#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 -1.18 -0.35 7.12 -2.01 -2.28 115.31 116.61 2hgc h LEU 6 Ca 0.00 0.00 0.08 0.00 0.13 0.00 0.00 57.88 58.09 2hgc h LEU 6 Cb 0.00 0.00 -0.06 0.00 -0.53 0.00 0.00 40.66 40.07 2hgc h LEU 6 CO 0.00 0.33 0.58 0.03 -0.13 0.00 0.00 178.44 179.24 2hgc h ARG 7 N 0.00 0.91 -0.61 1.25 3.08 -2.00 -1.44 114.38 115.57 2hgc h ARG 7 Ca -0.00 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.00 2hgc h ARG 7 Cb 0.64 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 2hgc h ARG 7 CO 0.04 0.60 0.40 -0.92 -1.07 0.00 0.00 179.97 179.03 2hgc h TYR 8 N 0.94 0.77 -0.92 3.04 3.20 -1.76 0.48 116.97 122.72 2hgc h TYR 8 Ca 0.40 0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.33 2hgc h TYR 8 Cb 0.31 -0.26 -0.06 0.00 1.54 0.00 0.00 36.73 38.26 2hgc h TYR 8 CO -0.00 0.48 0.59 0.00 -1.64 0.00 0.00 178.16 177.59 2hgc h ALA 9 N 1.23 1.23 -0.02 1.82 0.00 -1.29 0.13 119.26 122.35 2hgc h ALA 9 Ca 0.22 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2hgc h ALA 9 Cb -0.09 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.40 2hgc h ALA 9 CO -0.05 0.41 -0.02 0.82 0.00 0.00 0.00 179.25 180.42 2hgc h ILE 10 N 1.11 1.36 -0.68 0.00 2.04 -1.08 -3.10 117.51 117.16 2hgc h ILE 10 Ca 0.38 -1.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.14 2hgc h ILE 10 Cb 0.07 2.04 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 2hgc h ILE 10 CO -0.14 0.29 0.37 -0.07 0.00 0.00 0.00 178.15 178.59 2hgc h LEU 11 N -0.39 0.83 -1.23 1.44 4.07 -0.48 -1.67 115.31 117.89 2hgc h LEU 11 Ca 0.00 -0.07 -0.05 0.00 0.08 0.00 0.00 57.88 57.85 2hgc h LEU 11 Cb 0.47 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.00 2hgc h LEU 11 CO 0.00 0.67 -0.22 0.07 -1.08 0.00 0.00 178.44 177.89 2hgc h LYS 12 N 0.94 0.00 -0.06 1.13 5.09 -0.81 0.36 116.57 123.23 2hgc h LYS 12 Ca 0.24 0.00 -0.24 0.00 0.09 0.00 0.00 60.65 60.74 2hgc h LYS 12 Cb 0.03 0.00 0.01 0.00 0.10 0.00 0.00 32.23 32.37 2hgc h LYS 12 CO -0.04 0.22 -0.92 0.93 -2.09 0.00 0.00 179.45 177.55 2hgc h GLU 13 N 0.00 0.69 -0.25 0.07 4.39 -1.25 -0.91 114.58 117.31 2hgc h GLU 13 Ca -0.00 -0.66 -0.10 0.00 0.34 0.00 0.00 59.36 58.94 2hgc h GLU 13 Cb 0.69 0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 29.51 2hgc h GLU 13 CO 0.03 1.26 -0.23 0.82 -1.16 0.00 0.00 179.01 179.73 2hgc h ILE 14 N 0.42 1.31 0.03 3.13 2.04 -0.77 0.15 117.51 123.83 2hgc h ILE 14 Ca -0.09 -1.39 -0.00 0.00 1.00 0.00 0.00 64.86 64.38 2hgc h ILE 14 Cb 1.56 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 39.28 2hgc h ILE 14 CO 0.18 0.44 -0.01 0.15 0.00 0.00 0.00 178.15 178.90 2hgc h PHE 15 N 0.32 -0.03 0.22 1.37 3.57 -0.36 -0.15 116.94 121.88 2hgc h PHE 15 Ca 0.04 -0.00 -0.35 0.00 3.53 0.00 0.00 57.97 61.20 2hgc h PHE 15 Cb 0.78 0.01 0.02 0.00 2.79 0.00 0.00 35.95 39.56 2hgc h PHE 15 CO 0.07 0.52 -1.64 1.49 -2.23 0.00 0.00 178.31 176.52 2hgc h GLU 16 N -0.61 0.46 0.00 1.11 4.57 -1.27 -3.29 114.58 115.54 2hgc h GLU 16 Ca -0.00 -0.78 -0.13 0.00 -1.18 0.00 0.00 59.36 57.27 2hgc h GLU 16 Cb 0.57 0.29 -0.02 0.00 -0.16 0.00 0.00 28.75 29.43 2hgc h GLU 16 CO 0.01 1.37 -0.61 0.78 -1.18 0.00 0.00 179.01 179.38 2hgc h GLY 17 N 0.44 0.00 -1.69 1.92 0.00 -1.07 -3.47 103.07 99.20 2hgc h GLY 17 Ca -0.31 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 46.69 2hgc h GLY 17 CO 0.22 0.00 -0.37 -2.01 0.00 0.00 0.00 176.54 174.38 2hgc n ASN 18 N -3.36 -4.89 -1.38 0.19 4.05 -0.07 -4.73 115.26 105.07 2hgc n ASN 18 Ca 0.01 0.16 0.10 0.00 0.45 0.00 0.00 54.58 55.30 2hgc n ASN 18 Cb 0.73 -3.93 -0.06 0.00 1.23 0.00 0.00 39.78 37.76 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 -3.41 -1.34 -2.09 -0.44 -2.24 -1.23 -4.79 114.28 98.74 2hgc n THR 19 Ca -0.18 0.96 -0.27 0.00 -2.27 0.00 0.00 64.05 62.28 2hgc n THR 19 Cb 0.60 -1.50 0.11 0.00 -2.10 0.00 0.00 70.33 67.44 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 -4.70 1.69 -0.11 -0.78 0.04 -1.19 -4.65 135.00 125.29 2hgc s PRO 20 Ca 0.00 -0.28 -0.08 0.00 0.04 0.00 0.00 61.00 60.68 2hgc s PRO 20 Cb 0.00 -2.05 0.03 0.00 0.04 0.00 0.00 34.50 32.53 2hgc s PRO 20 CO 0.00 -1.65 0.27 -0.48 0.04 0.00 0.00 177.00 175.18 2hgc s LEU 21 N -5.49 0.72 0.65 -3.56 2.34 -1.26 -5.04 118.68 107.03 2hgc s LEU 21 Ca 0.65 0.57 -0.07 0.00 0.06 0.00 0.00 54.13 55.33 2hgc s LEU 21 Cb -0.08 0.90 0.03 0.00 -0.56 0.00 0.00 46.19 46.48 2hgc s LEU 21 CO 0.48 -0.12 0.97 -0.44 -1.06 0.00 0.00 176.35 176.18 2hgc s SER 22 N 0.58 5.26 0.24 1.48 0.01 -1.26 -4.93 113.70 115.08 2hgc s SER 22 Ca -0.04 0.66 -0.05 0.00 1.31 0.00 0.00 55.95 57.84 2hgc s SER 22 Cb -0.05 -1.49 0.38 0.00 0.21 0.00 0.00 66.02 65.07 2hgc s SER 22 CO -0.03 -1.31 1.81 -0.33 0.41 0.00 0.00 173.24 173.78 2hgc h GLU 23 N -0.41 0.75 0.00 12.44 3.07 -1.95 -1.06 114.58 127.43 2hgc h GLU 23 Ca -0.45 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 58.34 2hgc h GLU 23 Cb 1.28 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 29.02 2hgc h GLU 23 CO 0.61 0.50 -0.14 -0.97 -1.40 0.00 0.00 179.01 177.60 2hgc h ASN 24 N 0.77 0.00 -0.00 1.42 -0.00 -1.93 -0.74 115.58 115.09 2hgc h ASN 24 Ca 0.39 0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.69 2hgc h ASN 24 Cb 0.35 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.67 2hgc h ASN 24 CO -0.24 0.14 -0.01 0.44 -0.00 0.00 0.00 177.43 177.76 2hgc h ASP 25 N 0.00 0.01 -0.25 1.15 3.32 -1.55 -3.25 116.42 115.86 2hgc h ASP 25 Ca -0.00 -0.52 -0.16 0.00 0.02 0.00 0.00 57.03 56.37 2hgc h ASP 25 Cb 0.59 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 2hgc h ASP 25 CO 0.02 0.53 -0.44 -0.29 -1.72 0.00 0.00 179.24 177.34 2hgc h ILE 26 N -0.50 1.28 0.00 0.35 -0.00 -1.37 -3.48 117.51 113.79 2hgc h ILE 26 Ca 0.00 -1.62 0.00 0.00 -0.00 0.00 0.00 64.86 63.24 2hgc h ILE 26 Cb 0.53 1.51 0.00 0.00 -0.00 0.00 0.00 36.82 38.85 2hgc h ILE 26 CO 0.00 0.53 0.00 0.61 -0.00 0.00 0.00 178.15 179.29 2hgc n GLY 27 N 0.16 0.99 3.58 8.18 0.00 -0.31 -4.95 105.19 112.84 2hgc n GLY 27 Ca -0.03 0.00 -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 -1.84 2.94 0.77 1.61 -7.23 -1.04 -4.96 120.40 110.65 2hgc s VAL 28 Ca 0.00 -2.10 -0.11 0.00 -1.81 0.00 0.00 61.98 57.96 2hgc s VAL 28 Cb 0.00 -2.64 0.05 0.00 0.56 0.00 0.00 36.38 34.35 2hgc s VAL 28 CO 0.00 -0.35 1.09 0.28 -0.31 0.00 0.00 175.10 175.81 2hgc s THR 29 N -2.43 3.37 0.52 5.32 -1.32 -1.26 -4.15 115.64 115.69 2hgc s THR 29 Ca 0.32 0.45 0.17 0.00 -1.21 0.00 0.00 61.69 61.41 2hgc s THR 29 Cb -0.05 -2.95 0.27 0.00 -1.51 0.00 0.00 72.50 68.26 2hgc s THR 29 CO 0.18 -0.58 2.15 1.05 -2.21 0.00 0.00 174.62 175.21 2hgc h GLU 30 N -1.08 0.00 0.17 7.08 4.11 -1.97 0.21 114.58 123.11 2hgc h GLU 30 Ca -0.44 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 58.99 2hgc h GLU 30 Cb 1.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 2hgc h GLU 30 CO 0.52 0.01 -0.13 -0.44 0.07 0.00 0.00 179.01 179.04 2hgc h ASP 31 N 0.00 -0.33 0.31 3.06 3.32 -1.99 0.31 116.42 121.11 2hgc h ASP 31 Ca -0.00 0.03 -0.20 0.00 0.02 0.00 0.00 57.03 56.88 2hgc h ASP 31 Cb 0.03 0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 2hgc h ASP 31 CO 0.00 -0.20 -0.82 1.56 -1.72 0.00 0.00 179.24 178.06 2hgc h GLN 32 N -0.30 0.39 0.44 3.56 4.20 -1.79 -2.69 115.11 118.91 2hgc h GLN 32 Ca -0.01 -0.36 -0.01 0.00 0.06 0.00 0.00 58.65 58.33 2hgc h GLN 32 Cb 0.27 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 2hgc h GLN 32 CO -0.01 1.02 -0.30 0.35 -0.67 0.00 0.00 178.83 179.22 2hgc h PHE 33 N 0.25 -0.79 -0.28 2.96 3.57 -0.38 0.16 116.94 122.42 2hgc h PHE 33 Ca -0.05 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.50 2hgc h PHE 33 Cb 1.42 0.29 -0.05 0.00 2.79 0.00 0.00 35.95 40.40 2hgc h PHE 33 CO 0.05 -0.45 -0.04 0.22 -2.23 0.00 0.00 178.31 175.85 2hgc h ASP 34 N -0.71 -0.21 -0.13 0.41 1.82 -0.44 0.41 116.42 117.57 2hgc h ASP 34 Ca -0.04 0.08 0.03 0.00 -0.39 0.00 0.00 57.03 56.70 2hgc h ASP 34 Cb 0.60 0.15 -0.03 0.00 0.68 0.00 0.00 39.33 40.73 2hgc h ASP 34 CO 0.03 -0.07 -0.05 -0.78 -1.61 0.00 0.00 179.24 176.76 2hgc h ASP 35 N 0.03 -0.17 -0.20 2.28 3.58 -1.30 -1.15 116.42 119.49 2hgc h ASP 35 Ca 0.13 0.05 -0.08 0.00 0.42 0.00 0.00 57.03 57.55 2hgc h ASP 35 Cb 0.20 0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.35 2hgc h ASP 35 CO -0.27 -0.07 -0.20 0.00 -2.88 0.00 0.00 179.24 175.82 2hgc h ALA 36 N 1.09 0.29 -0.68 -0.78 0.00 -0.70 -2.73 119.26 115.76 2hgc h ALA 36 Ca 0.07 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 2hgc h ALA 36 Cb 0.13 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2hgc h ALA 36 CO -0.15 0.23 0.41 0.28 0.00 0.00 0.00 179.25 180.02 2hgc h VAL 37 N 0.16 1.19 0.02 0.00 2.07 -0.83 0.34 116.25 119.21 2hgc h VAL 37 Ca 0.03 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.14 2hgc h VAL 37 Cb 0.75 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 2hgc h VAL 37 CO 0.05 0.20 -0.04 0.78 0.02 0.00 0.00 177.57 178.58 2hgc h ASN 38 N 0.94 -0.11 -0.75 0.57 2.35 -1.12 -1.16 115.58 116.30 2hgc h ASN 38 Ca 0.25 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.97 2hgc h ASN 38 Cb -0.04 0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.34 2hgc h ASN 38 CO -0.05 -0.06 0.32 0.15 -1.65 0.00 0.00 177.43 176.14 2hgc h PHE 39 N -0.09 1.12 -0.65 1.19 3.57 -1.05 0.19 116.94 121.22 2hgc h PHE 39 Ca 0.01 -0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.41 2hgc h PHE 39 Cb 0.09 -0.34 -0.03 0.00 2.79 0.00 0.00 35.95 38.46 2hgc h PHE 39 CO -0.10 0.84 0.29 -0.07 -2.23 0.00 0.00 178.31 177.03 2hgc h LEU 40 N 1.09 0.85 -0.11 0.59 3.38 -0.72 0.15 115.31 120.55 2hgc h LEU 40 Ca 0.26 -0.10 -0.23 0.00 0.09 0.00 0.00 57.88 57.90 2hgc h LEU 40 Cb 0.17 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2hgc h LEU 40 CO -0.03 0.75 -1.01 0.50 0.09 0.00 0.00 178.44 178.74 2hgc h LYS 41 N 0.93 0.23 -0.14 1.13 3.64 -0.62 0.31 116.57 122.06 2hgc h LYS 41 Ca 0.22 -0.30 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 2hgc h LYS 41 Cb 0.14 0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2hgc h LYS 41 CO -0.02 1.06 -0.02 0.00 -2.27 0.00 0.00 179.45 178.20 2hgc h ARG 42 N 0.10 0.25 -0.13 1.90 2.47 -0.12 -3.02 114.38 115.84 2hgc h ARG 42 Ca -0.07 -0.09 0.00 0.00 -1.26 0.00 0.00 59.98 58.56 2hgc h ARG 42 Cb 1.69 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.99 2hgc h ARG 42 CO 0.16 0.53 0.00 0.39 0.56 0.00 0.00 179.97 181.61 2hgc n GLU 43 N -4.74 1.34 -3.00 0.04 -0.58 0.47 -4.90 120.64 109.28 2hgc n GLU 43 Ca -0.06 -0.53 -0.12 0.00 -0.42 0.00 0.00 57.16 56.04 2hgc n GLU 43 Cb 0.24 -1.18 0.06 0.00 -0.57 0.00 0.00 31.44 29.99 2hgc n GLU 43 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2hgc n GLY 44 N 0.80 -0.10 0.13 0.62 0.00 -1.07 -4.95 105.19 100.63 2hgc n GLY 44 Ca 0.08 -0.08 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.23 0.63 -3.89 1.61 4.01 0.11 -4.31 117.16 112.08 2hgc n TYR 45 Ca -0.18 0.13 -0.11 0.00 -0.16 0.00 0.00 57.90 57.59 2hgc n TYR 45 Cb 0.61 -1.08 -0.13 0.00 -0.31 0.00 0.00 39.34 38.43 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 -2.54 0.03 0.38 -0.72 -5.25 -1.16 -1.48 121.20 110.46 2hgc s ILE 46 Ca -0.28 -0.25 0.04 0.00 -0.99 0.00 0.00 60.65 59.17 2hgc s ILE 46 Cb 0.08 -0.10 -0.03 0.00 2.95 0.00 0.00 42.46 45.35 2hgc s ILE 46 CO 0.69 -0.14 0.12 0.27 -1.79 0.00 0.00 174.94 174.09 2hgc s ILE 47 N -0.40 0.69 0.00 8.37 -0.00 0.15 -4.07 121.20 125.95 2hgc s ILE 47 Ca -0.04 -2.00 0.00 0.00 -0.00 0.00 0.00 60.65 58.61 2hgc s ILE 47 Cb -0.03 -2.47 0.00 0.00 -0.00 0.00 0.00 42.46 39.97 2hgc s ILE 47 CO -0.00 0.00 0.00 0.61 -0.00 0.00 0.00 174.94 175.55 2hgc n GLY 48 N -0.82 0.74 3.60 6.27 0.00 -1.26 0.19 105.19 113.91 2hgc n GLY 48 Ca -0.04 0.00 -0.43 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 -2.45 3.97 -0.43 1.61 1.01 -1.26 -3.32 120.40 119.54 2hgc s VAL 49 Ca 0.00 0.99 -0.23 0.00 0.00 0.00 0.00 61.98 62.73 2hgc s VAL 49 Cb 0.00 -4.31 0.02 0.00 0.00 0.00 0.00 36.38 32.09 2hgc s VAL 49 CO 0.00 -0.83 0.81 -2.28 0.00 0.00 0.00 175.10 172.79 2hgc s HIS 50 N 5.22 3.01 0.15 5.22 2.46 -1.26 -4.92 115.29 125.17 2hgc s HIS 50 Ca 0.58 0.29 -0.30 0.00 0.47 0.00 0.00 55.06 56.10 2hgc s HIS 50 Cb -0.12 -3.65 -0.07 0.00 -0.13 0.00 0.00 32.58 28.61 2hgc s HIS 50 CO 0.32 -0.94 1.01 0.71 -2.47 0.00 0.00 174.74 173.37 2hgc s TYR 51 N 3.32 3.76 -0.44 3.88 1.51 -1.26 -1.63 117.35 126.48 2hgc s TYR 51 Ca 0.31 1.75 0.04 0.00 -1.01 0.00 0.00 57.07 58.16 2hgc s TYR 51 Cb -0.12 -3.12 0.58 0.00 -0.11 0.00 0.00 41.96 39.18 2hgc s TYR 51 CO 0.22 -0.05 1.79 0.45 -1.11 0.00 0.00 175.55 176.85 2hgc n SER 52 N 2.46 4.23 0.00 2.29 2.88 -0.71 -4.92 113.62 119.85 2hgc n SER 52 Ca 0.02 -3.70 0.00 0.00 -1.33 0.00 0.00 58.87 53.86 2hgc n SER 52 Cb 0.48 -0.79 0.00 0.00 -0.75 0.00 0.00 64.21 63.15 2hgc n SER 52 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2hgc n ASP 53 N -1.08 0.00 0.07 -3.46 2.03 -1.26 -4.53 116.55 108.32 2hgc n ASP 53 Ca 0.53 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.73 2hgc n ASP 53 Cb 1.29 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 41.61 2hgc n ASP 53 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 2hgc h ASP 54 N 0.00 -0.21 -5.25 1.67 2.03 -2.00 -3.48 116.42 109.18 2hgc h ASP 54 Ca 0.00 -0.32 -0.10 0.00 -0.73 0.00 0.00 57.03 55.88 2hgc h ASP 54 Cb 0.00 0.06 -0.13 0.00 -0.83 0.00 0.00 39.33 38.43 2hgc h ASP 54 CO 0.00 0.29 -0.33 -0.13 -1.03 0.00 0.00 179.24 178.04 2hgc s ARG 55 N -3.75 1.10 -0.63 4.15 1.81 -1.26 -5.10 118.95 115.27 2hgc s ARG 55 Ca -0.13 -1.14 -0.27 0.00 -1.72 0.00 0.00 55.73 52.47 2hgc s ARG 55 Cb 0.01 0.37 0.01 0.00 -0.45 0.00 0.00 34.95 34.88 2hgc s ARG 55 CO 0.50 -0.39 1.54 -1.25 -0.68 0.00 0.00 175.30 175.02 2hgc s PRO 56 N -3.95 3.04 -0.46 3.54 0.04 -1.26 -1.73 135.00 134.21 2hgc s PRO 56 Ca 0.15 0.33 -0.20 0.00 0.04 0.00 0.00 61.00 61.31 2hgc s PRO 56 Cb 0.04 -4.23 0.03 0.00 0.04 0.00 0.00 34.50 30.37 2hgc s PRO 56 CO -0.02 -2.27 0.65 -1.01 0.04 0.00 0.00 177.00 174.39 2hgc s HIS 57 N 7.02 3.05 -0.45 0.56 3.76 -0.65 -4.96 115.29 123.62 2hgc s HIS 57 Ca 0.53 -0.17 -0.29 0.00 -0.15 0.00 0.00 55.06 54.98 2hgc s HIS 57 Cb -0.11 -3.42 0.02 0.00 1.11 0.00 0.00 32.58 30.18 2hgc s HIS 57 CO 0.21 -0.93 1.33 -0.51 -0.85 0.00 0.00 174.74 173.98 2hgc s LEU 58 N 2.83 3.57 0.00 0.89 1.43 -1.26 -4.04 118.68 122.10 2hgc s LEU 58 Ca 0.21 0.64 0.00 0.00 -1.03 0.00 0.00 54.13 53.95 2hgc s LEU 58 Cb -0.15 -3.49 0.00 0.00 0.03 0.00 0.00 46.19 42.58 2hgc s LEU 58 CO 0.17 -1.41 0.00 -1.22 0.23 0.00 0.00 176.35 174.12 2hgc n TYR 59 N 8.62 -2.77 -0.01 0.29 4.01 -1.26 -4.56 117.16 121.48 2hgc n TYR 59 Ca 0.15 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.72 2hgc n TYR 59 Cb 0.48 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.40 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 0.32 -5.15 -0.72 1.57 -1.90 -3.15 116.57 107.53 2hgc h LYS 60 Ca 0.00 -0.34 -0.60 0.00 -1.87 0.00 0.00 60.65 57.84 2hgc h LYS 60 Cb 0.00 0.10 -0.32 0.00 0.08 0.00 0.00 32.23 32.08 2hgc h LYS 60 CO 0.00 1.04 -0.85 -1.17 -0.57 0.00 0.00 179.45 177.90 2hgc s LEU 61 N -8.40 1.90 0.00 2.94 2.96 -1.26 -4.56 118.68 112.26 2hgc s LEU 61 Ca -0.14 -0.42 0.00 0.00 -0.22 0.00 0.00 54.13 53.35 2hgc s LEU 61 Cb 0.02 -1.11 0.00 0.00 0.50 0.00 0.00 46.19 45.61 2hgc s LEU 61 CO 0.79 0.13 0.00 0.61 -1.32 0.00 0.00 176.35 176.56 2hgc n GLY 62 N 3.45 1.07 3.67 7.98 0.00 -1.26 -5.08 105.19 115.01 2hgc n GLY 62 Ca -0.20 -0.03 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 2hgc n GLY 62 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2hgc n PRO 63 N 0.00 2.74 -4.28 1.61 -0.02 -1.21 -4.33 135.00 129.51 2hgc n PRO 63 Ca 0.00 1.01 -0.22 0.00 -2.02 0.00 0.00 63.50 62.26 2hgc n PRO 63 Cb 0.00 -2.94 -0.12 0.00 -0.02 0.00 0.00 33.50 30.42 2hgc n PRO 63 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2hgc s GLU 64 N 4.33 1.13 0.12 -0.52 -6.30 0.13 -4.97 118.70 112.61 2hgc s GLU 64 Ca 0.89 -1.21 -0.06 0.00 -2.50 0.00 0.00 54.97 52.09 2hgc s GLU 64 Cb -0.48 -1.29 -0.06 0.00 0.00 0.00 0.00 34.13 32.30 2hgc s GLU 64 CO 0.44 0.29 0.38 -0.51 0.02 0.00 0.00 175.26 175.87 2hgc s LEU 65 N -2.13 4.29 0.42 2.70 1.02 -1.26 -0.67 118.68 123.04 2hgc s LEU 65 Ca 0.08 0.64 -0.01 0.00 0.02 0.00 0.00 54.13 54.86 2hgc s LEU 65 Cb -0.09 -3.20 -0.03 0.00 0.02 0.00 0.00 46.19 42.90 2hgc s LEU 65 CO 0.05 0.09 0.66 0.42 0.02 0.00 0.00 176.35 177.58 2hgc s THR 66 N -1.58 4.78 0.37 5.49 -4.23 -0.55 -4.91 115.64 115.01 2hgc s THR 66 Ca 0.38 -0.25 0.21 0.00 -1.18 0.00 0.00 61.69 60.85 2hgc s THR 66 Cb -0.13 -3.77 0.21 0.00 1.34 0.00 0.00 72.50 70.15 2hgc s THR 66 CO 0.22 -0.60 1.96 -0.08 -0.54 0.00 0.00 174.62 175.58 2hgc h GLU 67 N 0.49 0.00 0.17 3.99 4.81 -1.90 0.70 114.58 122.84 2hgc h GLU 67 Ca -0.48 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.74 2hgc h GLU 67 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 2hgc h GLU 67 CO 0.61 0.22 -0.08 -0.22 -0.73 0.00 0.00 179.01 178.80 2hgc h LYS 68 N 0.00 -0.21 -0.07 1.92 3.64 -1.90 -1.16 116.57 118.78 2hgc h LYS 68 Ca -0.00 0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.28 2hgc h LYS 68 Cb 0.48 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 2hgc h LYS 68 CO 0.03 -0.08 -0.45 0.78 -2.27 0.00 0.00 179.45 177.46 2hgc h GLY 69 N -0.29 0.18 1.01 5.01 0.00 -1.61 -1.49 103.07 105.87 2hgc h GLY 69 Ca -0.02 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.10 2hgc h GLY 69 CO 0.04 0.16 0.31 -2.09 0.00 0.00 0.00 176.54 174.96 2hgc h GLU 70 N 0.14 1.00 -0.07 4.80 4.22 -0.72 -0.26 114.58 123.68 2hgc h GLU 70 Ca 0.01 -0.16 -0.13 0.00 0.08 0.00 0.00 59.36 59.16 2hgc h GLU 70 Cb 0.85 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 2hgc h GLU 70 CO 0.07 0.80 -0.53 -0.91 -2.18 0.00 0.00 179.01 176.26 2hgc h ASN 71 N 0.96 0.20 -0.42 1.04 2.35 -1.01 -2.92 115.58 115.77 2hgc h ASN 71 Ca 0.23 -0.10 -0.06 0.00 -0.55 0.00 0.00 56.30 55.82 2hgc h ASN 71 Cb 0.15 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 2hgc h ASN 71 CO -0.03 0.70 0.08 0.22 -1.65 0.00 0.00 177.43 176.75 2hgc h TYR 72 N 0.15 0.81 -0.44 1.19 3.20 -0.56 -2.07 116.97 119.25 2hgc h TYR 72 Ca 0.00 -0.09 0.05 0.00 3.14 0.00 0.00 58.73 61.83 2hgc h TYR 72 Cb 0.99 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 39.00 2hgc h TYR 72 CO 0.01 0.71 0.29 -0.07 -1.64 0.00 0.00 178.16 177.47 2hgc h LEU 73 N 0.74 0.36 -1.37 2.82 3.38 -0.87 -1.50 115.31 118.87 2hgc h LEU 73 Ca 0.16 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 2hgc h LEU 73 Cb 0.34 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2hgc h LEU 73 CO 0.01 0.24 0.16 0.50 0.09 0.00 0.00 178.44 179.44 2hgc h LYS 74 N 0.41 0.59 0.14 1.13 3.64 -1.37 -0.39 116.57 120.73 2hgc h LYS 74 Ca 0.18 -0.08 -0.27 0.00 -1.27 0.00 0.00 60.65 59.21 2hgc h LYS 74 Cb 0.21 -0.11 0.01 0.00 -0.41 0.00 0.00 32.23 31.93 2hgc h LYS 74 CO -0.04 0.49 -1.36 0.93 -2.27 0.00 0.00 179.45 177.20 2hgc h GLU 75 N 0.59 0.29 -0.24 1.90 5.08 -1.33 -3.35 114.58 117.52 2hgc h GLU 75 Ca 0.14 -0.49 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 2hgc h GLU 75 Cb 0.13 0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2hgc h GLU 75 CO -0.01 1.24 0.00 0.27 -1.00 0.00 0.00 179.01 179.50 2hgc n ASN 76 N -3.91 1.98 0.30 1.42 2.04 -0.86 -4.33 115.26 111.90 2hgc n ASN 76 Ca -0.23 -1.80 0.12 0.00 -0.44 0.00 0.00 54.58 52.23 2hgc n ASN 76 Cb 0.92 -0.16 0.65 0.00 -2.53 0.00 0.00 39.78 38.67 2hgc n ASN 76 CO 0.00 0.00 0.00 1.23 -0.44 0.00 0.00 177.26 178.05 2hgc h GLY 77 N 4.98 0.00 0.00 4.83 0.00 -1.20 -3.34 103.07 108.34 2hgc h GLY 77 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2hgc h GLY 77 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 176.54 176.17 2hgc n THR 78 N -2.67 0.00 -1.07 4.70 5.66 -1.26 -5.07 114.28 114.56 2hgc n THR 78 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 2hgc n THR 78 Cb 0.42 -0.03 0.00 0.00 -1.55 0.00 0.00 70.33 69.17 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 -1.85 0.00 1.09 -0.00 -1.26 -4.64 117.44 110.79 2hgc n TRP 79 Ca 0.00 1.11 0.00 0.00 -0.00 0.00 0.00 57.50 58.61 2hgc n TRP 79 Cb 0.00 -2.63 0.00 0.00 -0.00 0.00 0.00 31.31 28.68 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 0.69 0.00 -4.58 5.87 7.64 -1.26 -4.75 113.62 117.24 2hgc n SER 80 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.51 2hgc n SER 80 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 2hgc n SER 80 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 2hgc s LYS 81 N 0.00 3.34 0.00 1.43 0.00 -1.26 -5.33 119.74 117.92 2hgc s LYS 81 Ca 0.00 -1.62 0.28 0.00 0.00 0.00 0.00 55.97 54.63 2hgc s LYS 81 Cb 0.00 -5.41 1.01 0.00 0.00 0.00 0.00 37.83 33.43 2hgc s LYS 81 CO 0.00 -2.99 1.72 0.00 0.00 0.00 0.00 175.35 174.08