.04 -2.91 0.00 0.00 -0.52 0.00 0.00 37.83 34.44 1hue s LYS 41 CO -0.08 0.60 0.00 0.28 -0.92 0.00 0.00 175.35 175.23 1hue n VAL 42 N 0.44 0.00 0.00 3.17 0.31 -0.94 -4.90 118.33 116.41 1hue n VAL 42 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1hue n VAL 42 Cb 0.51 -0.11 0.00 0.00 -0.91 0.00 0.00 33.84 33.34 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 -3.55 5.55 6.02 -1.26 -4.80 117.38 119.34 1hue n GLN 43 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 56.85 1hue n GLN 43 Cb 0.00 0.00 -0.12 0.00 1.02 0.00 0.00 30.24 31.14 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 -0.29 0.21 1.08 1.43 -0.47 -4.99 118.68 115.65 1hue s LEU 44 Ca 0.00 0.23 -0.30 0.00 -1.03 0.00 0.00 54.13 53.04 1hue s LEU 44 Cb 0.00 0.67 -0.08 0.00 0.03 0.00 0.00 46.19 46.80 1hue s LEU 44 CO 0.00 -0.28 1.04 -0.51 0.23 0.00 0.00 176.35 176.83 1hue s ILE 45 N 2.41 3.88 -0.13 -0.59 2.07 -1.26 -1.77 121.20 125.80 1hue s ILE 45 Ca 0.05 1.75 0.00 0.00 -1.41 0.00 0.00 60.65 61.04 1hue s ILE 45 Cb -0.14 -4.12 0.00 0.00 0.13 0.00 0.00 42.46 38.34 1hue s ILE 45 CO -0.11 0.36 0.00 0.61 -1.91 0.00 0.00 174.94 173.89 1hue n GLY 46 N 1.69 0.37 0.34 1.50 0.00 -1.26 -4.77 105.19 103.05 1hue n GLY 46 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.54 -0.29 -3.69 1.61 7.35 -1.22 -3.99 117.46 114.69 1hue n PHE 47 Ca -0.01 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.64 1hue n PHE 47 Cb 0.25 0.08 -0.01 0.00 0.35 0.00 0.00 39.48 40.15 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 -1.82 -0.30 -0.31 7.13 0.00 -0.73 -2.67 107.32 108.62 1hue s GLY 48 Ca 0.00 0.40 0.03 0.00 0.00 0.00 0.00 44.72 45.16 1hue s GLY 48 CO 0.00 0.09 0.46 0.21 0.00 0.00 0.00 173.10 173.86 1hue s ASN 49 N -2.85 -0.06 0.23 1.64 2.47 -1.17 -1.37 114.94 113.84 1hue s ASN 49 Ca 0.11 -0.44 -0.17 0.00 0.42 0.00 0.00 52.86 52.79 1hue s ASN 49 Cb -0.00 1.29 -0.08 0.00 -1.45 0.00 0.00 41.25 41.00 1hue s ASN 49 CO -0.01 -0.32 0.68 -0.36 -3.72 0.00 0.00 177.10 173.37 1hue s PHE 50 N 2.42 3.55 0.04 0.43 0.40 -1.26 -1.69 117.98 121.87 1hue s PHE 50 Ca 0.11 1.24 -0.27 0.00 -0.60 0.00 0.00 56.93 57.41 1hue s PHE 50 Cb -0.11 -2.52 0.08 0.00 0.51 0.00 0.00 43.02 40.98 1hue s PHE 50 CO -0.25 0.29 0.71 -1.83 0.70 0.00 0.00 175.22 174.83 1hue s GLU 51 N -2.30 1.08 0.41 0.44 -1.05 -1.05 -2.20 118.70 114.02 1hue s GLU 51 Ca 0.45 -0.16 -0.05 0.00 -0.15 0.00 0.00 54.97 55.06 1hue s GLU 51 Cb -0.14 0.50 -0.04 0.00 -0.44 0.00 0.00 34.13 34.01 1hue s GLU 51 CO 0.20 -0.42 0.70 0.54 0.95 0.00 0.00 175.26 177.22 1hue s VAL 52 N -2.63 4.95 -0.40 1.83 0.11 -1.26 -1.95 120.40 121.05 1hue s VAL 52 Ca -0.02 0.12 0.02 0.00 -2.93 0.00 0.00 61.98 59.16 1hue s VAL 52 Cb -0.01 -3.82 0.12 0.00 -1.53 0.00 0.00 36.38 31.14 1hue s VAL 52 CO -0.04 -0.64 0.17 -0.60 -3.33 0.00 0.00 175.10 170.65 1hue s ARG 53 N -4.29 1.25 -0.07 1.54 3.52 -0.28 -4.82 118.95 115.80 1hue s ARG 53 Ca 0.46 -1.80 -0.30 0.00 -0.13 0.00 0.00 55.73 53.96 1hue s ARG 53 Cb -0.10 -2.52 -0.04 0.00 -1.56 0.00 0.00 34.95 30.73 1hue s ARG 53 CO 0.38 -1.07 1.40 -1.83 -0.81 0.00 0.00 175.30 173.38 1hue s GLU 54 N 0.72 4.24 -0.02 5.12 -1.05 -1.26 -2.21 118.70 124.24 1hue s GLU 54 Ca 0.14 1.90 -0.25 0.00 -0.15 0.00 0.00 54.97 56.61 1hue s GLU 54 Cb -0.22 -3.74 -0.04 0.00 -0.44 0.00 0.00 34.13 29.69 1hue s GLU 54 CO -0.08 -0.68 0.76 0.50 0.95 0.00 0.00 175.26 176.71 1hue s ARG 55 N 3.18 4.47 -0.59 -4.83 6.06 -0.95 -4.96 118.95 121.34 1hue s ARG 55 Ca 0.63 1.02 -0.28 0.00 -2.50 0.00 0.00 55.73 54.59 1hue s ARG 55 Cb -0.28 -3.42 0.03 0.00 0.06 0.00 0.00 34.95 31.34 1hue s ARG 55 CO 0.23 0.12 1.22 0.00 -2.50 0.00 0.00 175.30 174.36 1hue s ALA 56 N 0.56 2.97 0.01 6.12 0.00 -1.26 -4.07 121.76 126.09 1hue s ALA 56 Ca 0.40 -0.84 -0.35 0.00 0.00 0.00 0.00 51.96 51.18 1hue s ALA 56 Cb -0.19 -4.05 -0.13 0.00 0.00 0.00 0.00 23.12 18.74 1hue s ALA 56 CO 0.21 -2.71 1.71 0.00 0.00 0.00 0.00 175.76 174.97 1hue n ALA 57 N 8.58 0.85 -3.09 0.00 0.00 -1.26 -4.92 120.51 120.67 1hue n ALA 57 Ca 0.09 0.37 -0.12 0.00 0.00 0.00 0.00 53.44 53.78 1hue n ALA 57 Cb 0.49 -2.39 0.03 0.00 0.00 0.00 0.00 19.45 17.58 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 4.98 0.83 -3.50 0.00 5.12 -0.69 -4.94 116.66 118.46 1hue n ARG 58 Ca 0.20 -1.57 -0.14 0.00 -1.93 0.00 0.00 57.85 54.42 1hue n ARG 58 Cb 0.27 -0.09 -0.11 0.00 -1.16 0.00 0.00 32.46 31.37 1hue n ARG 58 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1hue s LYS 59 N -3.29 0.23 0.00 5.56 2.47 -1.26 -1.96 119.74 121.49 1hue s LYS 59 Ca 0.29 0.48 0.00 0.00 -1.56 0.00 0.00 55.97 55.18 1hue s LYS 59 Cb -0.02 -0.63 0.00 0.00 -1.46 0.00 0.00 37.83 35.72 1hue s LYS 59 CO 0.18 -0.54 0.00 0.41 0.16 0.00 0.00 175.35 175.56 1hue n GLY 60 N 5.34 2.85 3.15 5.54 0.00 -1.03 -5.00 105.19 116.05 1hue n GLY 60 Ca -0.05 0.02 -0.08 0.00 0.00 0.00 0.00 46.02 45.91 1hue n GLY 60 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hue s ARG 61 N 3.03 0.72 0.22 1.61 0.52 -1.26 -2.44 118.95 121.35 1hue s ARG 61 Ca 0.00 -1.02 -0.30 0.00 -0.52 0.00 0.00 55.73 53.90 1hue s ARG 61 Cb 0.00 0.28 -0.09 0.00 0.52 0.00 0.00 34.95 35.66 1hue s ARG 61 CO 0.00 -0.19 1.18 1.21 0.02 0.00 0.00 175.30 177.51 1hue s ASN 62 N -2.77 7.12 0.25 0.23 3.84 -0.96 -4.88 114.94 117.78 1hue s ASN 62 Ca 0.04 2.27 -0.05 0.00 0.21 0.00 0.00 52.86 55.32 1hue s ASN 62 Cb 0.05 -2.61 0.28 0.00 -0.55 0.00 0.00 41.25 38.41 1hue s ASN 62 CO -0.10 -0.32 1.87 1.55 -2.79 0.00 0.00 177.10 177.32 1hue h PRO 63 N 4.77 1.18 0.05 0.43 0.13 -2.00 -2.41 132.00 134.15 1hue h PRO 63 Ca -0.45 -0.14 -0.00 0.00 -0.87 0.00 0.00 66.00 64.54 1hue h PRO 63 Cb 1.21 -0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1hue h PRO 63 CO 0.72 0.86 -0.02 0.37 -0.23 0.00 0.00 178.00 179.70 1hue h GLN 64 N 1.18 -0.06 0.01 0.86 4.15 -2.01 -3.42 115.11 115.81 1hue h GLN 64 Ca 0.30 0.00 -0.21 0.00 0.77 0.00 0.00 58.65 59.51 1hue h GLN 64 Cb 0.03 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.73 1hue h GLN 64 CO -0.05 -0.04 -0.92 1.79 -1.93 0.00 0.00 178.83 177.68 1hue h THR 65 N -0.28 1.47 -1.20 2.39 1.35 -2.00 -3.49 112.91 111.14 1hue h THR 65 Ca -0.01 -2.59 -0.09 0.00 -0.55 0.00 0.00 66.41 63.17 1hue h THR 65 Cb 0.05 2.48 0.01 0.00 -1.73 0.00 0.00 68.15 68.96 1hue h THR 65 CO 0.01 0.76 -0.13 0.61 -0.25 0.00 0.00 175.52 176.53 1hue n GLY 66 N 0.94 0.37 3.74 5.82 0.00 -0.91 -5.01 105.19 110.15 1hue n GLY 66 Ca -0.05 -0.61 -0.35 0.00 0.00 0.00 0.00 46.02 45.01 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 -4.65 3.92 -0.05 1.61 -6.30 -1.26 -4.79 118.70 107.18 1hue s GLU 67 Ca 0.05 -0.23 -0.30 0.00 -2.50 0.00 0.00 54.97 51.99 1hue s GLU 67 Cb -0.02 -3.30 -0.06 0.00 0.00 0.00 0.00 34.13 30.75 1hue s GLU 67 CO 0.06 0.42 1.73 -1.21 0.02 0.00 0.00 175.26 176.29 1hue s GLU 68 N -0.02 4.11 -0.03 4.30 2.02 -1.26 -2.26 118.70 125.56 1hue s GLU 68 Ca 0.09 2.23 -0.10 0.00 0.02 0.00 0.00 54.97 57.21 1hue s GLU 68 Cb -0.12 -4.04 0.02 0.00 0.10 0.00 0.00 34.13 30.09 1hue s GLU 68 CO -0.00 -0.94 0.22 0.00 0.02 0.00 0.00 175.26 174.56 1hue s MET 69 N 4.25 0.48 0.02 1.61 0.23 -1.02 -4.98 119.30 119.89 1hue s MET 69 Ca 0.77 -0.10 -0.30 0.00 -1.03 0.00 0.00 55.69 55.03 1hue s MET 69 Cb -0.35 0.21 -0.04 0.00 -1.53 0.00 0.00 34.83 33.12 1hue s MET 69 CO 0.32 -0.11 1.11 -1.83 -2.03 0.00 0.00 175.02 172.49 1hue s GLU 70 N -0.87 4.47 -0.40 3.16 1.03 -1.26 -2.45 118.70 122.37 1hue s GLU 70 Ca -0.10 1.62 -0.20 0.00 0.03 0.00 0.00 54.97 56.33 1hue s GLU 70 Cb -0.05 -3.41 0.01 0.00 -0.80 0.00 0.00 34.13 29.88 1hue s GLU 70 CO 0.02 -0.20 0.60 0.42 -1.33 0.00 0.00 175.26 174.77 1hue s ILE 71 N 1.17 4.89 0.66 1.83 1.01 -0.83 -4.98 121.20 124.95 1hue s ILE 71 Ca 0.56 0.25 -0.12 0.00 0.00 0.00 0.00 60.65 61.34 1hue s ILE 71 Cb -0.26 -4.12 -0.01 0.00 0.01 0.00 0.00 42.46 38.09 1hue s ILE 71 CO 0.28 -0.44 1.05 -2.16 0.00 0.00 0.00 174.94 173.67 1hue s PRO 72 N 2.67 3.12 0.68 2.79 0.04 -1.26 -1.71 135.00 141.34 1hue s PRO 72 Ca 0.22 0.97 -0.11 0.00 0.04 0.00 0.00 61.00 62.11 1hue s PRO 72 Cb -0.15 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.38 1hue s PRO 72 CO 0.17 -0.95 1.07 0.00 0.04 0.00 0.00 177.00 177.33 1hue s ALA 73 N -2.95 2.96 -0.28 8.56 0.00 -1.26 -4.73 121.76 124.06 1hue s ALA 73 Ca 0.59 -0.31 -0.23 0.00 0.00 0.00 0.00 51.96 52.01 1hue s ALA 73 Cb -0.14 -3.02 0.10 0.00 0.00 0.00 0.00 23.12 20.07 1hue s ALA 73 CO 0.51 -1.03 0.90 -1.54 0.00 0.00 0.00 175.76 174.60 1hue s SER 74 N -4.32 -0.60 -0.06 0.00 1.04 -1.26 -4.95 113.70 103.56 1hue s SER 74 Ca 0.57 1.11 -0.28 0.00 0.48 0.00 0.00 55.95 57.83 1hue s SER 74 Cb -0.11 1.15 -0.03 0.00 0.10 0.00 0.00 66.02 67.13 1hue s SER 74 CO 0.52 -0.19 0.91 -0.54 0.98 0.00 0.00 173.24 174.92 1hue s LYS 75 N 0.54 4.47 -0.23 4.02 1.02 -1.26 -2.23 119.74 126.07 1hue s LYS 75 Ca -0.00 1.25 -0.01 0.00 0.02 0.00 0.00 55.97 57.23 1hue s LYS 75 Cb -0.05 -3.49 0.02 0.00 -0.52 0.00 0.00 37.83 33.80 1hue s LYS 75 CO -0.06 -0.11 -0.10 0.08 -0.92 0.00 0.00 175.35 174.23 1hue s VAL 76 N 1.31 2.64 0.13 3.17 1.01 -0.94 -4.77 120.40 122.94 1hue s VAL 76 Ca 0.47 -1.02 -0.27 0.00 0.00 0.00 0.00 61.98 61.15 1hue s VAL 76 Cb -0.19 -2.29 -0.07 0.00 0.00 0.00 0.00 36.38 33.83 1hue s VAL 76 CO 0.22 0.28 0.86 -2.16 0.00 0.00 0.00 175.10 174.30 1hue s PRO 77 N 1.31 4.63 0.25 2.72 0.04 -1.26 -1.12 135.00 141.57 1hue s PRO 77 Ca 0.01 1.27 0.04 0.00 0.04 0.00 0.00 61.00 62.36 1hue s PRO 77 Cb -0.16 -3.33 -0.05 0.00 0.04 0.00 0.00 34.50 31.00 1hue s PRO 77 CO -0.07 0.37 0.00 0.00 0.04 0.00 0.00 177.00 177.34 1hue s ALA 78 N -0.49 1.95 -0.09 8.56 0.00 -0.82 -5.01 121.76 125.86 1hue s ALA 78 Ca 0.41 -1.82 -0.04 0.00 0.00 0.00 0.00 51.96 50.51 1hue s ALA 78 Cb -0.23 0.49 0.05 0.00 0.00 0.00 0.00 23.12 23.43 1hue s ALA 78 CO 0.27 -0.24 0.18 0.12 0.00 0.00 0.00 175.76 176.09 1hue s PHE 79 N -3.36 -0.23 0.28 0.00 5.36 -1.26 -2.54 117.98 116.23 1hue s PHE 79 Ca 0.30 0.66 -0.19 0.00 -0.96 0.00 0.00 56.93 56.74 1hue s PHE 79 Cb 0.06 -0.16 -0.09 0.00 -0.34 0.00 0.00 43.02 42.49 1hue s PHE 79 CO 0.10 -0.26 0.76 0.15 -1.46 0.00 0.00 175.22 174.51 1hue s LYS 80 N 2.00 4.19 -0.03 10.12 -0.14 -0.68 -4.94 119.74 130.25 1hue s LYS 80 Ca -0.01 0.86 0.00 0.00 -1.36 0.00 0.00 55.97 55.46 1hue s LYS 80 Cb -0.12 -2.68 0.05 0.00 -1.68 0.00 0.00 37.83 33.40 1hue s LYS 80 CO -0.06 0.28 1.10 -0.35 -0.76 0.00 0.00 175.35 175.55 1hue n PRO 81 N 0.26 1.09 -0.89 -1.68 -0.04 -1.26 -3.03 135.00 129.45 1hue n PRO 81 Ca 0.01 -0.22 -0.04 0.00 -0.04 0.00 0.00 63.50 63.21 1hue n PRO 81 Cb 0.52 -1.08 -0.02 0.00 -0.04 0.00 0.00 33.50 32.88 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 0.41 0.41 5.00 0.55 0.00 -1.09 -1.54 105.19 108.93 1hue n GLY 82 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.83 0.00 -0.10 1.61 4.01 -1.26 -4.66 118.16 116.92 1hue n LYS 83 Ca -0.04 0.00 -0.06 0.00 -0.51 0.00 0.00 58.31 57.70 1hue n LYS 83 Cb 0.19 0.00 0.01 0.00 -0.51 0.00 0.00 35.03 34.73 1hue n LYS 83 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1hue h ALA 84 N 0.00 0.32 -0.80 7.82 0.00 -1.85 -2.43 119.26 122.32 1hue h ALA 84 Ca 0.00 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1hue h ALA 84 Cb 0.00 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1hue h ALA 84 CO 0.00 -0.40 0.45 1.25 0.00 0.00 0.00 179.25 180.55 1hue h LEU 85 N 0.10 1.00 -1.94 0.00 5.85 -1.41 -2.58 115.31 116.34 1hue h LEU 85 Ca 0.17 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.85 1hue h LEU 85 Cb 0.23 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 1hue h LEU 85 CO -0.28 0.81 0.40 0.50 -0.34 0.00 0.00 178.44 179.53 1hue h LYS 86 N 1.11 0.00 0.18 1.25 3.64 -1.51 -1.60 116.57 119.64 1hue h LYS 86 Ca 0.28 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.33 1hue h LYS 86 Cb 0.02 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1hue h LYS 86 CO -0.05 0.00 -1.65 0.22 -2.27 0.00 0.00 179.45 175.70 1hue h ASP 87 N 0.00 0.58 -0.95 4.20 3.58 -1.18 -3.29 116.42 119.37 1hue h ASP 87 Ca 0.09 -0.92 0.16 0.00 0.42 0.00 0.00 57.03 56.77 1hue h ASP 87 Cb 0.89 -0.19 -0.10 0.00 1.72 0.00 0.00 39.33 41.66 1hue h ASP 87 CO -0.00 1.75 0.55 0.00 -2.88 0.00 0.00 179.24 178.66 1hue h ALA 88 N 0.08 1.49 -0.00 -0.78 0.00 -0.96 -3.30 119.26 115.79 1hue h ALA 88 Ca -0.33 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1hue h ALA 88 Cb 2.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.73 1hue h ALA 88 CO 0.16 0.00 -0.71 1.55 0.00 0.00 0.00 179.25 180.25 1hue n VAL 89 N -4.77 0.00 0.70 0.00 3.14 -0.79 -5.12 118.33 111.49 1hue n VAL 89 Ca 0.20 -0.05 0.06 0.00 -2.96 0.00 0.00 64.34 61.59 1hue n VAL 89 Cb 0.47 0.76 0.33 0.00 -1.06 0.00 0.00 33.84 34.34 1hue n VAL 89 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66