#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 3.49 -0.25 -5.58 7.99 -1.26 -4.63 117.00 116.76 2hgc n LEU 6 Ca 0.00 -1.51 0.00 0.00 -0.01 0.00 0.00 56.01 54.49 2hgc n LEU 6 Cb 0.00 -0.25 0.07 0.00 -0.11 0.00 0.00 43.42 43.13 2hgc n LEU 6 CO 0.00 0.75 0.70 -0.09 -1.51 0.00 0.00 177.39 177.24 2hgc h ARG 7 N 4.49 -0.02 -0.34 3.23 2.43 -1.99 0.11 114.38 122.29 2hgc h ARG 7 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2hgc h ARG 7 Cb 0.99 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.53 2hgc h ARG 7 CO 0.00 -0.02 0.17 -0.92 -1.51 0.00 0.00 179.97 177.70 2hgc h TYR 8 N -0.02 0.49 -0.32 2.20 3.20 -1.96 -0.91 116.97 119.63 2hgc h TYR 8 Ca 0.34 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.18 2hgc h TYR 8 Cb 0.54 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.65 2hgc h TYR 8 CO -0.60 0.41 0.18 0.00 -1.64 0.00 0.00 178.16 176.50 2hgc h ALA 9 N 1.03 0.42 -0.47 1.82 0.00 -1.52 -1.87 119.26 118.67 2hgc h ALA 9 Ca 0.12 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.01 2hgc h ALA 9 Cb 0.10 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 2hgc h ALA 9 CO -0.02 -0.05 0.18 0.82 0.00 0.00 0.00 179.25 180.18 2hgc h ILE 10 N 0.40 0.87 -0.16 0.00 2.04 -0.61 0.27 117.51 120.32 2hgc h ILE 10 Ca 0.11 -0.13 0.03 0.00 1.00 0.00 0.00 64.86 65.88 2hgc h ILE 10 Cb 0.07 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 2hgc h ILE 10 CO -0.02 0.07 -0.05 -0.07 0.00 0.00 0.00 178.15 178.08 2hgc h LEU 11 N 0.37 -0.19 -0.22 1.44 3.38 -0.76 0.34 115.31 119.67 2hgc h LEU 11 Ca 0.22 0.05 -0.19 0.00 0.09 0.00 0.00 57.88 58.06 2hgc h LEU 11 Cb 0.21 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2hgc h LEU 11 CO -0.21 -0.07 -0.90 0.07 0.09 0.00 0.00 178.44 177.42 2hgc h LYS 12 N -0.02 0.02 0.00 1.13 5.09 -0.95 -0.11 116.57 121.73 2hgc h LYS 12 Ca 0.08 -0.03 -0.03 0.00 0.09 0.00 0.00 60.65 60.76 2hgc h LYS 12 Cb 0.14 0.01 -0.00 0.00 0.10 0.00 0.00 32.23 32.48 2hgc h LYS 12 CO -0.18 0.90 -0.16 0.93 -2.09 0.00 0.00 179.45 178.85 2hgc h GLU 13 N 0.01 0.00 0.01 0.07 4.39 -0.30 -0.20 114.58 118.56 2hgc h GLU 13 Ca -0.01 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 2hgc h GLU 13 Cb 1.58 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.23 2hgc h GLU 13 CO 0.12 0.16 -0.00 0.82 -1.16 0.00 0.00 179.01 178.94 2hgc h ILE 14 N 0.00 1.59 -0.88 3.13 2.04 -0.70 0.16 117.51 122.85 2hgc h ILE 14 Ca -0.00 -1.89 0.08 0.00 1.00 0.00 0.00 64.86 64.05 2hgc h ILE 14 Cb 0.80 2.86 -0.07 0.00 -0.74 0.00 0.00 36.82 39.67 2hgc h ILE 14 CO 0.02 0.48 0.53 0.15 0.00 0.00 0.00 178.15 179.34 2hgc h PHE 15 N -0.83 0.98 0.00 1.37 3.57 -0.79 -0.37 116.94 120.87 2hgc h PHE 15 Ca -0.00 0.03 -0.22 0.00 3.53 0.00 0.00 57.97 61.31 2hgc h PHE 15 Cb 0.80 -0.31 -0.04 0.00 2.79 0.00 0.00 35.95 39.19 2hgc h PHE 15 CO 0.21 0.45 -2.00 0.39 -2.23 0.00 0.00 178.31 175.12 2hgc n GLU 16 N -4.65 0.66 0.11 1.11 1.02 -0.11 -4.36 120.64 114.42 2hgc n GLU 16 Ca 0.14 0.01 0.12 0.00 -0.02 0.00 0.00 57.16 57.42 2hgc n GLU 16 Cb 0.24 -1.61 0.26 0.00 -0.02 0.00 0.00 31.44 30.31 2hgc n GLU 16 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2hgc h GLY 17 N 3.91 0.00 0.00 0.62 0.00 -0.68 -3.47 103.07 103.45 2hgc h GLY 17 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2hgc h GLY 17 CO 0.03 0.00 0.00 -2.01 0.00 0.00 0.00 176.54 174.56 2hgc n ASN 18 N -2.37 0.00 -1.48 0.19 5.15 -0.17 -4.78 115.26 111.79 2hgc n ASN 18 Ca 0.04 0.00 0.12 0.00 -0.60 0.00 0.00 54.58 54.14 2hgc n ASN 18 Cb 0.46 -0.19 -0.07 0.00 -0.53 0.00 0.00 39.78 39.45 2hgc n ASN 18 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 2hgc n THR 19 N -1.94 -1.52 -1.60 -0.44 -2.24 -1.25 -4.52 114.28 100.77 2hgc n THR 19 Ca 0.00 1.09 -0.31 0.00 -2.27 0.00 0.00 64.05 62.56 2hgc n THR 19 Cb 0.00 -1.71 0.06 0.00 -2.10 0.00 0.00 70.33 66.59 2hgc n THR 19 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2hgc s PRO 20 N -4.70 2.68 -0.15 -0.78 0.02 -1.23 -3.71 135.00 127.14 2hgc s PRO 20 Ca 0.00 0.81 0.00 0.00 0.02 0.00 0.00 61.00 61.83 2hgc s PRO 20 Cb 0.00 -1.97 0.02 0.00 0.02 0.00 0.00 34.50 32.57 2hgc s PRO 20 CO 0.00 -1.24 -0.14 -0.48 -0.33 0.00 0.00 177.00 174.81 2hgc s LEU 21 N -5.59 1.67 0.65 -5.54 2.34 -1.26 -5.01 118.68 105.93 2hgc s LEU 21 Ca 0.59 -0.48 -0.14 0.00 0.06 0.00 0.00 54.13 54.15 2hgc s LEU 21 Cb -0.14 -1.17 -0.01 0.00 -0.56 0.00 0.00 46.19 44.32 2hgc s LEU 21 CO 0.54 -0.06 1.08 -0.44 -1.06 0.00 0.00 176.35 176.42 2hgc s SER 22 N 1.50 5.34 0.11 1.48 0.01 -1.26 -4.91 113.70 115.97 2hgc s SER 22 Ca 0.05 1.86 -0.13 0.00 1.31 0.00 0.00 55.95 59.04 2hgc s SER 22 Cb -0.13 -2.53 -0.10 0.00 0.21 0.00 0.00 66.02 63.47 2hgc s SER 22 CO -0.11 -1.47 1.39 1.05 0.41 0.00 0.00 173.24 174.52 2hgc h GLU 23 N -0.04 0.83 0.00 12.44 9.09 -1.93 -1.73 114.58 133.24 2hgc h GLU 23 Ca -0.46 -0.52 0.00 0.00 0.05 0.00 0.00 59.36 58.43 2hgc h GLU 23 Cb 1.23 0.06 0.00 0.00 -1.65 0.00 0.00 28.75 28.39 2hgc h GLU 23 CO 0.55 1.15 0.00 -2.95 0.05 0.00 0.00 179.01 177.81 2hgc h ASN 24 N 0.59 0.00 0.11 3.06 -1.07 -1.94 0.77 115.58 117.10 2hgc h ASN 24 Ca 0.02 0.00 -0.17 0.00 0.07 0.00 0.00 56.30 56.21 2hgc h ASN 24 Cb 1.10 0.00 0.01 0.00 -2.07 0.00 0.00 38.32 37.36 2hgc h ASN 24 CO 0.11 0.00 -0.81 -0.78 0.07 0.00 0.00 177.43 176.02 2hgc h ASP 25 N 0.00 0.35 0.18 6.14 1.82 -1.81 -3.35 116.42 119.75 2hgc h ASP 25 Ca 0.00 -0.92 -0.22 0.00 -0.39 0.00 0.00 57.03 55.50 2hgc h ASP 25 Cb 0.63 -0.12 0.00 0.00 0.68 0.00 0.00 39.33 40.53 2hgc h ASP 25 CO 0.00 1.37 -0.85 -0.29 -1.61 0.00 0.00 179.24 177.87 2hgc h ILE 26 N -0.49 1.35 0.00 2.25 -0.00 -1.29 -3.48 117.51 115.85 2hgc h ILE 26 Ca -0.16 -2.22 0.00 0.00 -0.00 0.00 0.00 64.86 62.48 2hgc h ILE 26 Cb 1.54 2.22 0.00 0.00 -0.00 0.00 0.00 36.82 40.58 2hgc h ILE 26 CO 0.09 0.68 0.00 0.61 -0.00 0.00 0.00 178.15 179.53 2hgc n GLY 27 N 0.78 1.63 3.26 8.18 0.00 -0.20 -4.92 105.19 113.91 2hgc n GLY 27 Ca -0.06 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.00 0.08 0.41 1.61 -7.23 0.09 -5.02 120.40 108.34 2hgc s VAL 28 Ca 0.00 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.05 2hgc s VAL 28 Cb 0.00 -2.50 -0.07 0.00 0.56 0.00 0.00 36.38 34.37 2hgc s VAL 28 CO 0.00 0.00 0.80 0.28 -0.31 0.00 0.00 175.10 175.87 2hgc s THR 29 N -3.77 4.74 0.33 5.32 -1.32 -1.26 -3.80 115.64 115.88 2hgc s THR 29 Ca 0.39 0.73 0.16 0.00 -1.21 0.00 0.00 61.69 61.76 2hgc s THR 29 Cb 0.05 -3.72 0.12 0.00 -1.51 0.00 0.00 72.50 67.44 2hgc s THR 29 CO 0.19 -0.51 1.82 1.05 -2.21 0.00 0.00 174.62 174.96 2hgc h GLU 30 N 1.31 0.00 -0.43 7.08 9.09 -1.98 0.28 114.58 129.93 2hgc h GLU 30 Ca -0.47 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 58.86 2hgc h GLU 30 Cb 1.19 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.27 2hgc h GLU 30 CO 0.64 0.36 -0.04 0.22 0.05 0.00 0.00 179.01 180.23 2hgc h ASP 31 N 0.00 0.78 1.86 3.06 3.58 -2.00 -1.13 116.42 122.58 2hgc h ASP 31 Ca -0.00 -0.33 -0.02 0.00 0.42 0.00 0.00 57.03 57.09 2hgc h ASP 31 Cb 0.70 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.53 2hgc h ASP 31 CO 0.05 0.93 -0.12 1.56 -2.88 0.00 0.00 179.24 178.78 2hgc h GLN 32 N 0.62 0.00 0.43 0.28 7.50 -1.91 -2.53 115.11 119.50 2hgc h GLN 32 Ca 0.12 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 59.24 2hgc h GLN 32 Cb 0.55 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.09 2hgc h GLN 32 CO 0.03 0.12 -0.21 0.35 -1.50 0.00 0.00 178.83 177.62 2hgc h PHE 33 N 0.00 -0.54 -0.18 2.96 3.57 -0.52 -0.67 116.94 121.56 2hgc h PHE 33 Ca -0.00 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.38 2hgc h PHE 33 Cb 1.08 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.98 2hgc h PHE 33 CO 0.00 -0.22 -0.35 0.38 -2.23 0.00 0.00 178.31 175.89 2hgc h ASP 34 N -0.87 0.40 0.05 0.41 2.03 -1.30 -2.08 116.42 115.06 2hgc h ASP 34 Ca -0.06 -0.16 -0.00 0.00 -0.73 0.00 0.00 57.03 56.08 2hgc h ASP 34 Cb 0.56 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 38.95 2hgc h ASP 34 CO 0.10 0.73 -0.02 -0.78 -1.03 0.00 0.00 179.24 178.23 2hgc h ASP 35 N 0.33 -0.06 -0.49 4.15 3.58 -1.46 -1.90 116.42 120.58 2hgc h ASP 35 Ca 0.04 -0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.46 2hgc h ASP 35 Cb 0.78 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.82 2hgc h ASP 35 CO 0.06 -0.01 0.30 0.00 -2.88 0.00 0.00 179.24 176.71 2hgc h ALA 36 N 0.85 0.62 -0.93 -0.78 0.00 -0.94 -1.12 119.26 116.95 2hgc h ALA 36 Ca -0.01 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.91 2hgc h ALA 36 Cb 0.08 -0.20 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 2hgc h ALA 36 CO 0.01 0.11 0.59 0.28 0.00 0.00 0.00 179.25 180.24 2hgc h VAL 37 N 0.65 1.05 -0.41 0.00 2.07 -1.26 0.38 116.25 118.73 2hgc h VAL 37 Ca 0.18 -0.37 -0.13 0.00 0.82 0.00 0.00 66.70 67.20 2hgc h VAL 37 Cb -0.01 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.64 2hgc h VAL 37 CO -0.03 0.19 -0.26 0.78 0.02 0.00 0.00 177.57 178.27 2hgc h ASN 38 N 1.06 0.89 -0.57 0.57 2.35 -0.88 -1.51 115.58 117.50 2hgc h ASN 38 Ca 0.41 -0.35 -0.11 0.00 -0.55 0.00 0.00 56.30 55.70 2hgc h ASN 38 Cb 0.19 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 2hgc h ASN 38 CO -0.18 1.10 -0.07 0.15 -1.65 0.00 0.00 177.43 176.78 2hgc h PHE 39 N 0.74 1.16 -0.78 1.19 3.57 -0.20 -1.22 116.94 121.40 2hgc h PHE 39 Ca 0.09 -0.23 -0.01 0.00 3.53 0.00 0.00 57.97 61.36 2hgc h PHE 39 Cb 0.81 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 39.22 2hgc h PHE 39 CO 0.05 1.05 0.47 -0.07 -2.23 0.00 0.00 178.31 177.57 2hgc h LEU 40 N 0.93 0.94 -0.48 0.59 3.38 -0.09 -0.93 115.31 119.65 2hgc h LEU 40 Ca 0.15 -0.06 -0.16 0.00 0.09 0.00 0.00 57.88 57.91 2hgc h LEU 40 Cb 0.63 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2hgc h LEU 40 CO 0.04 0.73 -0.49 0.50 0.09 0.00 0.00 178.44 179.31 2hgc h LYS 41 N 1.08 0.69 0.12 1.13 3.64 -1.02 0.11 116.57 122.32 2hgc h LYS 41 Ca 0.28 -0.40 0.01 0.00 -1.27 0.00 0.00 60.65 59.27 2hgc h LYS 41 Cb -0.03 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 2hgc h LYS 41 CO -0.05 1.02 -0.18 0.00 -2.27 0.00 0.00 179.45 177.97 2hgc h ARG 42 N 0.54 -0.35 -0.14 1.90 3.08 -0.49 -2.92 114.38 116.00 2hgc h ARG 42 Ca 0.02 0.02 -0.15 0.00 0.07 0.00 0.00 59.98 59.95 2hgc h ARG 42 Cb 1.05 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.17 2hgc h ARG 42 CO 0.10 -0.23 -0.54 1.49 -1.07 0.00 0.00 179.97 179.72 2hgc h GLU 43 N -0.36 0.40 0.00 0.04 4.57 -1.18 -3.48 114.58 114.57 2hgc h GLU 43 Ca 0.02 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 57.95 2hgc h GLU 43 Cb 0.37 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.99 2hgc h GLU 43 CO -0.09 0.84 0.00 0.41 -1.18 0.00 0.00 179.01 178.99 2hgc n GLY 44 N 0.18 0.72 0.12 1.92 0.00 0.06 -5.04 105.19 103.15 2hgc n GLY 44 Ca -0.03 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.84 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 0.00 0.66 -4.07 1.61 4.01 0.16 -4.34 117.16 115.19 2hgc n TYR 45 Ca 0.00 0.17 -0.10 0.00 -0.16 0.00 0.00 57.90 57.81 2hgc n TYR 45 Cb 0.00 -1.10 -0.11 0.00 -0.31 0.00 0.00 39.34 37.83 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 -2.55 0.39 0.17 -0.72 -5.25 -1.25 -0.96 121.20 111.04 2hgc s ILE 46 Ca -0.19 -1.43 0.03 0.00 -0.99 0.00 0.00 60.65 58.06 2hgc s ILE 46 Cb 0.07 -1.01 -0.05 0.00 2.95 0.00 0.00 42.46 44.43 2hgc s ILE 46 CO 0.75 -0.69 -0.02 0.27 -1.79 0.00 0.00 174.94 173.46 2hgc s ILE 47 N -2.58 0.83 0.00 8.37 -0.00 0.17 -4.32 121.20 123.68 2hgc s ILE 47 Ca -0.02 -2.00 0.00 0.00 -0.00 0.00 0.00 60.65 58.63 2hgc s ILE 47 Cb -0.02 -2.06 0.00 0.00 -0.00 0.00 0.00 42.46 40.38 2hgc s ILE 47 CO -0.04 -0.54 0.00 0.61 -0.00 0.00 0.00 174.94 174.97 2hgc n GLY 48 N -0.24 1.23 3.64 6.27 0.00 -1.26 0.03 105.19 114.86 2hgc n GLY 48 Ca -0.07 -0.38 -0.43 0.00 0.00 0.00 0.00 46.02 45.14 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 3.89 -0.25 1.61 1.01 -1.26 -3.13 120.40 120.27 2hgc s VAL 49 Ca 0.00 1.04 -0.14 0.00 0.00 0.00 0.00 61.98 62.88 2hgc s VAL 49 Cb 0.00 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 2hgc s VAL 49 CO 0.00 -0.23 0.32 -2.28 0.00 0.00 0.00 175.10 172.92 2hgc s HIS 50 N 4.36 3.28 -0.27 5.22 2.46 -1.26 -5.03 115.29 124.06 2hgc s HIS 50 Ca 0.65 0.39 -0.11 0.00 0.47 0.00 0.00 55.06 56.46 2hgc s HIS 50 Cb -0.25 -2.49 -0.05 0.00 -0.13 0.00 0.00 32.58 29.66 2hgc s HIS 50 CO 0.24 -0.13 0.21 0.71 -2.47 0.00 0.00 174.74 173.31 2hgc s TYR 51 N 1.70 3.25 -0.01 3.88 1.51 -1.26 -1.15 117.35 125.28 2hgc s TYR 51 Ca 0.14 0.19 -0.09 0.00 -1.01 0.00 0.00 57.07 56.30 2hgc s TYR 51 Cb -0.15 -2.37 -0.05 0.00 -0.11 0.00 0.00 41.96 39.28 2hgc s TYR 51 CO 0.09 -0.10 0.68 0.77 -1.11 0.00 0.00 175.55 175.87 2hgc h SER 52 N 8.08 -0.27 0.00 2.29 0.02 -1.77 -3.42 113.55 118.48 2hgc h SER 52 Ca -0.36 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2hgc h SER 52 Cb 1.18 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.79 2hgc h SER 52 CO 0.59 -0.10 -0.81 0.47 -1.14 0.00 0.00 176.83 175.84 2hgc n ASP 53 N -3.40 4.07 0.00 3.07 9.92 -1.26 -4.96 116.55 124.00 2hgc n ASP 53 Ca -0.04 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.22 2hgc n ASP 53 Cb 0.13 0.79 0.00 0.00 -0.64 0.00 0.00 41.12 41.39 2hgc n ASP 53 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 2hgc n ASP 54 N -1.26 0.00 -4.80 -2.24 5.75 -1.26 -5.14 116.55 107.60 2hgc n ASP 54 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 54.79 54.43 2hgc n ASP 54 Cb 0.03 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.05 2hgc n ASP 54 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 2hgc s ARG 55 N -0.77 3.20 -0.10 0.11 3.52 -1.26 -4.95 118.95 118.70 2hgc s ARG 55 Ca 0.00 -0.33 -0.29 0.00 -0.13 0.00 0.00 55.73 54.98 2hgc s ARG 55 Cb 0.00 -2.97 -0.05 0.00 -1.56 0.00 0.00 34.95 30.36 2hgc s ARG 55 CO 0.00 0.71 1.78 -1.25 -0.81 0.00 0.00 175.30 175.73 2hgc s PRO 56 N -1.29 3.93 -0.17 5.12 0.04 -1.26 -1.93 135.00 139.45 2hgc s PRO 56 Ca 0.18 2.11 0.06 0.00 0.04 0.00 0.00 61.00 63.39 2hgc s PRO 56 Cb -0.12 -4.09 -0.15 0.00 0.04 0.00 0.00 34.50 30.19 2hgc s PRO 56 CO 0.08 -1.15 -0.07 0.72 0.04 0.00 0.00 177.00 176.61 2hgc n HIS 57 N 8.15 0.00 -1.09 0.56 8.25 -0.30 -4.72 115.22 126.07 2hgc n HIS 57 Ca 0.20 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.66 2hgc n HIS 57 Cb 0.43 -0.71 0.00 0.00 1.12 0.00 0.00 29.99 30.83 2hgc n HIS 57 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2hgc n LEU 58 N -2.83 -4.41 0.00 2.41 4.77 -1.25 -4.80 117.00 110.89 2hgc n LEU 58 Ca -0.29 1.79 -0.18 0.00 -0.03 0.00 0.00 56.01 57.30 2hgc n LEU 58 Cb 0.90 -1.44 -0.04 0.00 -2.33 0.00 0.00 43.42 40.51 2hgc n LEU 58 CO 0.24 -0.47 -0.13 -1.22 -1.33 0.00 0.00 177.39 174.48 2hgc n TYR 59 N 0.24 0.57 0.74 -1.77 4.01 -1.26 -4.39 117.16 115.30 2hgc n TYR 59 Ca 0.00 -1.46 0.07 0.00 -0.16 0.00 0.00 57.90 56.35 2hgc n TYR 59 Cb 0.00 -0.16 0.39 0.00 -0.31 0.00 0.00 39.34 39.26 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 -0.69 0.24 -3.60 -0.72 5.02 -1.24 -3.49 118.16 113.68 2hgc n LYS 60 Ca -0.10 0.13 -0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2hgc n LYS 60 Cb 0.37 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.84 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 -2.51 -1.16 0.00 -0.35 2.96 -1.26 -4.83 118.68 111.53 2hgc s LEU 61 Ca 0.15 1.49 0.00 0.00 -0.22 0.00 0.00 54.13 55.56 2hgc s LEU 61 Cb 0.10 2.28 0.00 0.00 0.50 0.00 0.00 46.19 49.07 2hgc s LEU 61 CO 0.23 -0.22 0.00 0.61 -1.32 0.00 0.00 176.35 175.65 2hgc n GLY 62 N 5.44 -1.02 3.75 7.98 0.00 -1.26 -5.12 105.19 114.95 2hgc n GLY 62 Ca -0.11 0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.94 2hgc n GLY 62 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2hgc s PRO 63 N 0.00 4.49 0.25 1.61 0.04 -1.18 -4.59 135.00 135.61 2hgc s PRO 63 Ca 0.00 1.97 0.04 0.00 0.04 0.00 0.00 61.00 63.05 2hgc s PRO 63 Cb 0.00 -3.17 -0.05 0.00 0.04 0.00 0.00 34.50 31.31 2hgc s PRO 63 CO 0.00 -0.04 -0.00 -1.21 0.04 0.00 0.00 177.00 175.79 2hgc s GLU 64 N -1.00 1.40 0.01 4.56 2.02 0.10 -4.98 118.70 120.81 2hgc s GLU 64 Ca 0.50 -1.72 -0.06 0.00 0.02 0.00 0.00 54.97 53.71 2hgc s GLU 64 Cb -0.35 -0.69 -0.05 0.00 0.10 0.00 0.00 34.13 33.14 2hgc s GLU 64 CO 0.42 -0.10 0.26 -0.51 0.02 0.00 0.00 175.26 175.36 2hgc s LEU 65 N -3.34 4.36 0.80 1.80 1.02 -1.26 -0.65 118.68 121.41 2hgc s LEU 65 Ca 0.30 0.53 -0.12 0.00 0.02 0.00 0.00 54.13 54.86 2hgc s LEU 65 Cb 0.06 -2.71 0.07 0.00 0.02 0.00 0.00 46.19 43.64 2hgc s LEU 65 CO 0.10 0.24 1.17 0.42 0.02 0.00 0.00 176.35 178.30 2hgc s THR 66 N -1.33 2.12 0.30 5.49 -4.23 -0.14 -4.80 115.64 113.06 2hgc s THR 66 Ca 0.28 0.04 0.00 0.00 -1.18 0.00 0.00 61.69 60.83 2hgc s THR 66 Cb -0.13 -3.04 0.28 0.00 1.34 0.00 0.00 72.50 70.95 2hgc s THR 66 CO 0.17 -0.05 1.93 -0.08 -0.54 0.00 0.00 174.62 176.05 2hgc h GLU 67 N -1.02 1.00 -0.19 3.99 4.81 -1.90 0.78 114.58 122.06 2hgc h GLU 67 Ca -0.46 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 58.64 2hgc h GLU 67 Cb 1.32 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 2hgc h GLU 67 CO 0.66 0.66 -0.14 -0.22 -0.73 0.00 0.00 179.01 179.24 2hgc h LYS 68 N 1.03 0.42 -0.59 1.92 3.11 -1.90 -2.54 116.57 118.03 2hgc h LYS 68 Ca 0.36 -0.21 0.01 0.00 -2.81 0.00 0.00 60.65 58.01 2hgc h LYS 68 Cb 0.13 -0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.33 2hgc h LYS 68 CO -0.12 0.76 0.39 0.78 -2.81 0.00 0.00 179.45 178.44 2hgc h GLY 69 N 0.09 0.83 1.01 5.01 0.00 -1.54 0.53 103.07 109.00 2hgc h GLY 69 Ca 0.03 -0.30 0.01 0.00 0.00 0.00 0.00 47.33 47.07 2hgc h GLY 69 CO 0.04 0.29 0.61 -2.09 0.00 0.00 0.00 176.54 175.39 2hgc h GLU 70 N 0.78 1.26 0.00 4.80 4.81 -0.86 -2.02 114.58 123.34 2hgc h GLU 70 Ca 0.22 -0.09 -0.10 0.00 -0.13 0.00 0.00 59.36 59.27 2hgc h GLU 70 Cb -0.08 -0.28 -0.01 0.00 0.63 0.00 0.00 28.75 29.01 2hgc h GLU 70 CO -0.05 0.85 -0.53 -0.91 -0.73 0.00 0.00 179.01 177.63 2hgc h ASN 71 N 1.29 0.00 0.32 1.04 2.35 -1.00 -3.14 115.58 116.44 2hgc h ASN 71 Ca 0.34 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 56.04 2hgc h ASN 71 Cb -0.12 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 2hgc h ASN 71 CO -0.07 0.44 -0.24 0.22 -1.65 0.00 0.00 177.43 176.13 2hgc h TYR 72 N 0.00 0.00 -0.55 1.19 3.20 0.74 -1.36 116.97 120.19 2hgc h TYR 72 Ca -0.02 0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.90 2hgc h TYR 72 Cb 1.35 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 39.59 2hgc h TYR 72 CO 0.00 0.24 0.37 -0.07 -1.64 0.00 0.00 178.16 177.06 2hgc h LEU 73 N 0.00 0.49 -0.21 2.82 3.38 -1.35 0.19 115.31 120.62 2hgc h LEU 73 Ca -0.00 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 2hgc h LEU 73 Cb 0.46 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2hgc h LEU 73 CO 0.03 0.33 -0.11 0.50 0.09 0.00 0.00 178.44 179.28 2hgc h LYS 74 N 0.56 0.44 -0.08 1.13 3.64 -1.40 0.17 116.57 121.04 2hgc h LYS 74 Ca 0.23 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2hgc h LYS 74 Cb 0.21 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.02 2hgc h LYS 74 CO -0.06 0.73 0.02 0.93 -2.27 0.00 0.00 179.45 178.80 2hgc h GLU 75 N 0.15 0.13 -0.24 1.90 5.08 -1.19 -2.96 114.58 117.45 2hgc h GLU 75 Ca 0.05 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2hgc h GLU 75 Cb 0.60 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2hgc h GLU 75 CO 0.03 0.33 0.00 -1.71 -1.00 0.00 0.00 179.01 176.66 2hgc n ASN 76 N -4.89 2.07 0.00 1.42 4.05 0.60 -4.31 115.26 114.20 2hgc n ASN 76 Ca -0.06 -1.80 0.00 0.00 0.45 0.00 0.00 54.58 53.16 2hgc n ASN 76 Cb 0.15 -0.15 0.00 0.00 1.23 0.00 0.00 39.78 41.01 2hgc n ASN 76 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2hgc n GLY 77 N 1.20 -0.11 0.00 8.20 0.00 0.60 -3.41 105.19 111.68 2hgc n GLY 77 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2hgc n GLY 77 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2hgc n THR 78 N -1.09 0.00 -0.96 2.61 5.66 -1.26 -5.03 114.28 114.21 2hgc n THR 78 Ca 0.00 0.33 0.12 0.00 -3.05 0.00 0.00 64.05 61.45 2hgc n THR 78 Cb 0.01 -1.03 -0.05 0.00 -1.55 0.00 0.00 70.33 67.71 2hgc n THR 78 CO 0.00 0.00 0.00 1.87 -3.05 0.00 0.00 175.07 173.89 2hgc n TRP 79 N 0.00 -2.52 -3.67 1.09 -0.00 -1.22 -4.99 117.44 106.13 2hgc n TRP 79 Ca 0.00 1.35 -0.13 0.00 -0.00 0.00 0.00 57.50 58.72 2hgc n TRP 79 Cb 0.00 -2.29 -0.13 0.00 -0.00 0.00 0.00 31.31 28.89 2hgc n TRP 79 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 177.69 176.57 2hgc s SER 80 N -6.37 0.25 0.59 5.87 0.01 -1.26 -5.16 113.70 107.63 2hgc s SER 80 Ca 0.00 0.60 -0.17 0.00 1.31 0.00 0.00 55.95 57.69 2hgc s SER 80 Cb 0.00 0.68 -0.04 0.00 0.21 0.00 0.00 66.02 66.87 2hgc s SER 80 CO 0.00 -0.23 1.09 -0.54 0.41 0.00 0.00 173.24 173.97 2hgc s LYS 81 N 2.27 3.21 0.00 12.44 -0.14 -1.26 -5.12 119.74 131.14 2hgc s LYS 81 Ca -0.00 1.41 0.28 0.00 -1.36 0.00 0.00 55.97 56.29 2hgc s LYS 81 Cb -0.12 -2.00 1.01 0.00 -1.68 0.00 0.00 37.83 35.04 2hgc s LYS 81 CO -0.09 -0.92 1.72 0.00 -0.76 0.00 0.00 175.35 175.30