#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgq n GLU 2 N 0.00 0.00 -3.59 0.03 -0.58 -1.26 -4.12 120.64 111.12 2hgq n GLU 2 Ca 0.00 0.00 -0.40 0.00 -0.42 0.00 0.00 57.16 56.34 2hgq n GLU 2 Cb 0.00 0.00 -0.08 0.00 -0.57 0.00 0.00 31.44 30.79 2hgq n GLU 2 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2hgq s ALA 3 N -1.37 3.50 -0.15 0.62 0.00 -0.44 -4.70 121.76 119.22 2hgq s ALA 3 Ca 0.00 -2.80 -0.29 0.00 0.00 0.00 0.00 51.96 48.87 2hgq s ALA 3 Cb 0.00 -2.83 -0.02 0.00 0.00 0.00 0.00 23.12 20.27 2hgq s ALA 3 CO 0.00 -1.99 1.31 -1.59 0.00 0.00 0.00 175.76 173.50 2hgq s LYS 4 N 0.86 4.22 -0.68 0.00 -2.85 -1.26 -0.66 119.74 119.38 2hgq s LYS 4 Ca 0.10 1.73 0.01 0.00 -1.00 0.00 0.00 55.97 56.81 2hgq s LYS 4 Cb -0.22 -3.80 0.17 0.00 -2.06 0.00 0.00 37.83 31.92 2hgq s LYS 4 CO -0.03 -0.73 0.49 0.00 0.10 0.00 0.00 175.35 175.18 2hgq s ALA 5 N 3.58 3.73 0.06 0.59 0.00 -0.10 -3.80 121.76 125.82 2hgq s ALA 5 Ca 0.57 -3.55 -0.09 0.00 0.00 0.00 0.00 51.96 48.89 2hgq s ALA 5 Cb -0.23 -2.46 0.00 0.00 0.00 0.00 0.00 23.12 20.43 2hgq s ALA 5 CO 0.17 -2.10 0.19 0.42 0.00 0.00 0.00 175.76 174.44 2hgq s ILE 6 N -0.76 0.13 -0.07 0.00 1.01 -1.25 -0.74 121.20 119.51 2hgq s ILE 6 Ca 0.21 -1.04 -0.31 0.00 0.00 0.00 0.00 60.65 59.52 2hgq s ILE 6 Cb -0.15 -1.13 0.11 0.00 0.01 0.00 0.00 42.46 41.30 2hgq s ILE 6 CO -0.08 -0.57 0.98 0.00 0.00 0.00 0.00 174.94 175.27 2hgq s ALA 7 N -3.24 -1.90 0.55 9.38 0.00 -0.52 -4.90 121.76 121.12 2hgq s ALA 7 Ca 0.00 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.18 2hgq s ALA 7 Cb 0.02 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.31 2hgq s ALA 7 CO -0.08 -0.63 0.00 0.54 0.00 0.00 0.00 175.76 175.60 2hgq n ARG 8 N -0.12 3.40 -0.04 0.00 5.12 -1.26 -1.06 116.66 122.69 2hgq n ARG 8 Ca -0.06 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.86 2hgq n ARG 8 Cb 0.60 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.90 2hgq n ARG 8 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2hgq n TYR 9 N 0.00 0.00 -3.98 -1.55 4.02 -1.26 -4.12 117.16 110.27 2hgq n TYR 9 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.56 2hgq n TYR 9 Cb 0.00 -0.03 -0.14 0.00 -0.02 0.00 0.00 39.34 39.15 2hgq n TYR 9 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2hgq s VAL 10 N 0.08 2.53 0.00 -0.72 -7.23 -0.10 -4.89 120.40 110.08 2hgq s VAL 10 Ca 0.00 -1.87 0.00 0.00 -1.81 0.00 0.00 61.98 58.30 2hgq s VAL 10 Cb 0.00 -2.64 0.00 0.00 0.56 0.00 0.00 36.38 34.30 2hgq s VAL 10 CO 0.00 -0.32 0.00 -2.11 -0.31 0.00 0.00 175.10 172.36 2hgq n ARG 11 N 4.44 0.00 0.00 4.82 0.00 -1.26 -0.06 116.66 124.60 2hgq n ARG 11 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.78 2hgq n ARG 11 Cb 0.42 -1.19 0.00 0.00 -0.00 0.00 0.00 32.46 31.69 2hgq n ARG 11 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 2hgq n ILE 12 N 1.55 0.00 -3.64 8.89 -0.00 -1.15 -4.64 119.36 120.37 2hgq n ILE 12 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 62.75 62.71 2hgq n ILE 12 Cb 0.00 -0.02 -0.06 0.00 -0.00 0.00 0.00 39.64 39.56 2hgq n ILE 12 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 2hgq s SER 13 N -1.06 -0.12 0.00 7.28 0.15 -1.26 -4.39 113.70 114.30 2hgq s SER 13 Ca 0.00 0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.85 2hgq s SER 13 Cb 0.00 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.50 2hgq s SER 13 CO 0.00 -0.07 0.00 -0.81 1.20 0.00 0.00 173.24 173.56 2hgq n PRO 14 N 1.27 0.00 0.00 5.44 -0.04 -1.26 -1.37 135.00 139.04 2hgq n PRO 14 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 2hgq n PRO 14 Cb 0.57 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.03 2hgq n PRO 14 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2hgq n ARG 15 N 0.00 0.00 -0.34 0.54 1.74 -1.26 -0.07 116.66 117.27 2hgq n ARG 15 Ca 0.00 0.03 -0.04 0.00 -0.77 0.00 0.00 57.85 57.07 2hgq n ARG 15 Cb 0.00 -0.05 -0.01 0.00 -1.02 0.00 0.00 32.46 31.38 2hgq n ARG 15 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2hgq n LYS 16 N -0.92 -0.27 -0.26 5.56 4.01 -1.26 0.11 118.16 125.14 2hgq n LYS 16 Ca 0.00 1.32 -0.00 0.00 -0.51 0.00 0.00 58.31 59.12 2hgq n LYS 16 Cb 0.00 -1.96 0.12 0.00 -0.51 0.00 0.00 35.03 32.68 2hgq n LYS 16 CO 0.00 0.00 0.00 -0.39 -1.11 0.00 0.00 177.40 175.90 2hgq h VAL 17 N 0.00 0.98 -0.46 -0.18 -1.51 0.79 0.14 116.25 116.01 2hgq h VAL 17 Ca 0.24 -0.27 0.07 0.00 -1.23 0.00 0.00 66.70 65.51 2hgq h VAL 17 Cb 0.46 0.13 -0.06 0.00 -2.13 0.00 0.00 31.29 29.69 2hgq h VAL 17 CO -0.84 0.14 0.13 -0.09 -1.23 0.00 0.00 177.57 175.68 2hgq h ARG 18 N 0.78 0.27 -0.42 5.19 9.65 0.23 -1.38 114.38 128.70 2hgq h ARG 18 Ca 0.33 -0.02 0.09 0.00 -1.10 0.00 0.00 59.98 59.28 2hgq h ARG 18 Cb 0.21 -0.06 -0.09 0.00 -1.39 0.00 0.00 29.97 28.63 2hgq h ARG 18 CO -0.19 0.18 -0.27 -0.07 2.80 0.00 0.00 179.97 182.42 2hgq h LEU 19 N 0.28 -0.91 0.07 3.80 3.38 0.12 0.12 115.31 122.18 2hgq h LEU 19 Ca 0.22 0.18 0.01 0.00 0.09 0.00 0.00 57.88 58.38 2hgq h LEU 19 Cb 0.26 0.45 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 2hgq h LEU 19 CO -0.26 -0.28 -0.31 1.62 0.09 0.00 0.00 178.44 179.30 2hgq h VAL 20 N -0.19 0.00 -0.75 1.22 3.04 -0.27 -0.90 116.25 118.39 2hgq h VAL 20 Ca 0.19 0.00 0.12 0.00 -1.01 0.00 0.00 66.70 66.01 2hgq h VAL 20 Cb 0.50 0.00 -0.05 0.00 -2.01 0.00 0.00 31.29 29.73 2hgq h VAL 20 CO -0.53 0.00 0.50 1.62 -1.01 0.00 0.00 177.57 178.14 2hgq h VAL 21 N -0.45 0.86 -0.47 1.51 3.04 -0.73 0.06 116.25 120.07 2hgq h VAL 21 Ca -0.00 -0.18 0.07 0.00 -1.01 0.00 0.00 66.70 65.57 2hgq h VAL 21 Cb 0.45 0.28 -0.09 0.00 -2.01 0.00 0.00 31.29 29.92 2hgq h VAL 21 CO -0.17 0.10 -0.49 0.44 -1.01 0.00 0.00 177.57 176.44 2hgq h ASP 22 N 0.53 -1.66 -0.31 3.17 3.45 0.34 -0.20 116.42 121.75 2hgq h ASP 22 Ca 0.36 0.24 -0.16 0.00 0.43 0.00 0.00 57.03 57.90 2hgq h ASP 22 Cb 0.66 0.71 -0.01 0.00 -0.56 0.00 0.00 39.33 40.14 2hgq h ASP 22 CO -0.13 -0.37 -0.42 -0.07 -1.57 0.00 0.00 179.24 176.68 2hgq h LEU 23 N -0.32 0.94 -0.53 1.55 3.38 0.25 -3.36 115.31 117.21 2hgq h LEU 23 Ca 0.12 -0.44 -0.15 0.00 0.09 0.00 0.00 57.88 57.50 2hgq h LEU 23 Cb 0.58 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2hgq h LEU 23 CO -0.63 1.23 -0.72 0.16 0.09 0.00 0.00 178.44 178.57 2hgq h ILE 24 N 0.71 1.50 0.00 1.22 3.07 -0.31 -3.45 117.51 120.25 2hgq h ILE 24 Ca 0.05 -2.49 0.00 0.00 1.55 0.00 0.00 64.86 63.97 2hgq h ILE 24 Cb 1.00 2.35 0.00 0.00 -0.27 0.00 0.00 36.82 39.90 2hgq h ILE 24 CO 0.10 0.71 0.00 0.54 -1.05 0.00 0.00 178.15 178.45 2hgq n ARG 25 N -3.65 0.00 0.00 0.16 1.74 -0.17 -4.20 116.66 110.54 2hgq n ARG 25 Ca -0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 2hgq n ARG 25 Cb 0.71 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.15 2hgq n ARG 25 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2hgq n GLY 26 N 0.00 0.19 1.78 -0.13 0.00 -1.25 -4.41 105.19 101.38 2hgq n GLY 26 Ca 0.00 0.12 -0.08 0.00 0.00 0.00 0.00 46.02 46.05 2hgq n GLY 26 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2hgq n LYS 27 N 0.00 -0.57 -0.86 1.61 4.01 -1.26 -4.19 118.16 116.90 2hgq n LYS 27 Ca 0.00 -0.40 0.00 0.00 -0.51 0.00 0.00 58.31 57.40 2hgq n LYS 27 Cb 0.00 -0.85 0.00 0.00 -0.51 0.00 0.00 35.03 33.67 2hgq n LYS 27 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 2hgq n SER 28 N -1.11 0.13 -0.07 4.39 3.41 -1.26 -1.24 113.62 117.88 2hgq n SER 28 Ca 0.04 -0.80 -0.09 0.00 -0.26 0.00 0.00 58.87 57.76 2hgq n SER 28 Cb 0.16 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.09 2hgq n SER 28 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2hgq h LEU 29 N 0.00 0.23 0.00 1.04 6.46 -1.81 -0.82 115.31 120.41 2hgq h LEU 29 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2hgq h LEU 29 Cb 0.00 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 39.88 2hgq h LEU 29 CO 0.00 0.17 0.00 1.21 -0.62 0.00 0.00 178.44 179.20 2hgq n GLU 30 N -4.95 0.00 0.27 1.25 0.00 -1.26 -0.69 120.64 115.26 2hgq n GLU 30 Ca -0.02 0.43 -0.17 0.00 0.00 0.00 0.00 57.16 57.40 2hgq n GLU 30 Cb 0.05 -1.01 -0.08 0.00 0.00 0.00 0.00 31.44 30.40 2hgq n GLU 30 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 2hgq h GLU 31 N 0.00 -0.83 -0.23 5.31 3.07 -1.95 -1.15 114.58 118.81 2hgq h GLU 31 Ca 0.00 0.06 0.07 0.00 -0.50 0.00 0.00 59.36 58.98 2hgq h GLU 31 Cb 0.00 0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.09 2hgq h GLU 31 CO 0.00 -0.55 0.18 0.00 -1.40 0.00 0.00 179.01 177.24 2hgq h ALA 32 N -0.52 2.08 -1.00 3.43 0.00 -1.23 -0.74 119.26 121.30 2hgq h ALA 32 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2hgq h ALA 32 Cb 0.75 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2hgq h ALA 32 CO -0.03 -0.30 0.00 -2.13 0.00 0.00 0.00 179.25 176.79 2hgq n ARG 33 N -4.24 0.00 -0.29 0.00 0.00 0.13 -0.68 116.66 111.58 2hgq n ARG 33 Ca 0.02 0.33 0.14 0.00 -0.00 0.00 0.00 57.85 58.35 2hgq n ARG 33 Cb 0.33 -1.32 0.28 0.00 0.00 0.00 0.00 32.46 31.74 2hgq n ARG 33 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2hgq n ASN 34 N -1.50 -0.05 0.18 6.15 5.03 -0.41 -0.35 115.26 124.31 2hgq n ASN 34 Ca 0.00 1.45 -0.14 0.00 0.87 0.00 0.00 54.58 56.76 2hgq n ASN 34 Cb 0.00 -0.55 -0.08 0.00 -1.02 0.00 0.00 39.78 38.13 2hgq n ASN 34 CO 0.00 0.00 0.00 -0.29 -1.83 0.00 0.00 177.26 175.14 2hgq h ILE 35 N 0.00 0.66 -0.98 2.41 2.10 -1.08 -0.36 117.51 120.26 2hgq h ILE 35 Ca 0.54 -0.47 0.20 0.00 1.08 0.00 0.00 64.86 66.20 2hgq h ILE 35 Cb 1.17 0.90 -0.09 0.00 -1.09 0.00 0.00 36.82 37.71 2hgq h ILE 35 CO -0.79 0.09 0.61 0.25 -1.08 0.00 0.00 178.15 177.24 2hgq h LEU 36 N -0.73 0.68 0.10 2.19 5.85 0.16 0.63 115.31 124.19 2hgq h LEU 36 Ca -0.05 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2hgq h LEU 36 Cb 0.50 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.49 2hgq h LEU 36 CO 0.08 0.25 -0.05 0.08 -0.34 0.00 0.00 178.44 178.45 2hgq h ARG 37 N 0.66 -0.13 -0.12 1.25 0.11 -0.93 -3.39 114.38 111.83 2hgq h ARG 37 Ca 0.55 0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.64 2hgq h ARG 37 Cb 0.99 0.03 0.00 0.00 1.11 0.00 0.00 29.97 32.10 2hgq h ARG 37 CO -0.32 0.24 0.00 0.66 0.10 0.00 0.00 179.97 180.65 2hgq n TYR 38 N -4.83 0.14 -3.31 4.08 4.02 -0.15 -4.82 117.16 112.29 2hgq n TYR 38 Ca -0.05 -0.07 -0.38 0.00 -0.01 0.00 0.00 57.90 57.38 2hgq n TYR 38 Cb 0.21 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.47 2hgq n TYR 38 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2hgq s THR 39 N -1.86 4.90 0.63 -0.72 2.01 0.20 -5.04 115.64 115.77 2hgq s THR 39 Ca 0.34 1.11 -0.14 0.00 0.31 0.00 0.00 61.69 63.32 2hgq s THR 39 Cb 0.20 -3.86 -0.02 0.00 0.01 0.00 0.00 72.50 68.84 2hgq s THR 39 CO 0.30 0.50 1.06 0.21 -0.69 0.00 0.00 174.62 176.00 2hgq s ASN 40 N -0.65 5.57 0.00 3.53 3.84 -1.26 -4.87 114.94 121.10 2hgq s ASN 40 Ca 0.28 1.76 0.00 0.00 0.21 0.00 0.00 52.86 55.12 2hgq s ASN 40 Cb -0.18 -2.52 0.00 0.00 -0.55 0.00 0.00 41.25 38.00 2hgq s ASN 40 CO 0.16 -1.31 0.00 0.29 -2.79 0.00 0.00 177.10 173.45 2hgq n LYS 41 N -2.44 0.00 -0.31 0.43 5.02 -1.26 -5.00 118.16 114.59 2hgq n LYS 41 Ca 0.08 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.10 2hgq n LYS 41 Cb 0.53 0.00 0.26 0.00 -0.02 0.00 0.00 35.03 35.80 2hgq n LYS 41 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2hgq n ARG 42 N 0.32 -4.13 0.00 1.97 3.00 -1.26 -3.16 116.66 113.39 2hgq n ARG 42 Ca 0.00 -1.22 0.00 0.00 -0.00 0.00 0.00 57.85 56.63 2hgq n ARG 42 Cb 0.00 -1.84 0.00 0.00 0.00 0.00 0.00 32.46 30.62 2hgq n ARG 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2hgq n GLY 43 N 1.95 1.45 0.00 5.14 0.00 -1.26 -4.86 105.19 107.61 2hgq n GLY 43 Ca 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2hgq n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hgq n ALA 44 N 0.00 0.00 -0.05 4.61 0.00 -1.19 0.13 120.51 124.01 2hgq n ALA 44 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 2hgq n ALA 44 Cb 0.00 0.00 0.22 0.00 0.00 0.00 0.00 19.45 19.67 2hgq n ALA 44 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 2hgq h TYR 45 N 0.00 0.68 -0.16 0.00 -0.00 -1.89 -0.62 116.97 114.99 2hgq h TYR 45 Ca 0.00 -0.09 0.05 0.00 0.00 0.00 0.00 58.73 58.69 2hgq h TYR 45 Cb 0.00 -0.19 -0.07 0.00 0.00 0.00 0.00 36.73 36.48 2hgq h TYR 45 CO 0.00 0.67 -0.31 0.74 -0.00 0.00 0.00 178.16 179.25 2hgq h PHE 46 N 0.61 -0.86 0.05 0.10 -1.00 0.70 0.32 116.94 116.85 2hgq h PHE 46 Ca 0.12 0.04 -0.00 0.00 2.81 0.00 0.00 57.97 60.94 2hgq h PHE 46 Cb 0.43 0.40 -0.00 0.00 3.61 0.00 0.00 35.95 40.39 2hgq h PHE 46 CO 0.02 -0.39 -0.05 0.28 -1.61 0.00 0.00 178.31 176.56 2hgq h VAL 47 N -0.37 0.00 -0.82 -0.55 2.07 -0.63 -1.14 116.25 114.81 2hgq h VAL 47 Ca 0.10 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.74 2hgq h VAL 47 Cb 0.54 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.18 2hgq h VAL 47 CO -0.37 0.00 -0.37 0.00 0.02 0.00 0.00 177.57 176.85 2hgq n ALA 48 N -2.29 -0.23 0.14 1.67 0.00 -0.26 -0.12 120.51 119.41 2hgq n ALA 48 Ca -0.01 0.78 -0.14 0.00 0.00 0.00 0.00 53.44 54.07 2hgq n ALA 48 Cb 0.04 -0.29 -0.06 0.00 0.00 0.00 0.00 19.45 19.14 2hgq n ALA 48 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2hgq h LYS 49 N 0.00 -0.53 -0.91 0.00 1.79 -0.78 0.15 116.57 116.29 2hgq h LYS 49 Ca 0.24 0.04 0.24 0.00 -2.18 0.00 0.00 60.65 58.99 2hgq h LYS 49 Cb 0.44 0.12 -0.13 0.00 -1.58 0.00 0.00 32.23 31.08 2hgq h LYS 49 CO -0.80 -0.35 0.37 0.28 -1.08 0.00 0.00 179.45 177.87 2hgq h VAL 50 N -0.55 0.39 0.04 0.50 2.07 0.79 0.80 116.25 120.28 2hgq h VAL 50 Ca 0.02 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.44 2hgq h VAL 50 Cb 0.55 0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.32 2hgq h VAL 50 CO -0.13 0.06 -0.38 -0.07 0.02 0.00 0.00 177.57 177.07 2hgq h LEU 51 N 0.33 -1.17 -0.97 2.57 4.07 0.88 -1.04 115.31 119.98 2hgq h LEU 51 Ca 0.59 0.13 0.09 0.00 0.08 0.00 0.00 57.88 58.77 2hgq h LEU 51 Cb 1.19 0.44 -0.12 0.00 1.08 0.00 0.00 40.66 43.25 2hgq h LEU 51 CO -0.58 -0.39 -0.56 -0.62 -1.08 0.00 0.00 178.44 175.21 2hgq n GLU 52 N -4.61 -0.41 0.12 1.13 4.71 0.27 -0.36 120.64 121.50 2hgq n GLU 52 Ca -0.06 1.47 -0.13 0.00 -0.01 0.00 0.00 57.16 58.44 2hgq n GLU 52 Cb 0.29 -2.16 -0.06 0.00 -1.01 0.00 0.00 31.44 28.49 2hgq n GLU 52 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2hgq h SER 53 N 0.00 -0.50 -0.82 1.62 0.87 -1.06 -0.08 113.55 113.58 2hgq h SER 53 Ca 0.17 0.05 0.07 0.00 -1.23 0.00 0.00 61.79 60.86 2hgq h SER 53 Cb 0.41 0.18 -0.10 0.00 -0.44 0.00 0.00 62.40 62.46 2hgq h SER 53 CO -0.92 -0.27 -0.49 0.00 -0.53 0.00 0.00 176.83 174.62 2hgq n ALA 54 N -2.44 -0.53 -0.35 6.23 0.00 0.52 0.73 120.51 124.67 2hgq n ALA 54 Ca -0.07 0.70 0.04 0.00 0.00 0.00 0.00 53.44 54.11 2hgq n ALA 54 Cb 0.22 -0.10 0.22 0.00 0.00 0.00 0.00 19.45 19.79 2hgq n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hgq h ALA 55 N 0.37 1.48 -0.08 0.00 0.00 -0.44 -0.52 119.26 120.07 2hgq h ALA 55 Ca 0.13 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2hgq h ALA 55 Cb 0.34 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2hgq h ALA 55 CO -0.77 0.35 0.02 0.00 0.00 0.00 0.00 179.25 178.84 2hgq h ALA 56 N 1.50 0.11 -0.56 0.00 0.00 0.22 -0.38 119.26 120.15 2hgq h ALA 56 Ca 0.44 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 55.32 2hgq h ALA 56 Cb 0.27 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 17.93 2hgq h ALA 56 CO -0.19 -0.25 -0.03 -0.91 0.00 0.00 0.00 179.25 177.87 2hgq h ASN 57 N -0.09 -0.30 0.00 0.00 -0.26 -0.71 -0.56 115.58 113.65 2hgq h ASN 57 Ca 0.03 0.14 0.00 0.00 -0.56 0.00 0.00 56.30 55.91 2hgq h ASN 57 Cb 0.26 0.26 0.00 0.00 -1.06 0.00 0.00 38.32 37.79 2hgq h ASN 57 CO 0.00 -0.11 0.00 0.00 -1.06 0.00 0.00 177.43 176.26 2hgq n ALA 58 N -2.78 0.00 0.00 -0.83 0.00 -0.23 -0.78 120.51 115.89 2hgq n ALA 58 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2hgq n ALA 58 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.76 2hgq n ALA 58 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2hgq n VAL 59 N 0.00 1.62 -0.06 0.00 0.31 -0.21 0.57 118.33 120.56 2hgq n VAL 59 Ca 0.00 0.44 -0.04 0.00 -0.01 0.00 0.00 64.34 64.72 2hgq n VAL 59 Cb 0.00 -1.44 -0.04 0.00 -0.91 0.00 0.00 33.84 31.46 2hgq n VAL 59 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 2hgq h ASN 60 N 0.00 0.00 0.00 4.52 -1.24 -1.09 -3.34 115.58 114.44 2hgq h ASN 60 Ca 0.00 -0.25 0.00 0.00 0.71 0.00 0.00 56.30 56.76 2hgq h ASN 60 Cb 0.06 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.11 2hgq h ASN 60 CO 0.00 0.67 -0.06 0.59 -1.29 0.00 0.00 177.43 177.34 2hgq n ASN 61 N -4.72 1.24 0.00 1.15 3.02 0.04 -4.60 115.26 111.39 2hgq n ASN 61 Ca -0.04 -1.91 0.00 0.00 -0.03 0.00 0.00 54.58 52.60 2hgq n ASN 61 Cb 0.15 -0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 2hgq n ASN 61 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 2hgq n HIS 62 N -0.46 0.00 0.00 3.10 -0.00 0.08 -4.99 115.22 112.94 2hgq n HIS 62 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.75 2hgq n HIS 62 Cb 0.45 0.03 0.00 0.00 -0.00 0.00 0.00 29.99 30.46 2hgq n HIS 62 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 2hgq n ASP 63 N -2.17 0.00 0.00 0.26 9.92 2.30 -4.86 116.55 122.00 2hgq n ASP 63 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2hgq n ASP 63 Cb 0.29 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.77 2hgq n ASP 63 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 2hgq n MET 64 N 0.00 0.00 0.00 -1.24 1.56 -1.26 -3.30 117.12 112.88 2hgq n MET 64 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 2hgq n MET 64 Cb 0.00 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.37 2hgq n MET 64 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 2hgq n LEU 65 N 0.00 0.00 -0.00 -0.89 7.99 -1.26 -4.65 117.00 118.19 2hgq n LEU 65 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 56.01 56.00 2hgq n LEU 65 Cb 0.00 0.00 -0.00 0.00 -0.11 0.00 0.00 43.42 43.31 2hgq n LEU 65 CO 0.00 0.00 0.03 1.21 -1.51 0.00 0.00 177.39 177.12 2hgq n GLU 66 N 0.00 -0.00 -0.39 3.23 0.00 -1.23 -0.85 120.64 121.40 2hgq n GLU 66 Ca 0.00 0.07 0.31 0.00 0.00 0.00 0.00 57.16 57.54 2hgq n GLU 66 Cb 0.00 -0.10 0.51 0.00 0.00 0.00 0.00 31.44 31.85 2hgq n GLU 66 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 2hgq n ASP 67 N -2.15 0.09 -1.22 4.31 5.75 -1.26 -0.76 116.55 121.30 2hgq n ASP 67 Ca 0.00 0.84 0.11 0.00 -0.01 0.00 0.00 54.79 55.74 2hgq n ASP 67 Cb 0.00 -0.42 0.28 0.00 -1.03 0.00 0.00 41.12 39.96 2hgq n ASP 67 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 2hgq n ARG 68 N -3.76 2.55 -1.68 0.11 1.85 -0.03 -4.88 116.66 110.82 2hgq n ARG 68 Ca 0.29 -2.39 -0.43 0.00 -1.00 0.00 0.00 57.85 54.31 2hgq n ARG 68 Cb 1.20 -1.53 -0.03 0.00 -1.05 0.00 0.00 32.46 31.05 2hgq n ARG 68 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2hgq n LEU 69 N 1.49 3.90 -4.01 2.89 4.32 0.06 -3.68 117.00 121.96 2hgq n LEU 69 Ca 0.22 0.99 -0.17 0.00 -0.02 0.00 0.00 56.01 57.03 2hgq n LEU 69 Cb 0.58 -1.51 -0.14 0.00 -1.62 0.00 0.00 43.42 40.73 2hgq n LEU 69 CO 0.16 0.11 -0.42 -0.72 -1.22 0.00 0.00 177.39 175.30 2hgq s TYR 70 N 2.90 0.69 0.13 -1.77 -0.85 -0.22 -2.37 117.35 115.86 2hgq s TYR 70 Ca 0.84 -0.20 -0.31 0.00 -0.52 0.00 0.00 57.07 56.88 2hgq s TYR 70 Cb -0.52 -0.43 -0.11 0.00 0.38 0.00 0.00 41.96 41.28 2hgq s TYR 70 CO 0.40 -0.02 1.82 1.55 -1.52 0.00 0.00 175.55 177.78 2hgq n VAL 71 N 2.60 0.32 -4.88 -3.49 3.14 -0.37 -0.69 118.33 114.96 2hgq n VAL 71 Ca -0.15 -0.06 -0.27 0.00 -2.96 0.00 0.00 64.34 60.90 2hgq n VAL 71 Cb 0.57 -2.10 -0.16 0.00 -1.06 0.00 0.00 33.84 31.08 2hgq n VAL 71 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 2hgq s LYS 72 N 2.53 2.12 0.09 1.45 2.20 0.05 -3.78 119.74 124.40 2hgq s LYS 72 Ca 0.81 -0.63 0.00 0.00 -0.36 0.00 0.00 55.97 55.79 2hgq s LYS 72 Cb -0.49 -1.73 0.00 0.00 -1.51 0.00 0.00 37.83 34.10 2hgq s LYS 72 CO 0.37 0.17 0.00 0.00 -0.36 0.00 0.00 175.35 175.53 2hgq n ALA 73 N 3.43 -1.23 0.00 3.13 0.00 -1.26 -4.00 120.51 120.58 2hgq n ALA 73 Ca -0.20 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2hgq n ALA 73 Cb 0.52 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 19.24 2hgq n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hgq n ALA 74 N 0.48 0.00 0.00 0.00 0.00 -1.26 -1.11 120.51 118.62 2hgq n ALA 74 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hgq n ALA 74 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2hgq n ALA 74 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2hgq n TYR 75 N -0.50 0.00 -4.38 0.00 0.53 0.40 -4.92 117.16 108.29 2hgq n TYR 75 Ca 0.00 0.00 -0.27 0.00 -1.02 0.00 0.00 57.90 56.61 2hgq n TYR 75 Cb 0.00 0.00 -0.09 0.00 -1.03 0.00 0.00 39.34 38.22 2hgq n TYR 75 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38 2hgq s VAL 76 N -2.97 2.05 0.00 -0.72 0.11 -1.26 -1.09 120.40 116.52 2hgq s VAL 76 Ca 0.00 -1.84 -0.01 0.00 -2.93 0.00 0.00 61.98 57.20 2hgq s VAL 76 Cb 0.00 -2.89 -0.01 0.00 -1.53 0.00 0.00 36.38 31.96 2hgq s VAL 76 CO 0.00 0.00 0.01 -0.62 -3.33 0.00 0.00 175.10 171.16 2hgq s ASP 77 N -3.84 0.08 -0.09 3.54 2.15 -0.18 -4.79 116.67 113.55 2hgq s ASP 77 Ca 0.35 -0.18 0.04 0.00 0.43 0.00 0.00 52.55 53.19 2hgq s ASP 77 Cb 0.06 0.07 -0.00 0.00 -0.30 0.00 0.00 42.92 42.75 2hgq s ASP 77 CO 0.19 -0.14 -0.23 -0.70 -0.17 0.00 0.00 175.17 174.12 2hgq s GLU 78 N -0.62 2.76 0.00 4.34 2.56 -1.26 -0.70 118.70 125.78 2hgq s GLU 78 Ca -0.07 -0.83 0.00 0.00 0.00 0.00 0.00 54.97 54.07 2hgq s GLU 78 Cb -0.04 -2.15 0.00 0.00 2.00 0.00 0.00 34.13 33.93 2hgq s GLU 78 CO -0.00 0.21 0.00 0.41 -0.56 0.00 0.00 175.26 175.32 2hgq n GLY 79 N 3.41 1.64 2.34 -1.50 0.00 0.01 -4.93 105.19 106.14 2hgq n GLY 79 Ca -0.19 -1.70 -0.21 0.00 0.00 0.00 0.00 46.02 43.92 2hgq n GLY 79 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2hgq n PRO 80 N 0.00 -3.70 -4.10 1.61 -0.02 -1.26 -4.47 135.00 123.05 2hgq n PRO 80 Ca 0.00 -1.00 -0.08 0.00 -2.02 0.00 0.00 63.50 60.40 2hgq n PRO 80 Cb 0.00 -1.36 -0.10 0.00 -0.02 0.00 0.00 33.50 32.02 2hgq n PRO 80 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hgq s ALA 81 N -2.07 0.60 0.03 3.55 0.00 -1.26 -1.31 121.76 121.31 2hgq s ALA 81 Ca 0.46 -1.21 -0.26 0.00 0.00 0.00 0.00 51.96 50.95 2hgq s ALA 81 Cb -0.08 0.24 -0.05 0.00 0.00 0.00 0.00 23.12 23.23 2hgq s ALA 81 CO 0.39 -0.33 0.82 -1.17 0.00 0.00 0.00 175.76 175.47 2hgq s LEU 82 N -2.87 4.42 -0.52 0.00 1.98 -0.04 -4.77 118.68 116.88 2hgq s LEU 82 Ca 0.07 1.49 -0.16 0.00 -2.89 0.00 0.00 54.13 52.63 2hgq s LEU 82 Cb 0.06 -3.31 0.10 0.00 0.66 0.00 0.00 46.19 43.71 2hgq s LEU 82 CO -0.08 -0.06 0.50 -0.54 -1.89 0.00 0.00 176.35 174.28 2hgq s LYS 83 N 0.26 3.00 0.20 1.98 1.02 -1.26 -0.88 119.74 124.06 2hgq s LYS 83 Ca 0.42 -1.50 0.08 0.00 0.02 0.00 0.00 55.97 54.99 2hgq s LYS 83 Cb -0.21 -4.23 -0.04 0.00 -0.52 0.00 0.00 37.83 32.83 2hgq s LYS 83 CO 0.24 -1.25 0.01 1.03 -0.92 0.00 0.00 175.35 174.45 2hgq s ARG 84 N 1.81 2.40 -0.04 1.68 0.52 0.34 -4.99 118.95 120.67 2hgq s ARG 84 Ca 0.05 -1.18 0.02 0.00 -0.52 0.00 0.00 55.73 54.10 2hgq s ARG 84 Cb -0.27 -2.32 0.01 0.00 0.52 0.00 0.00 34.95 32.90 2hgq s ARG 84 CO 0.05 0.43 -0.07 0.14 0.02 0.00 0.00 175.30 175.87 2hgq s VAL 85 N -1.89 0.71 0.38 3.52 -7.23 -1.26 -1.06 120.40 113.57 2hgq s VAL 85 Ca 0.29 -0.28 0.02 0.00 -1.81 0.00 0.00 61.98 60.20 2hgq s VAL 85 Cb -0.08 -0.67 0.02 0.00 0.56 0.00 0.00 36.38 36.20 2hgq s VAL 85 CO 0.19 0.24 0.14 0.18 -0.31 0.00 0.00 175.10 175.55 2hgq n LEU 86 N 3.62 0.00 -4.76 1.32 4.77 -0.21 -4.99 117.00 116.75 2hgq n LEU 86 Ca -0.21 -2.15 -0.33 0.00 -0.03 0.00 0.00 56.01 53.28 2hgq n LEU 86 Cb 0.53 0.11 -0.08 0.00 -2.33 0.00 0.00 43.42 41.66 2hgq n LEU 86 CO 0.24 -0.40 -0.27 -2.16 -1.33 0.00 0.00 177.39 173.47 2hgq s PRO 87 N -3.45 3.00 -0.33 3.23 0.04 -1.26 -3.42 135.00 132.81 2hgq s PRO 87 Ca 0.11 -0.51 0.16 0.00 0.04 0.00 0.00 61.00 60.81 2hgq s PRO 87 Cb -0.01 -2.82 0.45 0.00 0.04 0.00 0.00 34.50 32.16 2hgq s PRO 87 CO 0.07 0.65 1.08 -2.13 0.04 0.00 0.00 177.00 176.70 2hgq n ARG 88 N 1.29 1.23 -0.09 4.56 3.00 -1.03 -4.93 116.66 120.69 2hgq n ARG 88 Ca -0.14 -2.90 0.00 0.00 -0.00 0.00 0.00 57.85 54.82 2hgq n ARG 88 Cb 0.53 -0.96 -0.00 0.00 0.00 0.00 0.00 32.46 32.02 2hgq n ARG 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2hgq n ALA 89 N -0.29 -0.47 -3.19 5.13 0.00 -1.26 -4.74 120.51 115.69 2hgq n ALA 89 Ca 0.05 0.04 -0.22 0.00 0.00 0.00 0.00 53.44 53.31 2hgq n ALA 89 Cb 0.83 -0.41 -0.04 0.00 0.00 0.00 0.00 19.45 19.82 2hgq n ALA 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2hgq n ARG 90 N -1.76 -0.87 0.00 0.00 5.12 -1.26 -3.30 116.66 114.60 2hgq n ARG 90 Ca -0.00 0.07 0.00 0.00 -1.93 0.00 0.00 57.85 55.99 2hgq n ARG 90 Cb 0.03 -2.40 0.00 0.00 -1.16 0.00 0.00 32.46 28.93 2hgq n ARG 90 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2hgq n GLY 91 N -0.99 1.10 1.12 -0.13 0.00 -1.26 -4.96 105.19 100.06 2hgq n GLY 91 Ca 0.02 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.37 2hgq n GLY 91 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2hgq n ARG 92 N 0.00 -0.79 -3.10 1.61 0.63 -1.21 -2.47 116.66 111.34 2hgq n ARG 92 Ca 0.00 0.59 -0.41 0.00 -0.92 0.00 0.00 57.85 57.11 2hgq n ARG 92 Cb 0.00 -1.11 -0.06 0.00 0.45 0.00 0.00 32.46 31.73 2hgq n ARG 92 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2hgq s ALA 93 N -3.57 3.52 -0.36 5.13 0.00 -1.26 -3.77 121.76 121.44 2hgq s ALA 93 Ca 0.00 -0.67 -0.09 0.00 0.00 0.00 0.00 51.96 51.20 2hgq s ALA 93 Cb 0.00 -3.14 0.03 0.00 0.00 0.00 0.00 23.12 20.02 2hgq s ALA 93 CO 0.00 -1.14 0.17 0.16 0.00 0.00 0.00 175.76 174.95 2hgq s ASP 94 N 1.67 5.59 0.10 0.00 3.84 -1.22 -5.03 116.67 121.62 2hgq s ASP 94 Ca 0.26 -1.03 0.02 0.00 -0.00 0.00 0.00 52.55 51.79 2hgq s ASP 94 Cb -0.15 -1.97 -0.04 0.00 -1.38 0.00 0.00 42.92 39.38 2hgq s ASP 94 CO 0.13 -0.36 0.20 0.27 -0.00 0.00 0.00 175.17 175.41 2hgq s ILE 95 N 1.50 5.12 0.06 2.11 -5.25 -1.26 -1.05 121.20 122.43 2hgq s ILE 95 Ca 0.01 -0.63 -0.12 0.00 -0.99 0.00 0.00 60.65 58.92 2hgq s ILE 95 Cb -0.19 -3.55 0.01 0.00 2.95 0.00 0.00 42.46 41.68 2hgq s ILE 95 CO 0.05 0.03 0.27 0.27 -1.79 0.00 0.00 174.94 173.77 2hgq s ILE 96 N -1.59 0.10 -0.27 8.37 -4.36 -0.22 -4.98 121.20 118.24 2hgq s ILE 96 Ca 0.33 -0.81 -0.03 0.00 -0.26 0.00 0.00 60.65 59.89 2hgq s ILE 96 Cb -0.12 -1.03 0.11 0.00 1.25 0.00 0.00 42.46 42.68 2hgq s ILE 96 CO 0.27 -0.45 0.22 -1.59 0.24 0.00 0.00 174.94 173.63 2hgq s LYS 97 N -2.91 0.24 0.39 0.37 -2.85 -1.24 -0.50 119.74 113.23 2hgq s LYS 97 Ca -0.02 -0.20 -0.25 0.00 -1.00 0.00 0.00 55.97 54.50 2hgq s LYS 97 Cb 0.00 -0.99 -0.09 0.00 -2.06 0.00 0.00 37.83 34.69 2hgq s LYS 97 CO -0.06 -0.94 1.06 0.21 0.10 0.00 0.00 175.35 175.72 2hgq s LYS 98 N 2.26 4.21 -0.38 1.78 2.36 -0.06 -4.68 119.74 125.23 2hgq s LYS 98 Ca 0.08 1.55 -0.29 0.00 -2.55 0.00 0.00 55.97 54.76 2hgq s LYS 98 Cb -0.15 -2.61 0.00 0.00 -1.05 0.00 0.00 37.83 34.02 2hgq s LYS 98 CO -0.29 -0.10 1.50 1.03 1.55 0.00 0.00 175.35 179.04 2hgq s ARG 99 N -2.38 3.54 -0.48 4.03 1.81 -1.26 -0.86 118.95 123.36 2hgq s ARG 99 Ca 0.56 1.09 -0.22 0.00 -1.72 0.00 0.00 55.73 55.43 2hgq s ARG 99 Cb -0.23 -4.06 0.03 0.00 -0.45 0.00 0.00 34.95 30.24 2hgq s ARG 99 CO 0.29 -1.61 0.78 0.95 -0.68 0.00 0.00 175.30 175.03 2hgq s THR 100 N 5.72 4.64 0.29 0.02 -4.23 -0.42 -2.93 115.64 118.73 2hgq s THR 100 Ca 0.66 0.23 -0.21 0.00 -1.18 0.00 0.00 61.69 61.20 2hgq s THR 100 Cb -0.16 -4.35 -0.09 0.00 1.34 0.00 0.00 72.50 69.24 2hgq s THR 100 CO 0.32 -0.80 0.81 -0.44 -0.54 0.00 0.00 174.62 173.97 2hgq s SER 101 N 2.34 7.07 -0.01 3.99 0.01 0.92 -0.81 113.70 127.20 2hgq s SER 101 Ca 0.27 1.53 0.02 0.00 1.31 0.00 0.00 55.95 59.08 2hgq s SER 101 Cb -0.13 -2.47 0.00 0.00 0.21 0.00 0.00 66.02 63.63 2hgq s SER 101 CO 0.20 -0.08 -0.06 -1.00 0.41 0.00 0.00 173.24 172.71 2hgq s HIS 102 N -1.70 0.57 -0.07 2.43 3.76 0.12 -0.92 115.29 119.49 2hgq s HIS 102 Ca 0.49 -0.11 0.04 0.00 -0.15 0.00 0.00 55.06 55.32 2hgq s HIS 102 Cb -0.15 -0.40 -0.02 0.00 1.11 0.00 0.00 32.58 33.12 2hgq s HIS 102 CO 0.20 -0.04 -0.17 0.96 -0.85 0.00 0.00 174.74 174.84 2hgq s ILE 103 N 0.05 2.76 -0.70 0.60 -0.00 -0.23 -1.01 121.20 122.67 2hgq s ILE 103 Ca -0.00 -0.82 0.05 0.00 -0.00 0.00 0.00 60.65 59.88 2hgq s ILE 103 Cb -0.05 -2.08 0.21 0.00 -0.00 0.00 0.00 42.46 40.55 2hgq s ILE 103 CO -0.00 0.57 0.66 1.07 -0.00 0.00 0.00 174.94 177.24 2hgq n THR 104 N 2.70 2.18 -4.74 8.37 5.66 -0.25 -1.44 114.28 126.75 2hgq n THR 104 Ca -0.17 -5.08 -0.26 0.00 -3.05 0.00 0.00 64.05 55.48 2hgq n THR 104 Cb 0.52 -2.16 -0.17 0.00 -1.55 0.00 0.00 70.33 66.98 2hgq n THR 104 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2hgq s VAL 105 N -1.97 1.35 -0.01 1.08 0.11 0.08 -0.45 120.40 120.58 2hgq s VAL 105 Ca 0.32 -0.62 0.08 0.00 -2.93 0.00 0.00 61.98 58.83 2hgq s VAL 105 Cb 0.05 -1.20 -0.02 0.00 -1.53 0.00 0.00 36.38 33.67 2hgq s VAL 105 CO -0.09 0.40 -0.24 -0.51 -3.33 0.00 0.00 175.10 171.34 2hgq s ILE 106 N 0.50 2.27 -0.12 7.04 1.10 -0.27 -0.92 121.20 130.79 2hgq s ILE 106 Ca -0.14 -1.12 -0.16 0.00 -0.51 0.00 0.00 60.65 58.72 2hgq s ILE 106 Cb -0.15 -1.83 -0.04 0.00 0.15 0.00 0.00 42.46 40.58 2hgq s ILE 106 CO 0.04 0.52 0.40 -0.22 -2.11 0.00 0.00 174.94 173.57 2hgq s LEU 107 N -0.82 4.28 0.09 8.50 2.96 0.17 -0.77 118.68 133.09 2hgq s LEU 107 Ca 0.11 0.71 0.09 0.00 -0.22 0.00 0.00 54.13 54.82 2hgq s LEU 107 Cb -0.10 -2.56 -0.03 0.00 0.50 0.00 0.00 46.19 44.00 2hgq s LEU 107 CO 0.00 0.07 -0.23 -0.83 -1.32 0.00 0.00 176.35 174.04 2hgq s GLY 108 N 0.39 1.33 0.02 7.98 0.00 0.13 -1.33 107.32 115.84 2hgq s GLY 108 Ca 0.22 -1.27 -0.17 0.00 0.00 0.00 0.00 44.72 43.50 2hgq s GLY 108 CO 0.08 -1.23 0.49 -0.54 0.00 0.00 0.00 173.10 171.90 2hgq s GLU 109 N -1.68 4.10 0.00 2.90 0.41 -1.26 -1.05 118.70 122.12 2hgq s GLU 109 Ca 0.09 0.57 0.00 0.00 -0.41 0.00 0.00 54.97 55.22 2hgq s GLU 109 Cb -0.10 -3.26 0.00 0.00 -1.78 0.00 0.00 34.13 28.99 2hgq s GLU 109 CO 0.04 0.59 0.00 1.17 -0.49 0.00 0.00 175.26 176.57