#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgc h LEU 6 N 0.00 0.00 -1.67 -5.58 -0.00 -2.03 -3.25 115.31 102.78 2hgc h LEU 6 Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 57.88 58.03 2hgc h LEU 6 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.62 2hgc h LEU 6 CO 0.00 0.04 0.48 0.03 -0.00 0.00 0.00 178.44 179.00 2hgc h ARG 7 N 0.00 0.32 0.26 1.13 2.47 -1.99 -1.20 114.38 115.37 2hgc h ARG 7 Ca -0.00 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.68 2hgc h ARG 7 Cb 1.04 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.29 2hgc h ARG 7 CO 0.01 0.21 -0.12 -0.92 0.56 0.00 0.00 179.97 179.70 2hgc h TYR 8 N 0.32 -0.32 -0.31 3.04 3.20 -1.94 -1.42 116.97 119.54 2hgc h TYR 8 Ca 0.35 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.26 2hgc h TYR 8 Cb 0.90 0.11 -0.04 0.00 1.54 0.00 0.00 36.73 39.24 2hgc h TYR 8 CO -0.00 0.03 0.05 0.00 -1.64 0.00 0.00 178.16 176.60 2hgc h ALA 9 N -0.18 0.32 -0.55 1.82 0.00 -1.58 0.20 119.26 119.29 2hgc h ALA 9 Ca -0.04 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2hgc h ALA 9 Cb 0.50 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2hgc h ALA 9 CO 0.06 -0.36 0.28 0.82 0.00 0.00 0.00 179.25 180.05 2hgc h ILE 10 N 0.16 1.19 -0.36 0.00 2.04 -1.31 -0.98 117.51 118.26 2hgc h ILE 10 Ca 0.15 -0.53 -0.08 0.00 1.00 0.00 0.00 64.86 65.40 2hgc h ILE 10 Cb 0.17 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 2hgc h ILE 10 CO -0.21 0.22 -0.09 0.25 0.00 0.00 0.00 178.15 178.32 2hgc h LEU 11 N 0.74 0.59 -0.32 1.44 5.85 -0.65 -2.67 115.31 120.29 2hgc h LEU 11 Ca 0.19 -0.15 -0.18 0.00 0.84 0.00 0.00 57.88 58.58 2hgc h LEU 11 Cb 0.09 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 40.96 2hgc h LEU 11 CO -0.03 0.72 -0.50 0.50 -0.34 0.00 0.00 178.44 178.80 2hgc h LYS 12 N 0.56 0.90 -0.85 1.25 3.64 -0.17 -0.95 116.57 120.96 2hgc h LYS 12 Ca 0.10 -0.54 -0.03 0.00 -1.27 0.00 0.00 60.65 58.91 2hgc h LYS 12 Cb 0.50 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.33 2hgc h LYS 12 CO 0.03 1.19 0.42 0.93 -2.27 0.00 0.00 179.45 179.74 2hgc h GLU 13 N 0.70 1.22 -0.10 1.90 4.39 -1.00 0.63 114.58 122.33 2hgc h GLU 13 Ca 0.03 -0.17 -0.10 0.00 0.34 0.00 0.00 59.36 59.45 2hgc h GLU 13 Cb 1.11 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.52 2hgc h GLU 13 CO 0.11 0.93 -0.41 0.82 -1.16 0.00 0.00 179.01 179.30 2hgc h ILE 14 N 1.21 1.31 -0.03 3.13 2.04 -1.40 -0.54 117.51 123.22 2hgc h ILE 14 Ca 0.29 -1.51 -0.26 0.00 1.00 0.00 0.00 64.86 64.39 2hgc h ILE 14 Cb 0.11 1.69 0.02 0.00 -0.74 0.00 0.00 36.82 37.89 2hgc h ILE 14 CO -0.04 0.45 -0.98 0.15 0.00 0.00 0.00 178.15 177.73 2hgc h PHE 15 N 0.18 1.05 0.24 1.37 3.57 0.22 -0.38 116.94 123.18 2hgc h PHE 15 Ca 0.02 -0.55 -0.33 0.00 3.53 0.00 0.00 57.97 60.63 2hgc h PHE 15 Cb 0.80 -0.13 0.03 0.00 2.79 0.00 0.00 35.95 39.45 2hgc h PHE 15 CO 0.01 1.39 -1.49 0.93 -2.23 0.00 0.00 178.31 176.92 2hgc h GLU 16 N 0.41 0.51 -0.00 1.11 5.08 0.26 -3.35 114.58 118.59 2hgc h GLU 16 Ca -0.11 -0.87 0.00 0.00 -1.00 0.00 0.00 59.36 57.37 2hgc h GLU 16 Cb 1.63 0.32 0.00 0.00 0.50 0.00 0.00 28.75 31.21 2hgc h GLU 16 CO 0.20 1.42 -0.83 0.41 -1.00 0.00 0.00 179.01 179.20 2hgc n GLY 17 N 1.74 -0.66 5.51 -3.84 0.00 -0.22 -5.01 105.19 102.71 2hgc n GLY 17 Ca -0.18 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.23 2hgc n GLY 17 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2hgc n ASN 18 N -1.03 0.00 0.00 1.61 5.15 -0.15 -4.73 115.26 116.11 2hgc n ASN 18 Ca 0.06 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.04 2hgc n ASN 18 Cb 0.37 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.62 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 0.00 0.00 -2.03 -0.44 -2.24 -1.26 -4.64 114.28 103.67 2hgc n THR 19 Ca 0.00 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.50 2hgc n THR 19 Cb 0.00 0.00 0.07 0.00 -2.10 0.00 0.00 70.33 68.30 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 -2.00 2.39 -0.15 -0.78 0.05 -1.26 -4.52 135.00 128.73 2hgc s PRO 20 Ca 0.00 0.11 -0.08 0.00 0.05 0.00 0.00 61.00 61.08 2hgc s PRO 20 Cb 0.00 -2.06 0.06 0.00 0.05 0.00 0.00 34.50 32.54 2hgc s PRO 20 CO 0.00 -1.24 0.37 -0.48 0.05 0.00 0.00 177.00 175.70 2hgc s LEU 21 N -5.36 0.02 0.71 -3.56 2.34 -1.15 -4.98 118.68 106.70 2hgc s LEU 21 Ca 0.59 0.79 -0.07 0.00 0.06 0.00 0.00 54.13 55.51 2hgc s LEU 21 Cb -0.11 1.18 0.07 0.00 -0.56 0.00 0.00 46.19 46.77 2hgc s LEU 21 CO 0.48 -0.19 1.03 -0.44 -1.06 0.00 0.00 176.35 176.17 2hgc s SER 22 N 1.42 4.75 0.31 1.48 0.01 -1.26 -4.48 113.70 115.93 2hgc s SER 22 Ca -0.09 0.43 0.02 0.00 1.31 0.00 0.00 55.95 57.62 2hgc s SER 22 Cb -0.09 -1.05 0.58 0.00 0.21 0.00 0.00 66.02 65.67 2hgc s SER 22 CO -0.12 -1.64 1.91 1.05 0.41 0.00 0.00 173.24 174.85 2hgc h GLU 23 N -0.64 0.93 -0.26 12.44 9.09 -1.94 -0.84 114.58 133.37 2hgc h GLU 23 Ca -0.44 -0.06 -0.12 0.00 0.05 0.00 0.00 59.36 58.79 2hgc h GLU 23 Cb 1.31 -0.21 -0.01 0.00 -1.65 0.00 0.00 28.75 28.19 2hgc h GLU 23 CO 0.59 0.62 -0.36 -0.97 0.05 0.00 0.00 179.01 178.94 2hgc h ASN 24 N 0.96 0.59 -0.34 3.06 -1.24 -1.94 0.19 115.58 116.87 2hgc h ASN 24 Ca 0.39 -0.25 -0.03 0.00 0.71 0.00 0.00 56.30 57.12 2hgc h ASN 24 Cb 0.27 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.14 2hgc h ASN 24 CO -0.15 0.90 0.08 0.44 -1.29 0.00 0.00 177.43 177.41 2hgc h ASP 25 N 0.48 0.52 1.49 1.15 3.32 -1.56 -3.02 116.42 118.80 2hgc h ASP 25 Ca 0.05 -0.24 -0.10 0.00 0.02 0.00 0.00 57.03 56.77 2hgc h ASP 25 Cb 0.84 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.24 2hgc h ASP 25 CO 0.07 0.62 -0.46 -0.29 -1.72 0.00 0.00 179.24 177.46 2hgc h ILE 26 N 0.40 0.80 0.00 0.35 2.10 -1.18 -3.48 117.51 116.50 2hgc h ILE 26 Ca 0.11 -2.10 0.00 0.00 1.08 0.00 0.00 64.86 63.95 2hgc h ILE 26 Cb 0.31 2.37 0.00 0.00 -1.09 0.00 0.00 36.82 38.41 2hgc h ILE 26 CO 0.00 0.45 0.00 0.61 -1.08 0.00 0.00 178.15 178.13 2hgc n GLY 27 N 1.16 0.91 3.51 8.18 0.00 -0.00 -4.98 105.19 113.98 2hgc n GLY 27 Ca 0.02 -0.04 -0.24 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 -2.00 1.81 0.77 1.61 -7.23 -0.85 -5.01 120.40 109.50 2hgc s VAL 28 Ca 0.00 -2.09 -0.12 0.00 -1.81 0.00 0.00 61.98 57.97 2hgc s VAL 28 Cb 0.00 -2.71 0.05 0.00 0.56 0.00 0.00 36.38 34.28 2hgc s VAL 28 CO 0.00 -0.14 1.13 0.42 -0.31 0.00 0.00 175.10 176.20 2hgc s THR 29 N -2.88 2.84 0.25 5.32 -4.23 -1.26 -4.31 115.64 111.37 2hgc s THR 29 Ca 0.33 0.27 -0.04 0.00 -1.18 0.00 0.00 61.69 61.07 2hgc s THR 29 Cb 0.06 -3.20 0.25 0.00 1.34 0.00 0.00 72.50 70.95 2hgc s THR 29 CO 0.15 -0.35 1.88 -0.33 -0.54 0.00 0.00 174.62 175.43 2hgc h GLU 30 N -0.93 1.13 -0.27 3.99 5.08 -1.98 0.14 114.58 121.74 2hgc h GLU 30 Ca -0.46 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 57.87 2hgc h GLU 30 Cb 1.29 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 2hgc h GLU 30 CO 0.64 0.75 0.06 0.22 -1.00 0.00 0.00 179.01 179.67 2hgc h ASP 31 N 1.16 0.02 0.21 1.42 3.58 -1.99 0.39 116.42 121.21 2hgc h ASP 31 Ca 0.40 0.04 -0.17 0.00 0.42 0.00 0.00 57.03 57.71 2hgc h ASP 31 Cb 0.08 0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 2hgc h ASP 31 CO -0.15 0.05 -0.67 1.56 -2.88 0.00 0.00 179.24 177.15 2hgc h GLN 32 N 0.16 0.43 -0.19 0.28 1.08 -1.83 -1.72 115.11 113.32 2hgc h GLN 32 Ca 0.12 -0.32 -0.01 0.00 -1.45 0.00 0.00 58.65 56.99 2hgc h GLN 32 Cb 0.12 0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 2hgc h GLN 32 CO -0.16 0.95 0.07 0.35 -0.95 0.00 0.00 178.83 179.09 2hgc h PHE 33 N 0.30 0.29 0.21 2.96 3.04 -0.34 -0.96 116.94 122.44 2hgc h PHE 33 Ca -0.02 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.91 2hgc h PHE 33 Cb 1.23 -0.09 -0.01 0.00 2.56 0.00 0.00 35.95 39.64 2hgc h PHE 33 CO 0.04 0.34 -0.19 0.22 -2.02 0.00 0.00 178.31 176.70 2hgc h ASP 34 N 0.15 -0.51 -0.10 0.41 1.82 -0.20 -0.56 116.42 117.44 2hgc h ASP 34 Ca 0.06 0.05 0.04 0.00 -0.39 0.00 0.00 57.03 56.79 2hgc h ASP 34 Cb 0.18 0.18 -0.05 0.00 0.68 0.00 0.00 39.33 40.31 2hgc h ASP 34 CO -0.00 -0.29 -0.23 -0.78 -1.61 0.00 0.00 179.24 176.32 2hgc h ASP 35 N -0.43 -0.70 0.23 2.28 1.82 -1.23 -1.70 116.42 116.69 2hgc h ASP 35 Ca -0.00 0.11 -0.01 0.00 -0.39 0.00 0.00 57.03 56.74 2hgc h ASP 35 Cb 0.40 0.31 0.00 0.00 0.68 0.00 0.00 39.33 40.72 2hgc h ASP 35 CO -0.04 -0.28 -0.11 0.00 -1.61 0.00 0.00 179.24 177.20 2hgc h ALA 36 N 0.63 -0.31 -0.67 -0.78 0.00 -1.09 -2.66 119.26 114.39 2hgc h ALA 36 Ca 0.09 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 2hgc h ALA 36 Cb 0.44 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 2hgc h ALA 36 CO -0.28 -0.50 0.11 0.28 0.00 0.00 0.00 179.25 178.86 2hgc h VAL 37 N -0.67 1.26 -0.74 0.00 2.07 -1.08 0.24 116.25 117.34 2hgc h VAL 37 Ca -0.03 -1.04 -0.06 0.00 0.82 0.00 0.00 66.70 66.39 2hgc h VAL 37 Cb 0.47 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 2hgc h VAL 37 CO 0.05 0.39 0.25 0.78 0.02 0.00 0.00 177.57 179.06 2hgc h ASN 38 N 1.03 1.06 -0.22 0.57 2.35 -1.38 0.21 115.58 119.21 2hgc h ASN 38 Ca 0.20 -0.19 -0.03 0.00 -0.55 0.00 0.00 56.30 55.73 2hgc h ASN 38 Cb 0.44 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 2hgc h ASN 38 CO 0.01 0.98 0.01 0.15 -1.65 0.00 0.00 177.43 176.93 2hgc h PHE 39 N 1.10 0.40 -0.81 1.19 3.57 -1.06 -1.79 116.94 119.54 2hgc h PHE 39 Ca 0.24 -0.07 0.02 0.00 3.53 0.00 0.00 57.97 61.69 2hgc h PHE 39 Cb 0.28 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.87 2hgc h PHE 39 CO 0.02 0.54 0.53 -0.07 -2.23 0.00 0.00 178.31 177.10 2hgc h LEU 40 N 0.15 0.90 -0.85 0.59 3.38 -0.15 -1.86 115.31 117.47 2hgc h LEU 40 Ca 0.06 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 2hgc h LEU 40 Cb 0.37 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2hgc h LEU 40 CO 0.01 0.64 -0.14 0.50 0.09 0.00 0.00 178.44 179.54 2hgc h LYS 41 N 1.07 0.71 -0.40 1.13 3.64 -0.55 -0.30 116.57 121.86 2hgc h LYS 41 Ca 0.30 -0.24 -0.08 0.00 -1.27 0.00 0.00 60.65 59.37 2hgc h LYS 41 Cb -0.08 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 2hgc h LYS 41 CO -0.08 0.81 -0.04 -0.09 -2.27 0.00 0.00 179.45 177.78 2hgc h ARG 42 N 0.64 0.74 0.00 1.90 2.43 -0.63 -2.82 114.38 116.65 2hgc h ARG 42 Ca 0.11 -0.26 -0.02 0.00 -0.81 0.00 0.00 59.98 59.00 2hgc h ARG 42 Cb 0.60 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.09 2hgc h ARG 42 CO 0.04 0.85 -0.07 0.93 -1.51 0.00 0.00 179.97 180.21 2hgc h GLU 43 N 0.57 0.00 -0.30 0.20 4.39 -1.31 -3.47 114.58 114.64 2hgc h GLU 43 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 2hgc h GLU 43 Cb 0.55 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2hgc h GLU 43 CO 0.03 0.07 0.00 0.41 -1.16 0.00 0.00 179.01 178.36 2hgc n GLY 44 N 0.93 1.04 0.08 -3.84 0.00 -0.66 -5.01 105.19 97.73 2hgc n GLY 44 Ca 0.03 -0.25 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 2hgc n GLY 44 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2hgc h TYR 45 N 0.00 0.04 -4.19 1.61 0.05 -1.34 -3.41 116.97 109.73 2hgc h TYR 45 Ca 0.00 -0.03 -0.12 0.00 0.05 0.00 0.00 58.73 58.63 2hgc h TYR 45 Cb 0.35 -0.00 -0.15 0.00 1.01 0.00 0.00 36.73 37.94 2hgc h TYR 45 CO 0.00 1.05 -0.64 0.96 -1.05 0.00 0.00 178.16 178.47 2hgc s ILE 46 N -2.63 0.21 0.15 -2.88 -0.00 -1.25 -1.17 121.20 113.64 2hgc s ILE 46 Ca -0.04 -1.73 0.05 0.00 -0.00 0.00 0.00 60.65 58.93 2hgc s ILE 46 Cb 0.08 -1.50 -0.04 0.00 -0.00 0.00 0.00 42.46 41.01 2hgc s ILE 46 CO 0.82 -0.96 -0.12 0.27 -0.00 0.00 0.00 174.94 174.96 2hgc s ILE 47 N -3.91 1.32 0.00 8.37 -0.00 0.56 -4.56 121.20 123.00 2hgc s ILE 47 Ca 0.07 -2.01 0.00 0.00 -0.00 0.00 0.00 60.65 58.70 2hgc s ILE 47 Cb 0.08 -1.81 0.00 0.00 -0.00 0.00 0.00 42.46 40.72 2hgc s ILE 47 CO -0.10 -0.64 0.00 0.61 -0.00 0.00 0.00 174.94 174.81 2hgc n GLY 48 N -0.07 1.06 3.60 6.27 0.00 -1.26 0.01 105.19 114.80 2hgc n GLY 48 Ca -0.11 -0.50 -0.43 0.00 0.00 0.00 0.00 46.02 44.98 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 3.57 -0.10 1.61 1.01 -1.26 -2.48 120.40 120.76 2hgc s VAL 49 Ca 0.00 0.58 -0.19 0.00 0.00 0.00 0.00 61.98 62.37 2hgc s VAL 49 Cb 0.00 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 2hgc s VAL 49 CO 0.00 -0.49 0.51 -2.28 0.00 0.00 0.00 175.10 172.84 2hgc s HIS 50 N 6.55 3.55 0.01 5.22 2.46 -1.26 -4.98 115.29 126.83 2hgc s HIS 50 Ca 0.76 0.96 0.01 0.00 0.47 0.00 0.00 55.06 57.26 2hgc s HIS 50 Cb -0.21 -2.57 -0.04 0.00 -0.13 0.00 0.00 32.58 29.63 2hgc s HIS 50 CO 0.33 0.20 0.05 0.71 -2.47 0.00 0.00 174.74 173.56 2hgc s TYR 51 N 0.49 3.19 0.08 3.88 1.51 -1.26 0.15 117.35 125.38 2hgc s TYR 51 Ca 0.28 0.14 0.00 0.00 -1.01 0.00 0.00 57.07 56.48 2hgc s TYR 51 Cb -0.16 -1.69 0.00 0.00 -0.11 0.00 0.00 41.96 40.00 2hgc s TYR 51 CO 0.12 0.51 0.00 0.45 -1.11 0.00 0.00 175.55 175.52 2hgc n SER 52 N 1.17 0.01 -1.75 2.29 2.88 -1.17 -4.82 113.62 112.22 2hgc n SER 52 Ca -0.13 0.13 -0.02 0.00 -1.33 0.00 0.00 58.87 57.52 2hgc n SER 52 Cb 0.53 0.09 0.30 0.00 -0.75 0.00 0.00 64.21 64.38 2hgc n SER 52 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2hgc n ASP 53 N -2.86 4.57 0.00 -3.46 5.75 -1.26 -4.86 116.55 114.43 2hgc n ASP 53 Ca 0.00 -3.22 0.00 0.00 -0.01 0.00 0.00 54.79 51.56 2hgc n ASP 53 Cb 0.06 -0.70 0.00 0.00 -1.03 0.00 0.00 41.12 39.45 2hgc n ASP 53 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 2hgc n ASP 54 N -0.23 0.00 -4.85 -1.12 2.03 -1.26 -5.01 116.55 106.11 2hgc n ASP 54 Ca 0.36 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.46 2hgc n ASP 54 Cb 1.27 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 41.63 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 -0.11 2.93 -0.01 -0.67 3.00 -1.26 -5.03 118.95 117.79 2hgc s ARG 55 Ca 0.00 -1.08 -0.30 0.00 0.00 0.00 0.00 55.73 54.35 2hgc s ARG 55 Cb 0.00 -2.58 -0.06 0.00 0.00 0.00 0.00 34.95 32.31 2hgc s ARG 55 CO 0.00 0.33 1.58 -2.14 0.00 0.00 0.00 175.30 175.07 2hgc s PRO 56 N -3.89 4.21 -0.23 3.54 0.02 -1.26 -3.06 135.00 134.33 2hgc s PRO 56 Ca 0.35 2.15 -0.03 0.00 0.02 0.00 0.00 61.00 63.48 2hgc s PRO 56 Cb -0.08 -3.78 0.08 0.00 0.02 0.00 0.00 34.50 30.74 2hgc s PRO 56 CO 0.26 -0.75 0.09 -1.01 -0.33 0.00 0.00 177.00 175.26 2hgc s HIS 57 N 3.25 0.69 -0.16 6.54 3.76 0.12 -4.86 115.29 124.63 2hgc s HIS 57 Ca 0.70 -0.83 -0.29 0.00 -0.15 0.00 0.00 55.06 54.49 2hgc s HIS 57 Cb -0.34 -0.99 -0.00 0.00 1.11 0.00 0.00 32.58 32.36 2hgc s HIS 57 CO 0.29 -0.68 1.03 -0.51 -0.85 0.00 0.00 174.74 174.02 2hgc s LEU 58 N 1.97 4.18 0.00 0.89 1.43 -1.26 -4.29 118.68 121.61 2hgc s LEU 58 Ca 0.04 1.48 0.02 0.00 -1.03 0.00 0.00 54.13 54.64 2hgc s LEU 58 Cb -0.16 -3.55 0.02 0.00 0.03 0.00 0.00 46.19 42.53 2hgc s LEU 58 CO -0.18 -0.56 0.18 -1.22 0.23 0.00 0.00 176.35 174.80 2hgc n TYR 59 N 5.62 -1.63 0.08 0.29 4.01 -1.26 -2.92 117.16 121.35 2hgc n TYR 59 Ca 0.10 -0.80 -0.12 0.00 -0.16 0.00 0.00 57.90 56.93 2hgc n TYR 59 Cb 0.47 -0.17 -0.05 0.00 -0.31 0.00 0.00 39.34 39.28 2hgc n TYR 59 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 2hgc h LYS 60 N 0.00 -0.27 -5.75 -0.72 1.57 -1.94 -3.35 116.57 106.10 2hgc h LYS 60 Ca -0.11 0.02 -0.67 0.00 -1.87 0.00 0.00 60.65 58.02 2hgc h LYS 60 Cb 0.44 0.06 -0.21 0.00 0.08 0.00 0.00 32.23 32.60 2hgc h LYS 60 CO 0.18 -0.18 -0.70 -0.51 -0.57 0.00 0.00 179.45 177.67 2hgc s LEU 61 N -10.28 3.12 0.00 2.94 2.01 -1.26 -4.72 118.68 110.49 2hgc s LEU 61 Ca -0.15 -0.10 0.00 0.00 0.01 0.00 0.00 54.13 53.89 2hgc s LEU 61 Cb 0.08 -1.70 0.00 0.00 0.01 0.00 0.00 46.19 44.57 2hgc s LEU 61 CO 0.66 0.27 0.00 0.61 1.01 0.00 0.00 176.35 178.90 2hgc n GLY 62 N 2.84 2.12 3.66 -3.19 0.00 -1.26 -5.03 105.19 104.32 2hgc n GLY 62 Ca -0.18 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 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 4.13 0.09 1.61 0.02 -1.03 -4.17 135.00 135.65 2hgc s PRO 63 Ca 0.00 2.36 0.03 0.00 0.02 0.00 0.00 61.00 63.41 2hgc s PRO 63 Cb 0.00 -4.08 -0.04 0.00 0.02 0.00 0.00 34.50 30.41 2hgc s PRO 63 CO 0.00 -0.94 -0.09 -1.21 -0.33 0.00 0.00 177.00 174.44 2hgc s GLU 64 N 4.30 0.82 0.07 5.54 2.02 0.10 -4.94 118.70 126.61 2hgc s GLU 64 Ca 0.81 -1.18 -0.08 0.00 0.02 0.00 0.00 54.97 54.54 2hgc s GLU 64 Cb -0.37 -0.42 -0.06 0.00 0.10 0.00 0.00 34.13 33.39 2hgc s GLU 64 CO 0.35 0.05 0.37 -0.51 0.02 0.00 0.00 175.26 175.54 2hgc s LEU 65 N -2.55 4.34 0.55 1.80 1.02 -1.26 -0.32 118.68 122.26 2hgc s LEU 65 Ca 0.06 0.71 0.01 0.00 0.02 0.00 0.00 54.13 54.93 2hgc s LEU 65 Cb -0.01 -2.97 0.03 0.00 0.02 0.00 0.00 46.19 43.26 2hgc s LEU 65 CO -0.01 0.17 0.78 0.42 0.02 0.00 0.00 176.35 177.72 2hgc s THR 66 N -1.42 2.68 0.28 5.49 -4.23 -0.31 -4.88 115.64 113.25 2hgc s THR 66 Ca 0.33 -0.65 0.25 0.00 -1.18 0.00 0.00 61.69 60.44 2hgc s THR 66 Cb -0.13 -3.01 0.25 0.00 1.34 0.00 0.00 72.50 70.95 2hgc s THR 66 CO 0.19 -0.01 1.94 1.05 -0.54 0.00 0.00 174.62 177.25 2hgc h GLU 67 N 0.06 0.00 -0.33 3.99 9.09 -1.91 -0.50 114.58 124.99 2hgc h GLU 67 Ca -0.42 0.00 0.01 0.00 0.05 0.00 0.00 59.36 59.00 2hgc h GLU 67 Cb 1.30 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.38 2hgc h GLU 67 CO 0.52 0.19 0.19 -0.22 0.05 0.00 0.00 179.01 179.75 2hgc h LYS 68 N 0.00 0.38 -0.01 1.06 1.63 -1.86 0.59 116.57 118.36 2hgc h LYS 68 Ca -0.00 -0.02 -0.20 0.00 -0.85 0.00 0.00 60.65 59.57 2hgc h LYS 68 Cb 0.56 -0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 32.10 2hgc h LYS 68 CO 0.03 0.25 -0.87 0.78 -3.45 0.00 0.00 179.45 176.19 2hgc h GLY 69 N 0.40 0.36 0.96 5.01 0.00 -1.57 -2.01 103.07 106.22 2hgc h GLY 69 Ca 0.13 -0.60 -0.04 0.00 0.00 0.00 0.00 47.33 46.82 2hgc h GLY 69 CO -0.06 0.53 0.12 -2.09 0.00 0.00 0.00 176.54 175.05 2hgc h GLU 70 N 0.19 0.74 -0.01 4.80 4.22 -0.74 -2.16 114.58 121.62 2hgc h GLU 70 Ca -0.05 -0.17 -0.11 0.00 0.08 0.00 0.00 59.36 59.11 2hgc h GLU 70 Cb 1.48 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 2hgc h GLU 70 CO 0.14 0.72 -0.50 -0.91 -2.18 0.00 0.00 179.01 176.29 2hgc h ASN 71 N 0.63 0.03 -0.50 1.04 -0.26 0.15 -2.96 115.58 113.70 2hgc h ASN 71 Ca 0.15 -0.01 -0.03 0.00 -0.56 0.00 0.00 56.30 55.84 2hgc h ASN 71 Cb 0.31 -0.01 -0.03 0.00 -1.06 0.00 0.00 38.32 37.53 2hgc h ASN 71 CO -0.00 0.53 0.20 0.22 -1.06 0.00 0.00 177.43 177.31 2hgc h TYR 72 N 0.02 0.81 0.00 1.19 3.20 -0.87 -2.18 116.97 119.14 2hgc h TYR 72 Ca -0.00 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.82 2hgc h TYR 72 Cb 0.89 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.92 2hgc h TYR 72 CO 0.00 0.64 0.00 -0.07 -1.64 0.00 0.00 178.16 177.09 2hgc h LEU 73 N 0.79 0.00 -0.94 2.82 3.38 -1.23 -2.61 115.31 117.52 2hgc h LEU 73 Ca 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 2hgc h LEU 73 Cb 0.19 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 2hgc h LEU 73 CO -0.01 0.00 0.58 0.50 0.09 0.00 0.00 178.44 179.60 2hgc h LYS 74 N 0.00 1.27 0.04 1.13 3.64 -1.50 -0.43 116.57 120.72 2hgc h LYS 74 Ca 0.00 -0.11 -0.17 0.00 -1.27 0.00 0.00 60.65 59.10 2hgc h LYS 74 Cb 0.14 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 2hgc h LYS 74 CO 0.00 0.88 -0.91 0.93 -2.27 0.00 0.00 179.45 178.08 2hgc h GLU 75 N 1.30 0.08 -0.18 1.90 4.39 -1.64 -3.36 114.58 117.07 2hgc h GLU 75 Ca 0.34 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.90 2hgc h GLU 75 Cb -0.07 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 2hgc h GLU 75 CO -0.07 1.07 0.00 0.27 -1.16 0.00 0.00 179.01 179.12 2hgc n ASN 76 N -4.33 1.58 0.33 1.42 6.94 -1.20 -4.18 115.26 115.82 2hgc n ASN 76 Ca -0.23 -1.73 0.20 0.00 -0.02 0.00 0.00 54.58 52.80 2hgc n ASN 76 Cb 0.69 -0.12 1.07 0.00 -2.36 0.00 0.00 39.78 39.07 2hgc n ASN 76 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 2hgc h GLY 77 N 5.07 0.00 0.36 4.83 0.00 -1.22 -2.81 103.07 109.30 2hgc h GLY 77 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2hgc h GLY 77 CO 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 176.54 176.37 2hgc h THR 78 N 0.00 0.00 0.00 4.70 1.03 -1.85 -3.48 112.91 113.31 2hgc h THR 78 Ca 0.01 -0.41 0.00 0.00 -0.01 0.00 0.00 66.41 66.00 2hgc h THR 78 Cb 0.22 0.00 0.00 0.00 -1.07 0.00 0.00 68.15 67.30 2hgc h THR 78 CO -0.00 0.00 0.00 1.87 -0.01 0.00 0.00 175.52 177.38 2hgc n TRP 79 N -4.43 0.00 -3.71 0.00 -0.00 -1.06 -4.87 117.44 103.36 2hgc n TRP 79 Ca -0.06 0.00 -0.25 0.00 -0.00 0.00 0.00 57.50 57.19 2hgc n TRP 79 Cb 0.19 0.02 0.03 0.00 -0.00 0.00 0.00 31.31 31.55 2hgc n TRP 79 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 177.69 178.12 2hgc n SER 80 N -3.42 -2.88 -4.56 5.87 7.64 -1.26 -4.79 113.62 110.22 2hgc n SER 80 Ca 0.00 -0.92 -0.36 0.00 1.01 0.00 0.00 58.87 58.59 2hgc n SER 80 Cb 0.00 -3.68 -0.03 0.00 -1.01 0.00 0.00 64.21 59.49 2hgc n SER 80 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2hgc n LYS 81 N -4.19 2.46 0.00 1.43 4.81 -1.26 -5.30 118.16 116.12 2hgc n LYS 81 Ca -0.21 -2.89 0.00 0.00 -0.87 0.00 0.00 58.31 54.34 2hgc n LYS 81 Cb 0.64 -3.59 0.00 0.00 0.02 0.00 0.00 35.03 32.10 2hgc n LYS 81 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57