#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 -0.77 -0.35 -0.00 -2.01 -2.15 115.31 110.03 2hgc h LEU 6 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.88 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 0.25 0.47 0.03 -0.00 0.00 0.00 178.44 179.20 2hgc h ARG 7 N 0.00 1.05 -0.43 1.13 2.47 -1.97 -2.60 114.38 114.03 2hgc h ARG 7 Ca -0.00 -0.09 -0.07 0.00 -1.26 0.00 0.00 59.98 58.55 2hgc h ARG 7 Cb 0.46 -0.22 -0.02 0.00 -1.65 0.00 0.00 29.97 28.54 2hgc h ARG 7 CO 0.03 0.73 -0.02 -0.92 0.56 0.00 0.00 179.97 180.36 2hgc h TYR 8 N 1.06 0.85 -0.39 3.04 3.20 -1.82 -2.24 116.97 120.66 2hgc h TYR 8 Ca 0.28 -0.15 0.04 0.00 3.14 0.00 0.00 58.73 62.04 2hgc h TYR 8 Cb -0.05 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 37.97 2hgc h TYR 8 CO -0.01 0.84 0.15 0.00 -1.64 0.00 0.00 178.16 177.51 2hgc h ALA 9 N 0.89 0.47 -0.60 1.82 0.00 -1.27 -1.08 119.26 119.48 2hgc h ALA 9 Ca 0.12 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2hgc h ALA 9 Cb 0.52 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 2hgc h ALA 9 CO 0.03 -0.23 0.35 0.82 0.00 0.00 0.00 179.25 180.22 2hgc h ILE 10 N 0.32 1.18 -0.46 0.00 2.04 -1.36 -0.75 117.51 118.49 2hgc h ILE 10 Ca 0.18 -0.43 0.06 0.00 1.00 0.00 0.00 64.86 65.66 2hgc h ILE 10 Cb 0.14 0.38 -0.05 0.00 -0.74 0.00 0.00 36.82 36.54 2hgc h ILE 10 CO -0.16 0.19 0.17 -0.07 0.00 0.00 0.00 178.15 178.28 2hgc h LEU 11 N 0.82 0.19 -0.35 1.44 3.38 -0.78 -0.11 115.31 119.90 2hgc h LEU 11 Ca 0.22 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 58.13 2hgc h LEU 11 Cb 0.00 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2hgc h LEU 11 CO -0.04 0.14 -0.20 0.50 0.09 0.00 0.00 178.44 178.93 2hgc h LYS 12 N 0.35 0.75 -0.45 1.13 3.64 -0.86 -1.12 116.57 120.00 2hgc h LYS 12 Ca 0.21 -0.34 -0.06 0.00 -1.27 0.00 0.00 60.65 59.19 2hgc h LYS 12 Cb 0.20 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 2hgc h LYS 12 CO -0.21 0.96 0.02 0.93 -2.27 0.00 0.00 179.45 178.88 2hgc h GLU 13 N 0.53 0.72 -0.52 1.90 4.39 -0.82 0.58 114.58 121.37 2hgc h GLU 13 Ca 0.07 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.53 2hgc h GLU 13 Cb 0.75 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.29 2hgc h GLU 13 CO 0.06 0.72 0.07 0.82 -1.16 0.00 0.00 179.01 179.52 2hgc h ILE 14 N 0.68 1.25 0.01 3.13 2.04 -0.92 0.31 117.51 124.01 2hgc h ILE 14 Ca 0.14 -0.96 -0.00 0.00 1.00 0.00 0.00 64.86 65.04 2hgc h ILE 14 Cb 0.39 0.87 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 2hgc h ILE 14 CO 0.01 0.34 -0.00 0.15 0.00 0.00 0.00 178.15 178.65 2hgc h PHE 15 N 0.74 -0.01 -0.04 1.37 3.57 -0.19 0.30 116.94 122.68 2hgc h PHE 15 Ca 0.16 -0.00 -0.18 0.00 3.53 0.00 0.00 57.97 61.48 2hgc h PHE 15 Cb 0.42 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 2hgc h PHE 15 CO 0.03 0.39 -0.75 0.93 -2.23 0.00 0.00 178.31 176.68 2hgc h GLU 16 N -0.41 0.26 0.02 1.11 5.08 0.08 -3.29 114.58 117.43 2hgc h GLU 16 Ca -0.00 -0.23 -0.29 0.00 -1.00 0.00 0.00 59.36 57.85 2hgc h GLU 16 Cb 0.40 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.66 2hgc h GLU 16 CO 0.00 0.89 -1.61 0.78 -1.00 0.00 0.00 179.01 178.08 2hgc h GLY 17 N 1.59 0.05 -0.37 -3.84 0.00 -0.96 -3.48 103.07 96.06 2hgc h GLY 17 Ca -0.03 -0.12 -0.16 0.00 0.00 0.00 0.00 47.33 47.02 2hgc h GLY 17 CO 0.12 0.11 -0.14 -2.01 0.00 0.00 0.00 176.54 174.61 2hgc n ASN 18 N -3.16 -4.03 -1.29 0.19 4.05 0.10 -4.85 115.26 106.27 2hgc n ASN 18 Ca -0.15 0.19 0.15 0.00 0.45 0.00 0.00 54.58 55.22 2hgc n ASN 18 Cb 1.03 -2.21 -0.06 0.00 1.23 0.00 0.00 39.78 39.78 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 -2.74 -0.04 -3.14 -0.44 -2.24 -1.23 -4.65 114.28 99.78 2hgc n THR 19 Ca -0.08 0.43 -0.28 0.00 -2.27 0.00 0.00 64.05 61.85 2hgc n THR 19 Cb 0.27 -0.83 -0.02 0.00 -2.10 0.00 0.00 70.33 67.65 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 -3.31 3.61 -0.14 -0.78 0.04 -1.19 -4.57 135.00 128.67 2hgc s PRO 20 Ca 0.00 0.06 -0.08 0.00 0.04 0.00 0.00 61.00 61.01 2hgc s PRO 20 Cb 0.00 -2.56 0.05 0.00 0.04 0.00 0.00 34.50 32.03 2hgc s PRO 20 CO 0.00 0.09 0.34 -0.48 0.04 0.00 0.00 177.00 176.99 2hgc s LEU 21 N -3.94 0.21 0.71 -3.56 2.34 -1.26 -5.00 118.68 108.18 2hgc s LEU 21 Ca 0.45 0.72 -0.07 0.00 0.06 0.00 0.00 54.13 55.30 2hgc s LEU 21 Cb -0.10 1.09 0.07 0.00 -0.56 0.00 0.00 46.19 46.68 2hgc s LEU 21 CO 0.34 -0.17 1.03 -0.44 -1.06 0.00 0.00 176.35 176.04 2hgc s SER 22 N 1.17 4.76 0.34 1.48 0.01 -1.26 -4.90 113.70 115.30 2hgc s SER 22 Ca -0.08 0.44 0.01 0.00 1.31 0.00 0.00 55.95 57.64 2hgc s SER 22 Cb -0.08 -1.07 0.60 0.00 0.21 0.00 0.00 66.02 65.68 2hgc s SER 22 CO -0.09 -1.64 2.00 1.05 0.41 0.00 0.00 173.24 174.97 2hgc h GLU 23 N -0.63 0.88 0.00 12.44 -0.00 -1.89 -0.69 114.58 124.68 2hgc h GLU 23 Ca -0.44 -0.05 -0.05 0.00 -0.00 0.00 0.00 59.36 58.81 2hgc h GLU 23 Cb 1.31 -0.20 -0.01 0.00 -0.00 0.00 0.00 28.75 29.86 2hgc h GLU 23 CO 0.60 0.59 -0.25 -2.95 -0.00 0.00 0.00 179.01 176.99 2hgc h ASN 24 N 0.91 0.00 -0.01 3.06 -1.07 -1.94 0.12 115.58 116.65 2hgc h ASN 24 Ca 0.25 0.00 -0.03 0.00 0.07 0.00 0.00 56.30 56.59 2hgc h ASN 24 Cb -0.08 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.17 2hgc h ASN 24 CO -0.06 0.25 -0.11 0.44 0.07 0.00 0.00 177.43 178.03 2hgc h ASP 25 N 0.00 0.12 0.48 6.14 5.19 -1.50 -3.34 116.42 123.51 2hgc h ASP 25 Ca -0.00 -0.71 -0.22 0.00 -0.62 0.00 0.00 57.03 55.48 2hgc h ASP 25 Cb 0.62 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 40.09 2hgc h ASP 25 CO 0.03 0.81 -0.96 -0.29 -3.12 0.00 0.00 179.24 175.71 2hgc h ILE 26 N -0.57 1.46 0.00 0.35 2.10 -1.30 -3.48 117.51 116.07 2hgc h ILE 26 Ca -0.01 -2.61 0.00 0.00 1.08 0.00 0.00 64.86 63.32 2hgc h ILE 26 Cb 0.81 2.51 0.00 0.00 -1.09 0.00 0.00 36.82 39.06 2hgc h ILE 26 CO 0.02 0.77 0.00 0.61 -1.08 0.00 0.00 178.15 178.47 2hgc n GLY 27 N 1.00 1.94 3.51 8.18 0.00 0.21 -5.11 105.19 114.92 2hgc n GLY 27 Ca -0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 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 1.17 0.59 1.61 -7.23 -0.09 -5.02 120.40 109.43 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 -2.69 0.00 0.00 0.56 0.00 0.00 36.38 34.25 2hgc s VAL 28 CO 0.00 0.00 0.92 0.42 -0.31 0.00 0.00 175.10 176.13 2hgc s THR 29 N -3.18 3.87 0.24 5.32 -4.23 -1.26 -3.93 115.64 112.46 2hgc s THR 29 Ca 0.32 0.15 -0.05 0.00 -1.18 0.00 0.00 61.69 60.92 2hgc s THR 29 Cb 0.07 -3.54 0.20 0.00 1.34 0.00 0.00 72.50 70.58 2hgc s THR 29 CO 0.15 -0.58 1.82 -0.33 -0.54 0.00 0.00 174.62 175.13 2hgc h GLU 30 N -0.20 0.79 -0.18 3.99 5.08 -1.98 0.14 114.58 122.22 2hgc h GLU 30 Ca -0.45 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 57.89 2hgc h GLU 30 Cb 1.24 -0.18 -0.06 0.00 0.50 0.00 0.00 28.75 30.26 2hgc h GLU 30 CO 0.61 0.52 -0.44 0.22 -1.00 0.00 0.00 179.01 178.93 2hgc h ASP 31 N 0.81 -1.41 -0.19 1.42 3.58 -1.99 0.12 116.42 118.77 2hgc h ASP 31 Ca 0.38 0.17 -0.01 0.00 0.42 0.00 0.00 57.03 57.99 2hgc h ASP 31 Cb 0.30 0.56 -0.01 0.00 1.72 0.00 0.00 39.33 41.90 2hgc h ASP 31 CO -0.22 -0.36 0.06 -0.61 -2.88 0.00 0.00 179.24 175.23 2hgc h GLN 32 N -0.41 0.29 0.18 0.28 5.75 -1.82 -0.87 115.11 118.50 2hgc h GLN 32 Ca 0.04 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.47 2hgc h GLN 32 Cb 0.52 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.03 2hgc h GLN 32 CO -0.39 0.38 -0.08 0.35 -2.65 0.00 0.00 178.83 176.44 2hgc h PHE 33 N 0.14 -0.22 -0.30 3.99 3.57 -0.60 0.24 116.94 123.75 2hgc h PHE 33 Ca 0.06 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.53 2hgc h PHE 33 Cb 0.21 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 2hgc h PHE 33 CO -0.00 0.01 0.07 0.22 -2.23 0.00 0.00 178.31 176.37 2hgc h ASP 34 N -0.42 0.46 -0.86 0.41 3.58 -0.78 -0.64 116.42 118.18 2hgc h ASP 34 Ca -0.02 -0.24 -0.03 0.00 0.42 0.00 0.00 57.03 57.16 2hgc h ASP 34 Cb 0.32 -0.12 -0.04 0.00 1.72 0.00 0.00 39.33 41.21 2hgc h ASP 34 CO 0.04 0.58 0.42 -0.78 -2.88 0.00 0.00 179.24 176.62 2hgc h ASP 35 N 0.32 1.12 0.05 2.28 3.58 -1.13 -2.20 116.42 120.44 2hgc h ASP 35 Ca 0.09 -0.13 -0.00 0.00 0.42 0.00 0.00 57.03 57.41 2hgc h ASP 35 Cb 0.30 -0.29 0.00 0.00 1.72 0.00 0.00 39.33 41.07 2hgc h ASP 35 CO 0.00 0.93 -0.02 0.00 -2.88 0.00 0.00 179.24 177.27 2hgc h ALA 36 N 1.24 -0.07 -0.85 -0.78 0.00 -0.16 -1.36 119.26 117.28 2hgc h ALA 36 Ca 0.30 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.19 2hgc h ALA 36 Cb 0.10 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 2hgc h ALA 36 CO -0.04 -0.49 0.54 0.28 0.00 0.00 0.00 179.25 179.53 2hgc h VAL 37 N -0.15 1.10 -0.38 0.00 2.07 -0.93 0.43 116.25 118.39 2hgc h VAL 37 Ca -0.01 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 2hgc h VAL 37 Cb 0.13 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 29.87 2hgc h VAL 37 CO 0.01 0.19 0.18 0.78 0.02 0.00 0.00 177.57 178.75 2hgc h ASN 38 N 1.02 0.51 -0.64 0.57 2.35 -1.28 0.94 115.58 119.05 2hgc h ASN 38 Ca 0.35 -0.13 -0.06 0.00 -0.55 0.00 0.00 56.30 55.90 2hgc h ASN 38 Cb 0.06 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.27 2hgc h ASN 38 CO -0.13 0.50 0.15 0.15 -1.65 0.00 0.00 177.43 176.44 2hgc h PHE 39 N 0.48 1.09 -0.30 1.19 3.57 -0.49 0.30 116.94 122.78 2hgc h PHE 39 Ca 0.13 -0.13 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 2hgc h PHE 39 Cb 0.13 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.55 2hgc h PHE 39 CO -0.01 0.91 0.10 -0.07 -2.23 0.00 0.00 178.31 177.01 2hgc h LEU 40 N 0.95 0.43 -1.10 0.59 3.38 0.11 -2.47 115.31 117.20 2hgc h LEU 40 Ca 0.20 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 2hgc h LEU 40 Cb 0.37 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2hgc h LEU 40 CO 0.00 0.51 -0.35 0.50 0.09 0.00 0.00 178.44 179.19 2hgc h LYS 41 N 0.33 0.00 0.14 1.13 3.64 -0.72 0.35 116.57 121.44 2hgc h LYS 41 Ca 0.10 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2hgc h LYS 41 Cb 0.23 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 2hgc h LYS 41 CO -0.00 0.35 -0.21 -0.09 -2.27 0.00 0.00 179.45 177.22 2hgc h ARG 42 N 0.00 -0.40 -0.00 1.90 9.65 -0.46 -2.36 114.38 122.71 2hgc h ARG 42 Ca -0.00 0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.90 2hgc h ARG 42 Cb 0.80 0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.47 2hgc h ARG 42 CO 0.05 -0.27 -0.40 0.39 2.80 0.00 0.00 179.97 182.53 2hgc n GLU 43 N -5.34 0.26 -1.26 0.20 1.02 -1.14 -4.96 120.64 109.42 2hgc n GLU 43 Ca -0.07 -0.15 0.00 0.00 -0.02 0.00 0.00 57.16 56.92 2hgc n GLU 43 Cb 0.25 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 2hgc n GLU 43 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2hgc n GLY 44 N 1.45 0.63 0.13 0.62 0.00 -0.65 -5.01 105.19 102.36 2hgc n GLY 44 Ca 0.08 -0.38 -0.21 0.00 0.00 0.00 0.00 46.02 45.51 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 0.61 -3.95 1.61 -1.99 -0.60 -3.43 116.97 109.22 2hgc h TYR 45 Ca 0.00 -0.45 -0.38 0.00 2.00 0.00 0.00 58.73 59.90 2hgc h TYR 45 Cb 0.69 -0.02 -0.21 0.00 2.00 0.00 0.00 36.73 39.19 2hgc h TYR 45 CO 0.00 1.57 -0.77 0.96 -0.00 0.00 0.00 178.16 179.93 2hgc s ILE 46 N -2.59 0.98 0.30 -2.88 -0.00 -1.26 -1.02 121.20 114.73 2hgc s ILE 46 Ca -0.14 -1.25 0.05 0.00 -0.00 0.00 0.00 60.65 59.32 2hgc s ILE 46 Cb 0.06 -0.96 -0.06 0.00 -0.00 0.00 0.00 42.46 41.50 2hgc s ILE 46 CO 0.85 -0.26 -0.01 0.27 -0.00 0.00 0.00 174.94 175.80 2hgc s ILE 47 N -1.29 1.43 0.00 8.37 -4.36 0.63 -4.60 121.20 121.38 2hgc s ILE 47 Ca -0.04 -2.06 0.00 0.00 -0.26 0.00 0.00 60.65 58.29 2hgc s ILE 47 Cb -0.10 -2.59 0.00 0.00 1.25 0.00 0.00 42.46 41.02 2hgc s ILE 47 CO 0.02 -0.18 0.00 0.61 0.24 0.00 0.00 174.94 175.63 2hgc n GLY 48 N -0.62 0.74 3.68 6.27 0.00 -1.26 0.27 105.19 114.27 2hgc n GLY 48 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 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 4.74 -0.24 1.61 1.01 -1.26 -4.29 120.40 119.96 2hgc s VAL 49 Ca 0.00 2.01 -0.11 0.00 0.00 0.00 0.00 61.98 63.88 2hgc s VAL 49 Cb 0.00 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 32.04 2hgc s VAL 49 CO 0.00 -0.01 0.17 -2.28 0.00 0.00 0.00 175.10 172.98 2hgc s HIS 50 N 2.13 3.32 -0.11 5.22 2.46 -1.26 -4.99 115.29 122.06 2hgc s HIS 50 Ca 0.49 0.25 -0.10 0.00 0.47 0.00 0.00 55.06 56.17 2hgc s HIS 50 Cb -0.18 -2.28 -0.05 0.00 -0.13 0.00 0.00 32.58 29.94 2hgc s HIS 50 CO 0.17 0.07 0.21 0.71 -2.47 0.00 0.00 174.74 173.43 2hgc s TYR 51 N 1.06 3.59 0.00 3.88 1.51 -1.26 -1.20 117.35 124.93 2hgc s TYR 51 Ca 0.08 0.61 0.00 0.00 -1.01 0.00 0.00 57.07 56.76 2hgc s TYR 51 Cb -0.14 -2.08 0.00 0.00 -0.11 0.00 0.00 41.96 39.64 2hgc s TYR 51 CO 0.05 0.62 0.10 0.43 -1.11 0.00 0.00 175.55 175.64 2hgc n SER 52 N 2.26 0.00 -0.01 2.29 7.64 -0.58 -4.77 113.62 120.46 2hgc n SER 52 Ca -0.18 0.29 0.02 0.00 1.01 0.00 0.00 58.87 60.01 2hgc n SER 52 Cb 0.54 -0.22 -0.04 0.00 -1.01 0.00 0.00 64.21 63.48 2hgc n SER 52 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2hgc n ASP 53 N -1.16 3.92 0.00 6.43 8.00 -1.26 -4.94 116.55 127.54 2hgc n ASP 53 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2hgc n ASP 53 Cb 0.00 1.10 0.00 0.00 -0.02 0.00 0.00 41.12 42.20 2hgc n ASP 53 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2hgc n ASP 54 N -1.76 0.00 -4.80 -2.24 5.75 -1.26 -5.14 116.55 107.11 2hgc n ASP 54 Ca -0.02 0.00 -0.39 0.00 -0.01 0.00 0.00 54.79 54.37 2hgc n ASP 54 Cb 0.22 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.25 2hgc n ASP 54 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2hgc s ARG 55 N -0.30 4.35 0.33 0.11 3.00 -1.26 -4.95 118.95 120.23 2hgc s ARG 55 Ca 0.00 0.92 -0.22 0.00 0.00 0.00 0.00 55.73 56.43 2hgc s ARG 55 Cb 0.00 -3.21 -0.10 0.00 0.00 0.00 0.00 34.95 31.64 2hgc s ARG 55 CO 0.00 0.59 0.87 -1.25 0.00 0.00 0.00 175.30 175.51 2hgc s PRO 56 N -1.22 4.36 -0.17 3.54 0.05 -1.26 -1.53 135.00 138.76 2hgc s PRO 56 Ca 0.33 1.10 0.00 0.00 0.05 0.00 0.00 61.00 62.49 2hgc s PRO 56 Cb -0.21 -2.62 0.04 0.00 0.05 0.00 0.00 34.50 31.76 2hgc s PRO 56 CO 0.22 0.21 -0.10 -1.01 0.05 0.00 0.00 177.00 176.38 2hgc s HIS 57 N -1.78 2.12 -0.24 0.56 3.76 -0.34 -4.97 115.29 114.40 2hgc s HIS 57 Ca 0.52 -1.33 -0.21 0.00 -0.15 0.00 0.00 55.06 53.89 2hgc s HIS 57 Cb -0.15 -1.52 -0.02 0.00 1.11 0.00 0.00 32.58 32.00 2hgc s HIS 57 CO 0.20 -0.68 0.65 -0.51 -0.85 0.00 0.00 174.74 173.55 2hgc s LEU 58 N 1.50 4.08 0.00 0.89 1.43 -1.26 -4.23 118.68 121.09 2hgc s LEU 58 Ca 0.01 0.77 0.04 0.00 -1.03 0.00 0.00 54.13 53.92 2hgc s LEU 58 Cb -0.15 -2.90 0.04 0.00 0.03 0.00 0.00 46.19 43.21 2hgc s LEU 58 CO -0.09 -0.37 0.35 -1.22 0.23 0.00 0.00 176.35 175.25 2hgc n TYR 59 N 5.63 -2.58 0.21 0.29 4.01 -1.26 -4.62 117.16 118.83 2hgc n TYR 59 Ca 0.00 -0.96 0.07 0.00 -0.16 0.00 0.00 57.90 56.85 2hgc n TYR 59 Cb 0.49 -0.25 0.43 0.00 -0.31 0.00 0.00 39.34 39.70 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 0.00 -3.80 -0.72 1.57 -1.87 -3.15 116.57 108.60 2hgc h LYS 60 Ca -0.12 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.06 2hgc h LYS 60 Cb 0.56 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.47 2hgc h LYS 60 CO 0.18 0.31 -0.75 -0.51 -0.57 0.00 0.00 179.45 178.11 2hgc s LEU 61 N -7.27 2.60 0.00 2.94 1.02 -1.26 -4.65 118.68 112.07 2hgc s LEU 61 Ca -0.01 -1.63 0.00 0.00 0.02 0.00 0.00 54.13 52.51 2hgc s LEU 61 Cb 0.12 -0.99 0.00 0.00 0.02 0.00 0.00 46.19 45.33 2hgc s LEU 61 CO 0.67 -0.39 0.00 0.61 0.02 0.00 0.00 176.35 177.26 2hgc n GLY 62 N 4.75 -1.18 3.66 -3.19 0.00 -1.26 -5.11 105.19 102.86 2hgc n GLY 62 Ca -0.02 0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.08 4.25 -0.08 1.61 0.04 -1.25 -4.27 135.00 135.22 2hgc s PRO 63 Ca 0.00 1.56 -0.05 0.00 0.04 0.00 0.00 61.00 62.55 2hgc s PRO 63 Cb 0.00 -3.71 -0.04 0.00 0.04 0.00 0.00 34.50 30.79 2hgc s PRO 63 CO 0.00 -0.66 0.15 -1.21 0.04 0.00 0.00 177.00 175.32 2hgc s GLU 64 N 3.31 3.43 -0.10 4.56 2.02 0.14 -4.88 118.70 127.17 2hgc s GLU 64 Ca 0.51 -0.21 -0.14 0.00 0.02 0.00 0.00 54.97 55.16 2hgc s GLU 64 Cb -0.20 -3.15 -0.05 0.00 0.10 0.00 0.00 34.13 30.84 2hgc s GLU 64 CO 0.12 0.74 0.33 -0.51 0.02 0.00 0.00 175.26 175.96 2hgc s LEU 65 N -1.36 4.34 0.71 1.80 1.02 -1.26 -0.27 118.68 123.66 2hgc s LEU 65 Ca 0.19 0.68 0.01 0.00 0.02 0.00 0.00 54.13 55.04 2hgc s LEU 65 Cb -0.12 -2.44 0.13 0.00 0.02 0.00 0.00 46.19 43.78 2hgc s LEU 65 CO 0.09 0.20 0.97 0.42 0.02 0.00 0.00 176.35 178.05 2hgc s THR 66 N -0.20 2.10 0.26 5.49 -4.23 -0.18 -4.87 115.64 114.01 2hgc s THR 66 Ca 0.20 -0.66 -0.04 0.00 -1.18 0.00 0.00 61.69 60.01 2hgc s THR 66 Cb -0.14 -2.44 0.26 0.00 1.34 0.00 0.00 72.50 71.52 2hgc s THR 66 CO 0.08 0.00 1.89 -0.08 -0.54 0.00 0.00 174.62 175.96 2hgc h GLU 67 N -0.44 1.15 -0.91 3.99 4.57 -1.89 0.71 114.58 121.76 2hgc h GLU 67 Ca -0.35 -0.07 0.01 0.00 -1.18 0.00 0.00 59.36 57.78 2hgc h GLU 67 Cb 1.27 -0.26 -0.05 0.00 -0.16 0.00 0.00 28.75 29.55 2hgc h GLU 67 CO 0.39 0.76 0.60 -0.22 -1.18 0.00 0.00 179.01 179.37 2hgc h LYS 68 N 1.19 1.18 -0.00 1.92 1.63 -1.88 -0.28 116.57 120.33 2hgc h LYS 68 Ca 0.41 -0.07 -0.22 0.00 -0.85 0.00 0.00 60.65 59.92 2hgc h LYS 68 Cb 0.09 -0.27 0.02 0.00 -0.60 0.00 0.00 32.23 31.47 2hgc h LYS 68 CO -0.15 0.78 -0.87 0.78 -3.45 0.00 0.00 179.45 176.55 2hgc h GLY 69 N 1.22 0.66 1.58 5.01 0.00 -1.54 -2.66 103.07 107.34 2hgc h GLY 69 Ca 0.34 -1.15 -0.07 0.00 0.00 0.00 0.00 47.33 46.45 2hgc h GLY 69 CO -0.08 1.02 -0.13 -2.09 0.00 0.00 0.00 176.54 175.25 2hgc h GLU 70 N 0.20 0.51 -0.12 4.80 4.81 -0.61 -1.92 114.58 122.24 2hgc h GLU 70 Ca -0.11 -0.15 -0.18 0.00 -0.13 0.00 0.00 59.36 58.79 2hgc h GLU 70 Cb 1.54 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.87 2hgc h GLU 70 CO 0.17 0.64 -0.68 -0.91 -0.73 0.00 0.00 179.01 177.50 2hgc h ASN 71 N 0.47 0.59 0.52 1.04 2.35 -1.12 -3.11 115.58 116.31 2hgc h ASN 71 Ca 0.08 -0.36 -0.05 0.00 -0.55 0.00 0.00 56.30 55.42 2hgc h ASN 71 Cb 0.51 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 2hgc h ASN 71 CO 0.03 1.10 -0.24 0.22 -1.65 0.00 0.00 177.43 176.89 2hgc h TYR 72 N 0.36 0.00 -0.83 1.19 3.20 -1.04 -2.19 116.97 117.66 2hgc h TYR 72 Ca -0.02 0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.86 2hgc h TYR 72 Cb 1.25 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.48 2hgc h TYR 72 CO 0.05 0.24 0.55 -0.07 -1.64 0.00 0.00 178.16 177.29 2hgc h LEU 73 N 0.00 0.95 -0.25 2.82 3.38 -1.29 0.39 115.31 121.30 2hgc h LEU 73 Ca -0.00 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 2hgc h LEU 73 Cb 0.57 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 2hgc h LEU 73 CO 0.03 0.68 -0.29 0.50 0.09 0.00 0.00 178.44 179.45 2hgc h LYS 74 N 1.12 0.65 -0.26 1.13 3.64 -1.49 0.18 116.57 121.54 2hgc h LYS 74 Ca 0.31 -0.36 -0.09 0.00 -1.27 0.00 0.00 60.65 59.24 2hgc h LYS 74 Cb -0.12 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2hgc h LYS 74 CO -0.07 0.97 -0.18 0.93 -2.27 0.00 0.00 179.45 178.83 2hgc h GLU 75 N 0.36 0.58 -0.16 1.90 4.39 -1.28 -2.72 114.58 117.64 2hgc h GLU 75 Ca 0.03 -0.28 0.00 0.00 0.34 0.00 0.00 59.36 59.46 2hgc h GLU 75 Cb 0.87 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 2hgc h GLU 75 CO 0.07 0.85 0.00 0.09 -1.16 0.00 0.00 179.01 178.87 2hgc n ASN 76 N -4.41 1.43 0.00 1.42 4.13 0.11 -3.74 115.26 114.19 2hgc n ASN 76 Ca -0.04 -1.71 0.02 0.00 1.68 0.00 0.00 54.58 54.53 2hgc n ASN 76 Cb 0.39 -0.10 0.09 0.00 -1.54 0.00 0.00 39.78 38.62 2hgc n ASN 76 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2hgc n GLY 77 N 1.06 -0.64 0.07 7.41 0.00 0.05 -0.93 105.19 112.21 2hgc n GLY 77 Ca 0.15 -0.02 0.15 0.00 0.00 0.00 0.00 46.02 46.30 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 -1.49 0.00 -1.49 2.61 5.66 -1.25 -4.88 114.28 113.44 2hgc n THR 78 Ca 0.01 -0.04 -0.32 0.00 -3.05 0.00 0.00 64.05 60.66 2hgc n THR 78 Cb 0.05 -0.31 0.07 0.00 -1.55 0.00 0.00 70.33 68.59 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 -2.29 2.67 0.46 1.09 -0.00 -0.11 -4.67 118.94 116.08 2hgc s TRP 79 Ca 0.37 1.54 0.00 0.00 -0.00 0.00 0.00 56.10 58.00 2hgc s TRP 79 Cb 0.21 -3.07 0.00 0.00 -0.00 0.00 0.00 33.47 30.61 2hgc s TRP 79 CO 0.42 -1.67 0.00 -1.13 -0.00 0.00 0.00 176.95 174.57 2hgc n SER 80 N -3.04 -7.77 0.00 5.86 3.41 -1.26 -4.78 113.62 106.03 2hgc n SER 80 Ca 0.09 0.98 0.00 0.00 -0.26 0.00 0.00 58.87 59.69 2hgc n SER 80 Cb 0.53 -4.26 0.00 0.00 -0.26 0.00 0.00 64.21 60.21 2hgc n SER 80 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2hgc n LYS 81 N -4.14 0.00 0.00 4.33 5.02 -1.26 -5.17 118.16 116.94 2hgc n LYS 81 Ca -0.04 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.39 2hgc n LYS 81 Cb 0.61 -0.63 0.81 0.00 -0.02 0.00 0.00 35.03 35.80 2hgc n LYS 81 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88