#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgc n LEU 6 N 0.00 3.27 0.19 3.14 7.99 -1.26 -4.43 117.00 125.90 2hgc n LEU 6 Ca 0.00 -1.31 -0.13 0.00 -0.01 0.00 0.00 56.01 54.56 2hgc n LEU 6 Cb 0.00 -0.15 -0.07 0.00 -0.11 0.00 0.00 43.42 43.08 2hgc n LEU 6 CO 0.00 0.65 0.48 0.03 -1.51 0.00 0.00 177.39 177.04 2hgc h ARG 7 N 4.51 -0.50 -0.78 3.23 2.47 -1.98 -1.57 114.38 119.75 2hgc h ARG 7 Ca 0.00 0.03 -0.03 0.00 -1.26 0.00 0.00 59.98 58.72 2hgc h ARG 7 Cb 0.98 0.11 -0.04 0.00 -1.65 0.00 0.00 29.97 29.38 2hgc h ARG 7 CO 0.00 -0.19 0.36 -0.92 0.56 0.00 0.00 179.97 179.78 2hgc h TYR 8 N -0.89 1.14 -0.56 3.04 3.20 -1.97 -2.09 116.97 118.83 2hgc h TYR 8 Ca -0.05 -0.06 0.04 0.00 3.14 0.00 0.00 58.73 61.79 2hgc h TYR 8 Cb 0.55 -0.35 -0.04 0.00 1.54 0.00 0.00 36.73 38.43 2hgc h TYR 8 CO 0.02 0.84 0.32 0.00 -1.64 0.00 0.00 178.16 177.70 2hgc h ALA 9 N 1.19 0.72 -0.27 1.82 0.00 -1.75 0.13 119.26 121.10 2hgc h ALA 9 Ca 0.27 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 55.00 2hgc h ALA 9 Cb 0.14 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2hgc h ALA 9 CO -0.03 0.01 -0.55 0.82 0.00 0.00 0.00 179.25 179.50 2hgc h ILE 10 N 0.62 1.28 -0.60 0.00 2.04 -1.22 -2.63 117.51 117.01 2hgc h ILE 10 Ca 0.23 -1.74 0.06 0.00 1.00 0.00 0.00 64.86 64.41 2hgc h ILE 10 Cb 0.08 1.65 -0.05 0.00 -0.74 0.00 0.00 36.82 37.75 2hgc h ILE 10 CO -0.13 0.56 0.30 -0.07 0.00 0.00 0.00 178.15 178.82 2hgc h LEU 11 N 0.63 0.41 -0.88 1.44 3.38 -0.63 0.12 115.31 119.77 2hgc h LEU 11 Ca 0.01 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2hgc h LEU 11 Cb 1.15 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.82 2hgc h LEU 11 CO 0.12 0.27 0.37 0.50 0.09 0.00 0.00 178.44 179.79 2hgc h LYS 12 N 0.56 1.18 -0.51 1.13 3.64 -0.71 0.66 116.57 122.51 2hgc h LYS 12 Ca 0.27 -0.18 -0.06 0.00 -1.27 0.00 0.00 60.65 59.41 2hgc h LYS 12 Cb 0.21 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 2hgc h LYS 12 CO -0.20 0.92 0.06 1.49 -2.27 0.00 0.00 179.45 179.45 2hgc h GLU 13 N 1.16 0.83 -0.37 1.90 4.57 -0.94 -2.20 114.58 119.53 2hgc h GLU 13 Ca 0.28 -0.20 -0.06 0.00 -1.18 0.00 0.00 59.36 58.20 2hgc h GLU 13 Cb 0.14 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 2hgc h GLU 13 CO -0.03 0.79 0.01 0.82 -1.18 0.00 0.00 179.01 179.42 2hgc h ILE 14 N 0.78 1.26 -0.03 2.32 2.04 -0.39 0.13 117.51 123.62 2hgc h ILE 14 Ca 0.16 -0.97 0.01 0.00 1.00 0.00 0.00 64.86 65.07 2hgc h ILE 14 Cb 0.39 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 2hgc h ILE 14 CO 0.01 0.32 -0.04 0.15 0.00 0.00 0.00 178.15 178.59 2hgc h PHE 15 N 0.46 -0.11 0.00 1.37 3.57 -0.44 -2.11 116.94 119.68 2hgc h PHE 15 Ca 0.10 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.61 2hgc h PHE 15 Cb 0.45 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.24 2hgc h PHE 15 CO 0.04 -0.07 -1.50 -0.85 -2.23 0.00 0.00 178.31 173.69 2hgc n GLU 16 N -5.16 0.57 0.16 1.11 0.28 -0.87 -4.09 120.64 112.65 2hgc n GLU 16 Ca -0.06 -0.06 0.03 0.00 -0.16 0.00 0.00 57.16 56.91 2hgc n GLU 16 Cb 0.09 -1.63 0.21 0.00 1.43 0.00 0.00 31.44 31.54 2hgc n GLU 16 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 2hgc h GLY 17 N 4.10 0.00 0.00 -1.84 0.00 -0.67 -3.47 103.07 101.20 2hgc h GLY 17 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2hgc h GLY 17 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 176.54 174.53 2hgc n ASN 18 N -3.52 0.00 -1.56 0.19 4.05 -0.80 -4.79 115.26 108.83 2hgc n ASN 18 Ca -0.00 0.00 0.06 0.00 0.45 0.00 0.00 54.58 55.09 2hgc n ASN 18 Cb 0.61 -0.67 -0.04 0.00 1.23 0.00 0.00 39.78 40.91 2hgc n ASN 18 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 177.26 174.56 2hgc n THR 19 N -2.00 -2.23 -2.01 -0.44 -2.24 -1.26 -4.75 114.28 99.35 2hgc n THR 19 Ca 0.00 1.29 -0.29 0.00 -2.27 0.00 0.00 64.05 62.78 2hgc n THR 19 Cb 0.00 -2.09 0.06 0.00 -2.10 0.00 0.00 70.33 66.20 2hgc n THR 19 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2hgc s PRO 20 N -5.06 2.48 0.01 -0.78 0.05 -1.17 -4.40 135.00 126.14 2hgc s PRO 20 Ca 0.00 0.17 -0.01 0.00 0.05 0.00 0.00 61.00 61.21 2hgc s PRO 20 Cb 0.00 -2.06 -0.01 0.00 0.05 0.00 0.00 34.50 32.48 2hgc s PRO 20 CO 0.00 -1.20 0.00 -0.48 0.05 0.00 0.00 177.00 175.37 2hgc s LEU 21 N -5.36 2.10 0.66 -3.56 2.34 -1.26 -5.05 118.68 108.55 2hgc s LEU 21 Ca 0.59 -0.40 -0.07 0.00 0.06 0.00 0.00 54.13 54.31 2hgc s LEU 21 Cb -0.11 0.19 0.03 0.00 -0.56 0.00 0.00 46.19 45.74 2hgc s LEU 21 CO 0.49 -0.28 0.98 -0.55 -1.06 0.00 0.00 176.35 175.92 2hgc s SER 22 N -1.31 5.20 -0.11 1.48 0.15 -1.26 -4.93 113.70 112.91 2hgc s SER 22 Ca -0.14 0.63 -0.26 0.00 0.70 0.00 0.00 55.95 56.88 2hgc s SER 22 Cb -0.09 -1.44 -0.27 0.00 -1.71 0.00 0.00 66.02 62.51 2hgc s SER 22 CO -0.01 -1.35 0.77 1.05 1.20 0.00 0.00 173.24 174.91 2hgc h GLU 23 N -0.43 0.10 0.00 5.44 -0.00 -1.89 -2.67 114.58 115.12 2hgc h GLU 23 Ca -0.45 -0.16 -0.05 0.00 -0.00 0.00 0.00 59.36 58.69 2hgc h GLU 23 Cb 1.29 0.06 -0.01 0.00 -0.00 0.00 0.00 28.75 30.09 2hgc h GLU 23 CO 0.61 1.08 -0.26 -0.97 -0.00 0.00 0.00 179.01 179.47 2hgc h ASN 24 N -0.79 0.00 -0.19 3.06 -0.00 -1.82 0.22 115.58 116.06 2hgc h ASN 24 Ca -0.07 0.00 -0.20 0.00 -0.00 0.00 0.00 56.30 56.03 2hgc h ASN 24 Cb 1.23 0.00 0.01 0.00 -0.00 0.00 0.00 38.32 39.55 2hgc h ASN 24 CO 0.04 0.26 -0.66 -0.78 -0.00 0.00 0.00 177.43 176.29 2hgc h ASP 25 N 0.00 0.91 0.48 1.15 3.58 -1.85 -3.05 116.42 117.63 2hgc h ASP 25 Ca -0.00 -0.60 -0.18 0.00 0.42 0.00 0.00 57.03 56.67 2hgc h ASP 25 Cb 0.53 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.30 2hgc h ASP 25 CO 0.03 1.35 -0.76 -0.29 -2.88 0.00 0.00 179.24 176.70 2hgc h ILE 26 N 0.52 1.44 0.00 2.25 -0.00 -1.21 -3.48 117.51 117.03 2hgc h ILE 26 Ca -0.03 -2.34 0.00 0.00 -0.00 0.00 0.00 64.86 62.49 2hgc h ILE 26 Cb 1.29 2.26 0.00 0.00 -0.00 0.00 0.00 36.82 40.37 2hgc h ILE 26 CO 0.14 0.69 0.00 0.61 -0.00 0.00 0.00 178.15 179.59 2hgc n GLY 27 N 0.61 1.48 3.46 8.18 0.00 -0.15 -5.08 105.19 113.70 2hgc n GLY 27 Ca -0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 2hgc n GLY 27 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2hgc s VAL 28 N -1.48 0.69 0.75 1.61 -7.23 0.60 -4.97 120.40 110.37 2hgc s VAL 28 Ca 0.00 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.10 2hgc s VAL 28 Cb 0.00 -2.49 0.09 0.00 0.56 0.00 0.00 36.38 34.54 2hgc s VAL 28 CO 0.00 0.00 1.07 0.42 -0.31 0.00 0.00 175.10 176.28 2hgc s THR 29 N -3.32 2.20 0.09 5.32 -4.23 -1.26 -2.60 115.64 111.84 2hgc s THR 29 Ca 0.29 -0.27 -0.27 0.00 -1.18 0.00 0.00 61.69 60.27 2hgc s THR 29 Cb 0.05 -2.93 -0.13 0.00 1.34 0.00 0.00 72.50 70.82 2hgc s THR 29 CO 0.15 0.00 1.67 -0.33 -0.54 0.00 0.00 174.62 175.58 2hgc h GLU 30 N -0.78 -0.39 0.00 3.99 5.08 -1.99 -1.63 114.58 118.87 2hgc h GLU 30 Ca -0.43 0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 57.89 2hgc h GLU 30 Cb 1.30 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 2hgc h GLU 30 CO 0.54 -0.26 -0.29 -0.44 -1.00 0.00 0.00 179.01 177.56 2hgc h ASP 31 N -0.40 0.00 -0.14 1.42 5.19 -1.98 0.30 116.42 120.82 2hgc h ASP 31 Ca -0.01 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.35 2hgc h ASP 31 Cb 0.36 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.87 2hgc h ASP 31 CO -0.02 0.29 -0.11 1.56 -3.12 0.00 0.00 179.24 177.84 2hgc h GLN 32 N 0.00 0.32 -0.39 3.56 4.20 -1.89 -0.41 115.11 120.50 2hgc h GLN 32 Ca -0.00 -0.16 -0.02 0.00 0.06 0.00 0.00 58.65 58.53 2hgc h GLN 32 Cb 0.51 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.27 2hgc h GLN 32 CO 0.04 0.68 0.17 0.35 -0.67 0.00 0.00 178.83 179.40 2hgc h PHE 33 N -0.05 0.57 0.03 2.96 3.57 -0.81 -1.67 116.94 121.55 2hgc h PHE 33 Ca 0.03 -0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.52 2hgc h PHE 33 Cb 0.61 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 2hgc h PHE 33 CO 0.08 0.50 -0.24 0.22 -2.23 0.00 0.00 178.31 176.64 2hgc h ASP 34 N 0.48 -0.70 -0.93 0.41 3.58 -0.40 -0.41 116.42 118.46 2hgc h ASP 34 Ca 0.13 0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.67 2hgc h ASP 34 Cb 0.16 0.28 -0.04 0.00 1.72 0.00 0.00 39.33 41.45 2hgc h ASP 34 CO -0.01 -0.31 0.56 -0.78 -2.88 0.00 0.00 179.24 175.81 2hgc h ASP 35 N -0.39 1.12 0.21 2.28 1.82 -0.98 -0.79 116.42 119.70 2hgc h ASP 35 Ca 0.05 -0.07 -0.01 0.00 -0.39 0.00 0.00 57.03 56.61 2hgc h ASP 35 Cb 0.46 -0.28 0.00 0.00 0.68 0.00 0.00 39.33 40.19 2hgc h ASP 35 CO -0.20 0.86 -0.10 0.00 -1.61 0.00 0.00 179.24 178.19 2hgc h ALA 36 N 1.31 -0.29 -0.53 -0.78 0.00 -0.92 0.18 119.26 118.23 2hgc h ALA 36 Ca 0.33 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2hgc h ALA 36 Cb -0.05 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2hgc h ALA 36 CO -0.06 -0.64 0.35 0.28 0.00 0.00 0.00 179.25 179.18 2hgc h VAL 37 N -0.34 1.14 -0.43 0.00 2.07 -0.80 0.60 116.25 118.49 2hgc h VAL 37 Ca -0.03 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 2hgc h VAL 37 Cb 0.26 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 2hgc h VAL 37 CO 0.05 0.13 0.20 0.78 0.02 0.00 0.00 177.57 178.76 2hgc h ASN 38 N 0.72 0.56 -0.24 0.57 2.35 -1.03 -0.03 115.58 118.49 2hgc h ASN 38 Ca 0.19 -0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.79 2hgc h ASN 38 Cb -0.08 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.14 2hgc h ASN 38 CO -0.04 0.54 0.06 0.15 -1.65 0.00 0.00 177.43 176.49 2hgc h PHE 39 N 0.55 0.39 -0.37 1.19 3.57 -0.64 -0.99 116.94 120.63 2hgc h PHE 39 Ca 0.15 -0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 2hgc h PHE 39 Cb 0.12 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 2hgc h PHE 39 CO -0.01 0.46 0.03 -0.07 -2.23 0.00 0.00 178.31 176.49 2hgc h LEU 40 N 0.21 0.53 -0.46 0.59 3.38 -0.74 -1.37 115.31 117.45 2hgc h LEU 40 Ca 0.08 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 2hgc h LEU 40 Cb 0.26 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2hgc h LEU 40 CO -0.00 0.58 -0.10 0.50 0.09 0.00 0.00 178.44 179.51 2hgc h LYS 41 N 0.55 0.88 -0.14 1.13 3.64 -0.79 0.33 116.57 122.17 2hgc h LYS 41 Ca 0.12 -0.33 -0.03 0.00 -1.27 0.00 0.00 60.65 59.14 2hgc h LYS 41 Cb 0.31 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.07 2hgc h LYS 41 CO 0.01 0.98 -0.03 -0.09 -2.27 0.00 0.00 179.45 178.04 2hgc h ARG 42 N 0.72 0.27 0.00 1.90 2.43 -0.53 -3.06 114.38 116.12 2hgc h ARG 42 Ca 0.12 -0.10 -0.05 0.00 -0.81 0.00 0.00 59.98 59.14 2hgc h ARG 42 Cb 0.64 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.17 2hgc h ARG 42 CO 0.04 0.55 -0.22 0.93 -1.51 0.00 0.00 179.97 179.77 2hgc h GLU 43 N -0.03 0.00 -0.05 0.20 4.39 -1.34 -3.47 114.58 114.29 2hgc h GLU 43 Ca 0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.74 2hgc h GLU 43 Cb 0.45 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 2hgc h GLU 43 CO 0.01 0.22 0.00 0.41 -1.16 0.00 0.00 179.01 178.49 2hgc n GLY 44 N 0.53 0.66 0.12 -3.84 0.00 -0.81 -5.03 105.19 96.81 2hgc n GLY 44 Ca 0.01 -0.01 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2hgc n GLY 44 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2hgc n TYR 45 N -0.04 0.16 -3.97 1.61 4.01 0.11 -4.32 117.16 114.72 2hgc n TYR 45 Ca 0.00 0.04 -0.09 0.00 -0.16 0.00 0.00 57.90 57.69 2hgc n TYR 45 Cb 0.01 -1.02 -0.10 0.00 -0.31 0.00 0.00 39.34 37.92 2hgc n TYR 45 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 2hgc s ILE 46 N -2.52 0.15 0.30 -0.72 -5.25 -1.20 -1.17 121.20 110.79 2hgc s ILE 46 Ca -0.24 -1.25 0.02 0.00 -0.99 0.00 0.00 60.65 58.19 2hgc s ILE 46 Cb 0.08 -0.97 -0.05 0.00 2.95 0.00 0.00 42.46 44.46 2hgc s ILE 46 CO 0.70 -0.69 0.09 0.27 -1.79 0.00 0.00 174.94 173.52 2hgc s ILE 47 N -2.81 0.78 0.00 8.37 -4.36 0.41 -4.25 121.20 119.34 2hgc s ILE 47 Ca -0.03 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.36 2hgc s ILE 47 Cb 0.00 -2.67 0.00 0.00 1.25 0.00 0.00 42.46 41.04 2hgc s ILE 47 CO -0.06 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.73 2hgc n GLY 48 N -0.59 0.85 3.62 6.27 0.00 -1.26 -0.62 105.19 113.47 2hgc n GLY 48 Ca -0.01 -0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 2hgc n GLY 48 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hgc s VAL 49 N -2.00 4.29 -0.14 1.61 1.01 -1.26 -4.21 120.40 119.70 2hgc s VAL 49 Ca 0.00 1.43 -0.03 0.00 0.00 0.00 0.00 61.98 63.38 2hgc s VAL 49 Cb 0.00 -4.37 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 2hgc s VAL 49 CO 0.00 -0.62 -0.05 -1.00 0.00 0.00 0.00 175.10 173.43 2hgc s HIS 50 N 4.17 3.00 0.09 5.22 3.76 -1.25 -4.97 115.29 125.30 2hgc s HIS 50 Ca 0.50 -0.27 -0.14 0.00 -0.15 0.00 0.00 55.06 55.00 2hgc s HIS 50 Cb -0.12 -1.91 -0.06 0.00 1.11 0.00 0.00 32.58 31.59 2hgc s HIS 50 CO 0.23 0.02 0.50 0.71 -0.85 0.00 0.00 174.74 175.34 2hgc s TYR 51 N 0.16 3.67 0.00 1.40 2.02 -1.26 0.03 117.35 123.36 2hgc s TYR 51 Ca -0.02 1.04 0.00 0.00 -0.37 0.00 0.00 57.07 57.72 2hgc s TYR 51 Cb -0.14 -2.34 0.00 0.00 -0.40 0.00 0.00 41.96 39.08 2hgc s TYR 51 CO 0.03 0.52 0.00 0.45 -1.57 0.00 0.00 175.55 174.98 2hgc n SER 52 N 1.21 0.00 0.16 2.29 2.88 -1.13 -4.89 113.62 114.14 2hgc n SER 52 Ca -0.09 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.31 2hgc n SER 52 Cb 0.52 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.90 2hgc n SER 52 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 2hgc h ASP 53 N 0.00 -0.32 0.00 -3.46 3.04 -1.99 -3.45 116.42 110.24 2hgc h ASP 53 Ca 0.00 0.02 0.00 0.00 -3.24 0.00 0.00 57.03 53.81 2hgc h ASP 53 Cb 0.00 0.09 0.00 0.00 -1.04 0.00 0.00 39.33 38.38 2hgc h ASP 53 CO 0.00 -0.22 0.00 -0.67 -2.04 0.00 0.00 179.24 176.31 2hgc n ASP 54 N -5.25 0.00 -4.85 4.15 2.03 -1.26 -5.15 116.55 106.21 2hgc n ASP 54 Ca -0.09 0.00 -0.21 0.00 0.52 0.00 0.00 54.79 55.01 2hgc n ASP 54 Cb 0.17 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.53 2hgc n ASP 54 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2hgc s ARG 55 N -0.69 2.79 0.26 -0.67 0.52 -1.26 -4.95 118.95 114.95 2hgc s ARG 55 Ca 0.00 -1.23 -0.30 0.00 -0.52 0.00 0.00 55.73 53.68 2hgc s ARG 55 Cb 0.00 -2.51 -0.11 0.00 0.52 0.00 0.00 34.95 32.85 2hgc s ARG 55 CO 0.00 0.16 1.54 -1.25 0.02 0.00 0.00 175.30 175.77 2hgc s PRO 56 N -3.97 4.18 -0.06 3.54 0.04 -1.26 -2.82 135.00 134.65 2hgc s PRO 56 Ca 0.39 2.47 0.03 0.00 0.04 0.00 0.00 61.00 63.93 2hgc s PRO 56 Cb -0.06 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.42 2hgc s PRO 56 CO 0.26 -0.56 -0.15 -1.01 0.04 0.00 0.00 177.00 175.58 2hgc s HIS 57 N 0.13 1.66 -0.09 0.56 3.76 0.10 -4.95 115.29 116.46 2hgc s HIS 57 Ca 0.63 -0.56 -0.10 0.00 -0.15 0.00 0.00 55.06 54.88 2hgc s HIS 57 Cb -0.46 -1.16 -0.05 0.00 1.11 0.00 0.00 32.58 32.03 2hgc s HIS 57 CO 0.44 -0.24 0.23 -0.51 -0.85 0.00 0.00 174.74 173.82 2hgc s LEU 58 N 0.35 4.40 0.00 0.89 1.43 -1.26 -3.83 118.68 120.66 2hgc s LEU 58 Ca -0.10 0.61 0.02 0.00 -1.03 0.00 0.00 54.13 53.63 2hgc s LEU 58 Cb -0.14 -2.25 0.02 0.00 0.03 0.00 0.00 46.19 43.85 2hgc s LEU 58 CO 0.04 0.35 0.16 -1.22 0.23 0.00 0.00 176.35 175.91 2hgc n TYR 59 N 2.14 -1.04 1.38 0.29 4.01 -1.26 -4.60 117.16 118.08 2hgc n TYR 59 Ca -0.17 -0.98 0.14 0.00 -0.16 0.00 0.00 57.90 56.73 2hgc n TYR 59 Cb 0.54 -0.19 0.63 0.00 -0.31 0.00 0.00 39.34 40.01 2hgc n TYR 59 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2hgc n LYS 60 N -1.02 0.57 -3.65 -0.72 5.02 -1.26 -3.01 118.16 114.09 2hgc n LYS 60 Ca -0.01 -0.16 -0.04 0.00 -2.02 0.00 0.00 58.31 56.07 2hgc n LYS 60 Cb 0.26 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.71 2hgc n LYS 60 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2hgc s LEU 61 N -2.54 -0.92 0.00 -0.35 0.20 -1.26 -4.84 118.68 108.98 2hgc s LEU 61 Ca 0.27 1.33 0.00 0.00 0.69 0.00 0.00 54.13 56.43 2hgc s LEU 61 Cb 0.20 1.92 0.00 0.00 -0.43 0.00 0.00 46.19 47.88 2hgc s LEU 61 CO 0.48 -0.22 0.00 0.61 -0.29 0.00 0.00 176.35 176.93 2hgc n GLY 62 N 5.33 0.84 3.58 7.98 0.00 -1.26 -5.10 105.19 116.56 2hgc n GLY 62 Ca -0.11 0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 2hgc n GLY 62 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2hgc s PRO 63 N 0.00 2.83 -0.07 1.61 0.02 -1.25 -4.05 135.00 134.09 2hgc s PRO 63 Ca 0.00 1.63 0.01 0.00 0.02 0.00 0.00 61.00 62.66 2hgc s PRO 63 Cb 0.00 -4.40 -0.03 0.00 0.02 0.00 0.00 34.50 30.09 2hgc s PRO 63 CO 0.00 -2.45 -0.07 -1.21 -0.33 0.00 0.00 177.00 172.94 2hgc s GLU 64 N 6.84 2.74 0.16 5.54 0.41 0.20 -4.93 118.70 129.66 2hgc s GLU 64 Ca 0.93 -0.55 -0.17 0.00 -0.41 0.00 0.00 54.97 54.77 2hgc s GLU 64 Cb -0.25 -2.58 -0.07 0.00 -1.78 0.00 0.00 34.13 29.45 2hgc s GLU 64 CO 0.31 0.66 0.61 -0.51 -0.49 0.00 0.00 175.26 175.84 2hgc s LEU 65 N -0.82 4.36 0.70 1.80 1.02 -1.26 -0.44 118.68 124.03 2hgc s LEU 65 Ca 0.12 1.21 -0.05 0.00 0.02 0.00 0.00 54.13 55.43 2hgc s LEU 65 Cb -0.11 -3.33 0.07 0.00 0.02 0.00 0.00 46.19 42.84 2hgc s LEU 65 CO 0.01 0.10 0.99 0.42 0.02 0.00 0.00 176.35 177.89 2hgc s THR 66 N -1.44 2.31 0.25 5.49 -4.23 -0.32 -4.88 115.64 112.82 2hgc s THR 66 Ca 0.38 -0.36 -0.04 0.00 -1.18 0.00 0.00 61.69 60.49 2hgc s THR 66 Cb -0.16 -2.95 0.16 0.00 1.34 0.00 0.00 72.50 70.89 2hgc s THR 66 CO 0.20 0.00 1.81 -0.08 -0.54 0.00 0.00 174.62 176.01 2hgc h GLU 67 N -0.54 0.99 -0.45 3.99 4.81 -1.90 0.11 114.58 121.60 2hgc h GLU 67 Ca -0.43 -0.19 -0.02 0.00 -0.13 0.00 0.00 59.36 58.59 2hgc h GLU 67 Cb 1.30 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.51 2hgc h GLU 67 CO 0.55 0.84 0.19 -0.22 -0.73 0.00 0.00 179.01 179.64 2hgc h LYS 68 N 0.96 0.66 -0.45 1.92 3.64 -1.90 0.42 116.57 121.82 2hgc h LYS 68 Ca 0.22 -0.11 -0.07 0.00 -1.27 0.00 0.00 60.65 59.41 2hgc h LYS 68 Cb 0.25 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 2hgc h LYS 68 CO -0.01 0.60 0.00 0.78 -2.27 0.00 0.00 179.45 178.55 2hgc h GLY 69 N 0.58 0.86 0.92 5.01 0.00 -1.63 0.07 103.07 108.87 2hgc h GLY 69 Ca 0.15 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 2hgc h GLY 69 CO -0.01 0.58 0.12 -2.09 0.00 0.00 0.00 176.54 175.13 2hgc h GLU 70 N 0.64 0.42 -0.36 4.80 4.57 -0.55 -2.22 114.58 121.86 2hgc h GLU 70 Ca 0.13 -0.07 -0.04 0.00 -1.18 0.00 0.00 59.36 58.20 2hgc h GLU 70 Cb 0.50 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.00 2hgc h GLU 70 CO 0.02 0.43 0.06 -0.91 -1.18 0.00 0.00 179.01 177.43 2hgc h ASN 71 N 0.31 0.50 -0.62 1.04 -0.26 -0.08 -2.22 115.58 114.25 2hgc h ASN 71 Ca 0.09 -0.08 -0.03 0.00 -0.56 0.00 0.00 56.30 55.72 2hgc h ASN 71 Cb 0.17 -0.13 -0.03 0.00 -1.06 0.00 0.00 38.32 37.27 2hgc h ASN 71 CO -0.01 0.53 0.27 0.22 -1.06 0.00 0.00 177.43 177.39 2hgc h TYR 72 N 0.53 0.95 -0.27 1.19 3.20 -0.60 -1.80 116.97 120.17 2hgc h TYR 72 Ca 0.12 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.90 2hgc h TYR 72 Cb 0.26 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.22 2hgc h TYR 72 CO 0.01 0.72 -0.01 -0.07 -1.64 0.00 0.00 178.16 177.17 2hgc h LEU 73 N 0.93 0.38 -0.72 2.82 3.38 -0.80 0.48 115.31 121.79 2hgc h LEU 73 Ca 0.22 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 58.01 2hgc h LEU 73 Cb 0.16 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2hgc h LEU 73 CO -0.02 0.45 -0.32 0.11 0.09 0.00 0.00 178.44 178.75 2hgc h LYS 74 N 0.40 0.63 0.08 1.13 1.79 -1.17 0.79 116.57 120.22 2hgc h LYS 74 Ca 0.09 -0.28 -0.22 0.00 -2.18 0.00 0.00 60.65 58.06 2hgc h LYS 74 Cb 0.28 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.91 2hgc h LYS 74 CO 0.01 0.87 -1.13 0.93 -1.08 0.00 0.00 179.45 179.05 2hgc h GLU 75 N 0.54 0.17 -0.20 3.15 4.39 -1.19 -3.34 114.58 118.09 2hgc h GLU 75 Ca 0.06 -0.29 0.00 0.00 0.34 0.00 0.00 59.36 59.47 2hgc h GLU 75 Cb 0.81 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.57 2hgc h GLU 75 CO 0.07 1.14 0.00 -1.71 -1.16 0.00 0.00 179.01 177.35 2hgc n ASN 76 N -4.13 1.69 0.16 1.42 5.15 0.13 -4.12 115.26 115.56 2hgc n ASN 76 Ca -0.23 -1.76 0.12 0.00 -0.60 0.00 0.00 54.58 52.10 2hgc n ASN 76 Cb 0.79 -0.13 0.59 0.00 -0.53 0.00 0.00 39.78 40.51 2hgc n ASN 76 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 2hgc h GLY 77 N 5.06 0.00 -5.93 8.20 0.00 -0.96 -3.33 103.07 106.11 2hgc h GLY 77 Ca 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 47.33 46.70 2hgc h GLY 77 CO 0.00 0.00 2.87 -0.37 0.00 0.00 0.00 176.54 179.04 2hgc n THR 78 N -2.30 2.85 -3.70 4.70 5.66 -1.26 -4.78 114.28 115.45 2hgc n THR 78 Ca -0.01 -2.21 -0.15 0.00 -3.05 0.00 0.00 64.05 58.63 2hgc n THR 78 Cb 0.09 -2.44 -0.15 0.00 -1.55 0.00 0.00 70.33 66.28 2hgc n THR 78 CO 0.00 0.00 0.00 0.86 -3.05 0.00 0.00 175.07 172.88 2hgc s TRP 79 N 3.71 -0.16 -0.80 1.09 -0.11 -1.25 -5.09 118.94 116.33 2hgc s TRP 79 Ca 0.53 0.54 -0.25 0.00 1.22 0.00 0.00 56.10 58.13 2hgc s TRP 79 Cb 0.14 -0.19 -0.05 0.00 -1.50 0.00 0.00 33.47 31.88 2hgc s TRP 79 CO -0.01 -0.22 1.96 0.45 -4.62 0.00 0.00 176.95 174.52 2hgc s SER 80 N 1.78 5.08 -0.26 5.86 0.15 -1.26 -4.86 113.70 120.19 2hgc s SER 80 Ca -0.02 -0.28 -0.04 0.00 0.70 0.00 0.00 55.95 56.31 2hgc s SER 80 Cb -0.12 -2.55 0.14 0.00 -1.71 0.00 0.00 66.02 61.79 2hgc s SER 80 CO -0.06 -2.71 0.47 -0.75 1.20 0.00 0.00 173.24 171.39 2hgc s LYS 81 N 7.17 0.42 0.00 5.44 2.36 -1.26 -5.21 119.74 128.66 2hgc s LYS 81 Ca 0.71 0.83 0.00 0.00 -2.55 0.00 0.00 55.97 54.96 2hgc s LYS 81 Cb -0.09 0.06 0.00 0.00 -1.05 0.00 0.00 37.83 36.75 2hgc s LYS 81 CO 0.07 -0.53 0.00 0.00 1.55 0.00 0.00 175.35 176.43