#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 0.39 -0.18 -5.58 7.99 -1.26 -3.79 117.00 114.57 2hgc n LEU 6 Ca 0.00 0.47 -0.09 0.00 -0.01 0.00 0.00 56.01 56.38 2hgc n LEU 6 Cb 0.00 -0.39 0.01 0.00 -0.11 0.00 0.00 43.42 42.93 2hgc n LEU 6 CO 0.00 -0.06 0.89 0.03 -1.51 0.00 0.00 177.39 176.74 2hgc h ARG 7 N 0.00 0.81 -0.67 3.23 2.47 -1.99 -2.43 114.38 115.80 2hgc h ARG 7 Ca 0.00 -0.20 0.01 0.00 -1.26 0.00 0.00 59.98 58.53 2hgc h ARG 7 Cb 0.61 -0.11 -0.04 0.00 -1.65 0.00 0.00 29.97 28.78 2hgc h ARG 7 CO 0.00 0.78 0.44 -0.92 0.56 0.00 0.00 179.97 180.83 2hgc h TYR 8 N 0.70 0.83 -0.61 3.04 3.20 -1.94 -0.96 116.97 121.24 2hgc h TYR 8 Ca 0.16 0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.12 2hgc h TYR 8 Cb 0.34 -0.28 -0.06 0.00 1.54 0.00 0.00 36.73 38.27 2hgc h TYR 8 CO 0.02 0.51 0.28 0.00 -1.64 0.00 0.00 178.16 177.34 2hgc h ALA 9 N 1.25 0.80 -0.09 1.82 0.00 -1.61 -1.27 119.26 120.17 2hgc h ALA 9 Ca 0.25 0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.06 2hgc h ALA 9 Cb -0.08 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.69 2hgc h ALA 9 CO -0.06 -0.09 -0.52 0.82 0.00 0.00 0.00 179.25 179.39 2hgc h ILE 10 N 0.52 1.37 0.04 0.00 2.04 -1.28 -3.06 117.51 117.15 2hgc h ILE 10 Ca 0.29 -1.86 0.02 0.00 1.00 0.00 0.00 64.86 64.30 2hgc h ILE 10 Cb 0.27 2.24 -0.03 0.00 -0.74 0.00 0.00 36.82 38.56 2hgc h ILE 10 CO -0.23 0.56 -0.16 -0.07 0.00 0.00 0.00 178.15 178.25 2hgc h LEU 11 N 0.10 -0.44 -1.21 1.44 3.38 -0.70 0.54 115.31 118.42 2hgc h LEU 11 Ca -0.04 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2hgc h LEU 11 Cb 1.18 0.18 -0.00 0.00 0.09 0.00 0.00 40.66 42.10 2hgc h LEU 11 CO 0.11 -0.22 -0.15 0.07 0.09 0.00 0.00 178.44 178.33 2hgc h LYS 12 N -0.28 0.00 0.00 1.13 5.09 -1.38 -1.27 116.57 119.87 2hgc h LYS 12 Ca 0.04 0.00 -0.08 0.00 0.09 0.00 0.00 60.65 60.70 2hgc h LYS 12 Cb 0.32 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.64 2hgc h LYS 12 CO -0.12 0.15 -0.38 1.49 -2.09 0.00 0.00 179.45 178.50 2hgc h GLU 13 N 0.00 0.00 -0.05 0.07 4.57 -1.27 -0.54 114.58 117.36 2hgc h GLU 13 Ca -0.00 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.12 2hgc h GLU 13 Cb 0.67 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.27 2hgc h GLU 13 CO 0.02 0.37 -0.21 0.82 -1.18 0.00 0.00 179.01 178.83 2hgc h ILE 14 N 0.00 1.45 0.00 2.32 2.04 -0.27 0.44 117.51 123.49 2hgc h ILE 14 Ca -0.01 -1.64 -0.00 0.00 1.00 0.00 0.00 64.86 64.21 2hgc h ILE 14 Cb 1.29 2.37 0.00 0.00 -0.74 0.00 0.00 36.82 39.74 2hgc h ILE 14 CO 0.05 0.46 -0.00 0.15 0.00 0.00 0.00 178.15 178.81 2hgc h PHE 15 N -0.30 -0.00 -0.01 1.37 3.57 -1.14 -2.96 116.94 117.47 2hgc h PHE 15 Ca -0.01 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2hgc h PHE 15 Cb 0.86 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.60 2hgc h PHE 15 CO 0.13 0.04 -0.60 0.39 -2.23 0.00 0.00 178.31 176.04 2hgc n GLU 16 N -5.07 0.89 0.03 1.11 -0.58 -0.22 -4.16 120.64 112.63 2hgc n GLU 16 Ca -0.07 -0.73 0.12 0.00 -0.42 0.00 0.00 57.16 56.06 2hgc n GLU 16 Cb 0.05 -1.48 0.19 0.00 -0.57 0.00 0.00 31.44 29.62 2hgc n GLU 16 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2hgc n GLY 17 N 1.44 -1.30 4.02 0.62 0.00 0.15 -4.93 105.19 105.19 2hgc n GLY 17 Ca 0.08 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.79 0.00 -1.47 1.61 5.15 -1.12 -4.81 115.26 112.83 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 0.39 -0.18 -0.06 0.00 -0.53 0.00 0.00 39.78 39.39 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 -1.83 -1.50 -2.13 -0.44 -2.24 -1.26 -4.62 114.28 100.26 2hgc n THR 19 Ca 0.00 1.07 -0.28 0.00 -2.27 0.00 0.00 64.05 62.58 2hgc n THR 19 Cb 0.00 -1.68 0.14 0.00 -2.10 0.00 0.00 70.33 66.69 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 -4.71 1.20 -0.15 -0.78 0.04 -1.22 -3.90 135.00 125.49 2hgc s PRO 20 Ca 0.00 -0.53 -0.10 0.00 0.04 0.00 0.00 61.00 60.41 2hgc s PRO 20 Cb 0.00 -2.02 0.05 0.00 0.04 0.00 0.00 34.50 32.57 2hgc s PRO 20 CO 0.00 -1.96 0.38 -0.48 0.04 0.00 0.00 177.00 174.98 2hgc s LEU 21 N -5.60 0.19 0.72 -3.56 2.34 -1.26 -5.02 118.68 106.49 2hgc s LEU 21 Ca 0.69 0.80 -0.07 0.00 0.06 0.00 0.00 54.13 55.62 2hgc s LEU 21 Cb -0.06 1.26 0.07 0.00 -0.56 0.00 0.00 46.19 46.90 2hgc s LEU 21 CO 0.49 -0.17 1.03 -0.44 -1.06 0.00 0.00 176.35 176.20 2hgc s SER 22 N 0.97 4.74 0.31 1.48 0.01 -1.26 -4.90 113.70 115.05 2hgc s SER 22 Ca -0.06 0.44 0.00 0.00 1.31 0.00 0.00 55.95 57.64 2hgc s SER 22 Cb -0.07 -1.06 0.52 0.00 0.21 0.00 0.00 66.02 65.62 2hgc s SER 22 CO -0.08 -1.65 1.96 1.05 0.41 0.00 0.00 173.24 174.93 2hgc h GLU 23 N -0.64 1.00 0.00 12.44 9.09 -1.92 -0.06 114.58 134.50 2hgc h GLU 23 Ca -0.44 -0.06 0.00 0.00 0.05 0.00 0.00 59.36 58.91 2hgc h GLU 23 Cb 1.31 -0.23 0.00 0.00 -1.65 0.00 0.00 28.75 28.19 2hgc h GLU 23 CO 0.59 0.66 0.00 -0.91 0.05 0.00 0.00 179.01 179.40 2hgc h ASN 24 N 1.03 0.00 0.00 3.06 2.35 -1.94 -0.62 115.58 119.46 2hgc h ASN 24 Ca 0.32 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.95 2hgc h ASN 24 Cb 0.01 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 2hgc h ASN 24 CO -0.09 0.00 -0.65 0.44 -1.65 0.00 0.00 177.43 175.48 2hgc h ASP 25 N 0.00 0.00 -0.09 5.81 3.32 -1.37 -3.39 116.42 120.70 2hgc h ASP 25 Ca 0.00 -0.75 -0.20 0.00 0.02 0.00 0.00 57.03 56.10 2hgc h ASP 25 Cb 0.35 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 2hgc h ASP 25 CO 0.00 1.25 -0.69 -0.29 -1.72 0.00 0.00 179.24 177.79 2hgc h ILE 26 N -1.00 1.30 0.00 0.35 -0.00 -1.30 -3.48 117.51 113.38 2hgc h ILE 26 Ca -0.18 -1.93 0.00 0.00 -0.00 0.00 0.00 64.86 62.75 2hgc h ILE 26 Cb 1.16 1.90 0.00 0.00 -0.00 0.00 0.00 36.82 39.88 2hgc h ILE 26 CO -0.11 0.61 0.00 0.61 -0.00 0.00 0.00 178.15 179.26 2hgc n GLY 27 N 0.55 1.84 3.52 8.18 0.00 -0.29 -5.08 105.19 113.91 2hgc n GLY 27 Ca -0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.72 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 1.01 0.49 1.61 -7.23 -0.87 -5.04 120.40 108.37 2hgc s VAL 28 Ca 0.00 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.08 2hgc s VAL 28 Cb 0.00 -2.57 -0.05 0.00 0.56 0.00 0.00 36.38 34.32 2hgc s VAL 28 CO 0.00 0.00 0.84 0.28 -0.31 0.00 0.00 175.10 175.91 2hgc s THR 29 N -3.18 4.81 0.45 5.32 -1.32 -1.26 -4.07 115.64 116.38 2hgc s THR 29 Ca 0.28 0.54 0.14 0.00 -1.21 0.00 0.00 61.69 61.44 2hgc s THR 29 Cb 0.06 -3.81 0.19 0.00 -1.51 0.00 0.00 72.50 67.42 2hgc s THR 29 CO 0.14 -0.79 2.00 1.05 -2.21 0.00 0.00 174.62 174.80 2hgc h GLU 30 N 0.49 0.03 -0.27 7.08 9.09 -1.98 0.11 114.58 129.13 2hgc h GLU 30 Ca -0.46 -0.01 0.03 0.00 0.05 0.00 0.00 59.36 58.97 2hgc h GLU 30 Cb 1.19 -0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.26 2hgc h GLU 30 CO 0.62 0.18 0.09 -0.44 0.05 0.00 0.00 179.01 179.51 2hgc h ASP 31 N 0.03 0.09 1.75 3.06 5.19 -1.99 -0.55 116.42 123.99 2hgc h ASP 31 Ca 0.00 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.45 2hgc h ASP 31 Cb 0.29 0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.82 2hgc h ASP 31 CO 0.02 0.08 -0.24 1.56 -3.12 0.00 0.00 179.24 177.54 2hgc h GLN 32 N 0.20 0.00 0.40 3.56 1.08 -1.73 -1.37 115.11 117.26 2hgc h GLN 32 Ca 0.12 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.30 2hgc h GLN 32 Cb 0.09 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 2hgc h GLN 32 CO -0.13 0.00 -0.19 0.35 -0.95 0.00 0.00 178.83 177.91 2hgc h PHE 33 N 0.00 -0.50 -0.36 2.96 3.57 -0.41 0.18 116.94 122.38 2hgc h PHE 33 Ca 0.00 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.54 2hgc h PHE 33 Cb 1.00 0.17 -0.05 0.00 2.79 0.00 0.00 35.95 39.86 2hgc h PHE 33 CO 0.00 -0.18 0.09 -0.44 -2.23 0.00 0.00 178.31 175.55 2hgc h ASP 34 N -0.83 0.06 -0.44 0.41 5.19 -1.15 0.53 116.42 120.19 2hgc h ASP 34 Ca -0.06 0.05 0.09 0.00 -0.62 0.00 0.00 57.03 56.49 2hgc h ASP 34 Cb 0.54 0.06 -0.08 0.00 0.18 0.00 0.00 39.33 40.04 2hgc h ASP 34 CO 0.09 0.07 -0.03 -0.78 -3.12 0.00 0.00 179.24 175.47 2hgc h ASP 35 N 0.22 -0.24 0.09 6.45 3.58 -1.20 0.99 116.42 126.31 2hgc h ASP 35 Ca 0.17 0.11 -0.00 0.00 0.42 0.00 0.00 57.03 57.73 2hgc h ASP 35 Cb 0.18 0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.44 2hgc h ASP 35 CO -0.21 -0.08 -0.04 0.00 -2.88 0.00 0.00 179.24 176.03 2hgc h ALA 36 N 1.40 -0.12 -0.79 -0.78 0.00 -0.25 -1.70 119.26 117.03 2hgc h ALA 36 Ca 0.22 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.96 2hgc h ALA 36 Cb 0.33 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 2hgc h ALA 36 CO -0.39 -0.37 0.51 0.28 0.00 0.00 0.00 179.25 179.28 2hgc h VAL 37 N -0.52 1.14 -0.56 0.00 2.07 -0.66 0.58 116.25 118.30 2hgc h VAL 37 Ca -0.01 -0.34 -0.07 0.00 0.82 0.00 0.00 66.70 67.09 2hgc h VAL 37 Cb 0.44 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 2hgc h VAL 37 CO 0.02 0.18 0.06 0.78 0.02 0.00 0.00 177.57 178.63 2hgc h ASN 38 N 1.00 0.92 -0.52 0.57 2.35 -0.84 -1.31 115.58 117.74 2hgc h ASN 38 Ca 0.31 -0.28 -0.05 0.00 -0.55 0.00 0.00 56.30 55.74 2hgc h ASN 38 Cb -0.02 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.08 2hgc h ASN 38 CO -0.10 0.96 0.15 0.15 -1.65 0.00 0.00 177.43 176.95 2hgc h PHE 39 N 0.84 0.86 -0.54 1.19 3.57 -0.32 0.60 116.94 123.13 2hgc h PHE 39 Ca 0.17 -0.09 0.01 0.00 3.53 0.00 0.00 57.97 61.59 2hgc h PHE 39 Cb 0.46 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.92 2hgc h PHE 39 CO 0.03 0.74 0.35 -0.07 -2.23 0.00 0.00 178.31 177.13 2hgc h LEU 40 N 0.72 0.58 -0.63 0.59 3.38 0.34 0.13 115.31 120.42 2hgc h LEU 40 Ca 0.17 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.99 2hgc h LEU 40 Cb 0.30 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2hgc h LEU 40 CO -0.00 0.42 -0.53 0.50 0.09 0.00 0.00 178.44 178.92 2hgc h LYS 41 N 0.70 0.42 -0.58 1.13 3.64 -1.10 0.50 116.57 121.28 2hgc h LYS 41 Ca 0.21 -0.25 -0.10 0.00 -1.27 0.00 0.00 60.65 59.24 2hgc h LYS 41 Cb -0.04 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 2hgc h LYS 41 CO -0.07 0.84 -0.02 -0.09 -2.27 0.00 0.00 179.45 177.85 2hgc h ARG 42 N 0.33 1.03 -0.08 1.90 2.43 -0.21 -2.98 114.38 116.80 2hgc h ARG 42 Ca 0.01 -0.34 -0.24 0.00 -0.81 0.00 0.00 59.98 58.60 2hgc h ARG 42 Cb 1.04 -0.09 0.02 0.00 -0.42 0.00 0.00 29.97 30.51 2hgc h ARG 42 CO 0.09 1.03 -0.91 1.49 -1.51 0.00 0.00 179.97 180.16 2hgc h GLU 43 N 0.92 0.75 0.00 0.20 4.22 -0.74 -3.48 114.58 116.45 2hgc h GLU 43 Ca 0.16 -0.70 0.00 0.00 0.08 0.00 0.00 59.36 58.90 2hgc h GLU 43 Cb 0.57 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.00 2hgc h GLU 43 CO 0.03 1.29 0.00 0.41 -2.18 0.00 0.00 179.01 178.57 2hgc n GLY 44 N 0.90 1.79 0.16 1.92 0.00 -0.27 -5.05 105.19 104.64 2hgc n GLY 44 Ca -0.09 0.00 -0.22 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 0.89 -4.30 1.61 0.05 -1.24 -3.42 116.97 110.57 2hgc h TYR 45 Ca 0.00 -0.58 -0.14 0.00 0.05 0.00 0.00 58.73 58.06 2hgc h TYR 45 Cb 0.00 -0.06 -0.15 0.00 1.01 0.00 0.00 36.73 37.53 2hgc h TYR 45 CO 0.00 1.43 -0.67 0.96 -1.05 0.00 0.00 178.16 178.83 2hgc s ILE 46 N -2.85 0.19 0.32 -2.88 -0.00 -1.26 -0.62 121.20 114.10 2hgc s ILE 46 Ca -0.11 -1.85 0.03 0.00 -0.00 0.00 0.00 60.65 58.73 2hgc s ILE 46 Cb 0.04 -1.70 -0.06 0.00 -0.00 0.00 0.00 42.46 40.74 2hgc s ILE 46 CO 0.91 -0.82 0.07 0.27 -0.00 0.00 0.00 174.94 175.37 2hgc s ILE 47 N -3.96 1.07 0.00 8.37 -0.00 0.12 -4.57 121.20 122.22 2hgc s ILE 47 Ca 0.13 -2.00 0.00 0.00 -0.00 0.00 0.00 60.65 58.78 2hgc s ILE 47 Cb 0.08 -2.76 0.00 0.00 -0.00 0.00 0.00 42.46 39.78 2hgc s ILE 47 CO -0.06 0.00 0.00 0.61 -0.00 0.00 0.00 174.94 175.49 2hgc n GLY 48 N -0.65 0.71 3.62 6.27 0.00 -1.25 -0.50 105.19 113.38 2hgc n GLY 48 Ca -0.02 -0.50 -0.43 0.00 0.00 0.00 0.00 46.02 45.07 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 4.49 0.11 1.61 1.01 -1.26 -3.32 120.40 121.04 2hgc s VAL 49 Ca 0.00 1.42 -0.19 0.00 0.00 0.00 0.00 61.98 63.21 2hgc s VAL 49 Cb 0.00 -4.41 -0.07 0.00 0.00 0.00 0.00 36.38 31.90 2hgc s VAL 49 CO 0.00 -0.59 0.61 -1.00 0.00 0.00 0.00 175.10 174.11 2hgc s HIS 50 N 3.71 3.78 -0.05 5.22 3.76 -1.21 -4.95 115.29 125.55 2hgc s HIS 50 Ca 0.43 1.30 0.06 0.00 -0.15 0.00 0.00 55.06 56.70 2hgc s HIS 50 Cb -0.11 -2.52 -0.01 0.00 1.11 0.00 0.00 32.58 31.04 2hgc s HIS 50 CO 0.19 0.54 -0.25 0.71 -0.85 0.00 0.00 174.74 175.08 2hgc s TYR 51 N -1.20 2.42 0.00 1.40 1.51 -1.26 0.24 117.35 120.46 2hgc s TYR 51 Ca 0.32 -0.68 0.00 0.00 -1.01 0.00 0.00 57.07 55.71 2hgc s TYR 51 Cb -0.19 -1.58 0.00 0.00 -0.11 0.00 0.00 41.96 40.08 2hgc s TYR 51 CO 0.20 -0.19 0.00 0.43 -1.11 0.00 0.00 175.55 174.88 2hgc n SER 52 N 2.86 0.00 -0.11 2.29 7.64 -1.13 -4.86 113.62 120.31 2hgc n SER 52 Ca -0.17 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.63 2hgc n SER 52 Cb 0.52 0.00 0.08 0.00 -1.01 0.00 0.00 64.21 63.80 2hgc n SER 52 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2hgc h ASP 53 N 0.00 0.84 0.00 6.43 5.19 -1.99 -3.45 116.42 123.43 2hgc h ASP 53 Ca 0.00 -0.28 0.00 0.00 -0.62 0.00 0.00 57.03 56.13 2hgc h ASP 53 Cb 0.00 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 39.28 2hgc h ASP 53 CO 0.00 1.00 0.00 -0.67 -3.12 0.00 0.00 179.24 176.45 2hgc n ASP 54 N -4.13 0.00 -4.86 6.45 2.03 -1.26 -5.15 116.55 109.62 2hgc n ASP 54 Ca 0.01 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 55.09 2hgc n ASP 54 Cb 0.41 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.77 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 0.00 3.09 0.18 -0.67 0.52 -1.26 -5.01 118.95 115.80 2hgc s ARG 55 Ca 0.00 -0.90 -0.30 0.00 -0.52 0.00 0.00 55.73 54.01 2hgc s ARG 55 Cb 0.00 -2.70 -0.08 0.00 0.52 0.00 0.00 34.95 32.69 2hgc s ARG 55 CO 0.00 0.44 1.22 -1.25 0.02 0.00 0.00 175.30 175.72 2hgc s PRO 56 N -3.65 4.47 -0.04 3.54 0.04 -1.26 -2.83 135.00 135.28 2hgc s PRO 56 Ca 0.33 1.90 0.04 0.00 0.04 0.00 0.00 61.00 63.31 2hgc s PRO 56 Cb -0.09 -3.24 -0.00 0.00 0.04 0.00 0.00 34.50 31.21 2hgc s PRO 56 CO 0.26 -0.12 -0.16 -1.01 0.04 0.00 0.00 177.00 176.00 2hgc s HIS 57 N 0.03 1.65 0.14 0.56 3.76 0.14 -4.98 115.29 116.58 2hgc s HIS 57 Ca 0.54 -0.47 0.00 0.00 -0.15 0.00 0.00 55.06 54.97 2hgc s HIS 57 Cb -0.33 -1.12 -0.04 0.00 1.11 0.00 0.00 32.58 32.20 2hgc s HIS 57 CO 0.36 -0.16 0.30 -0.51 -0.85 0.00 0.00 174.74 173.88 2hgc s LEU 58 N 0.06 4.31 0.00 0.89 1.43 -1.26 -3.33 118.68 120.78 2hgc s LEU 58 Ca -0.04 0.31 0.05 0.00 -1.03 0.00 0.00 54.13 53.42 2hgc s LEU 58 Cb -0.11 -3.04 -0.02 0.00 0.03 0.00 0.00 46.19 43.05 2hgc s LEU 58 CO 0.02 0.06 0.17 -1.22 0.23 0.00 0.00 176.35 175.61 2hgc n TYR 59 N -0.26 -0.22 0.15 0.29 4.01 -1.26 -4.61 117.16 115.26 2hgc n TYR 59 Ca -0.05 -2.23 -0.00 0.00 -0.16 0.00 0.00 57.90 55.46 2hgc n TYR 59 Cb 0.53 0.10 0.20 0.00 -0.31 0.00 0.00 39.34 39.86 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 -4.51 -0.72 1.57 -1.82 -3.22 116.57 107.87 2hgc h LYS 60 Ca -0.23 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.02 2hgc h LYS 60 Cb 1.00 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 32.96 2hgc h LYS 60 CO 0.36 0.57 -0.82 -1.17 -0.57 0.00 0.00 179.45 177.82 2hgc s LEU 61 N -7.56 1.55 0.00 2.94 0.20 -1.26 -4.75 118.68 109.79 2hgc s LEU 61 Ca -0.01 -0.33 0.00 0.00 0.69 0.00 0.00 54.13 54.48 2hgc s LEU 61 Cb 0.13 -0.88 0.00 0.00 -0.43 0.00 0.00 46.19 45.00 2hgc s LEU 61 CO 0.75 -0.01 0.00 0.61 -0.29 0.00 0.00 176.35 177.41 2hgc n GLY 62 N 4.16 0.30 3.55 7.98 0.00 -1.26 -5.10 105.19 114.82 2hgc n GLY 62 Ca -0.20 0.14 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 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 2.71 -0.09 1.61 0.02 -1.21 -3.89 135.00 134.15 2hgc s PRO 63 Ca 0.00 0.60 -0.03 0.00 0.02 0.00 0.00 61.00 61.60 2hgc s PRO 63 Cb 0.00 -4.36 -0.03 0.00 0.02 0.00 0.00 34.50 30.13 2hgc s PRO 63 CO 0.00 -2.63 0.03 -1.21 -0.33 0.00 0.00 177.00 172.85 2hgc s GLU 64 N 6.85 3.06 0.04 5.54 0.41 0.34 -4.95 118.70 130.00 2hgc s GLU 64 Ca 0.66 -0.37 -0.17 0.00 -0.41 0.00 0.00 54.97 54.68 2hgc s GLU 64 Cb -0.13 -2.86 -0.06 0.00 -1.78 0.00 0.00 34.13 29.30 2hgc s GLU 64 CO 0.21 0.71 0.50 -0.51 -0.49 0.00 0.00 175.26 175.69 2hgc s LEU 65 N -0.95 4.51 0.75 1.80 1.02 -1.26 -0.70 118.68 123.84 2hgc s LEU 65 Ca 0.14 1.14 -0.03 0.00 0.02 0.00 0.00 54.13 55.40 2hgc s LEU 65 Cb -0.11 -2.77 0.13 0.00 0.02 0.00 0.00 46.19 43.46 2hgc s LEU 65 CO 0.03 0.30 1.03 0.42 0.02 0.00 0.00 176.35 178.15 2hgc s THR 66 N -1.10 2.15 0.44 5.49 -4.23 0.21 -4.83 115.64 113.77 2hgc s THR 66 Ca 0.27 -0.50 0.10 0.00 -1.18 0.00 0.00 61.69 60.38 2hgc s THR 66 Cb -0.18 -2.64 0.28 0.00 1.34 0.00 0.00 72.50 71.29 2hgc s THR 66 CO 0.17 0.00 2.07 -0.33 -0.54 0.00 0.00 174.62 175.98 2hgc h GLU 67 N -0.66 0.40 -0.44 3.99 4.39 -1.91 0.19 114.58 120.54 2hgc h GLU 67 Ca -0.38 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.27 2hgc h GLU 67 Cb 1.27 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.81 2hgc h GLU 67 CO 0.41 0.27 0.18 -0.22 -1.16 0.00 0.00 179.01 178.49 2hgc h LYS 68 N 0.41 0.65 0.05 2.33 1.63 -1.84 -0.50 116.57 119.31 2hgc h LYS 68 Ca 0.14 -0.12 -0.23 0.00 -0.85 0.00 0.00 60.65 59.59 2hgc h LYS 68 Cb 0.04 -0.11 0.02 0.00 -0.60 0.00 0.00 32.23 31.59 2hgc h LYS 68 CO -0.03 0.60 -0.95 0.78 -3.45 0.00 0.00 179.45 176.40 2hgc h GLY 69 N 0.57 0.61 1.04 5.01 0.00 -1.43 -2.31 103.07 106.56 2hgc h GLY 69 Ca 0.15 -1.18 -0.06 0.00 0.00 0.00 0.00 47.33 46.23 2hgc h GLY 69 CO -0.01 1.04 0.15 -2.09 0.00 0.00 0.00 176.54 175.63 2hgc h GLU 70 N 0.12 1.02 0.00 4.80 4.81 -0.62 -2.15 114.58 122.57 2hgc h GLU 70 Ca -0.13 -0.25 -0.01 0.00 -0.13 0.00 0.00 59.36 58.84 2hgc h GLU 70 Cb 1.64 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.89 2hgc h GLU 70 CO 0.18 0.93 -0.03 -0.91 -0.73 0.00 0.00 179.01 178.45 2hgc h ASN 71 N 0.94 0.00 -0.08 1.04 2.35 -1.19 -2.78 115.58 115.86 2hgc h ASN 71 Ca 0.20 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.89 2hgc h ASN 71 Cb 0.37 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 2hgc h ASN 71 CO 0.00 0.03 -0.12 0.22 -1.65 0.00 0.00 177.43 175.91 2hgc h TYR 72 N 0.00 0.43 0.00 1.19 3.20 -0.82 -1.95 116.97 119.02 2hgc h TYR 72 Ca -0.00 -0.06 -0.01 0.00 3.14 0.00 0.00 58.73 61.80 2hgc h TYR 72 Cb 0.98 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 39.13 2hgc h TYR 72 CO 0.00 0.52 -0.03 -0.07 -1.64 0.00 0.00 178.16 176.94 2hgc h LEU 73 N 0.38 0.00 0.00 2.82 3.38 -1.11 -1.02 115.31 119.76 2hgc h LEU 73 Ca 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2hgc h LEU 73 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2hgc h LEU 73 CO 0.03 0.03 -0.00 0.50 0.09 0.00 0.00 178.44 179.09 2hgc h LYS 74 N 0.00 -0.00 -0.16 1.13 3.64 -1.44 -0.04 116.57 119.70 2hgc h LYS 74 Ca -0.00 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.16 2hgc h LYS 74 Cb 0.07 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.90 2hgc h LYS 74 CO 0.00 0.71 -0.74 1.05 -2.27 0.00 0.00 179.45 178.20 2hgc h GLU 75 N -0.71 0.79 -0.42 1.90 4.11 -1.40 -3.12 114.58 115.73 2hgc h GLU 75 Ca -0.00 -0.63 0.00 0.00 0.07 0.00 0.00 59.36 58.80 2hgc h GLU 75 Cb 0.71 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.09 2hgc h GLU 75 CO 0.00 1.24 0.00 -1.71 0.07 0.00 0.00 179.01 178.61 2hgc n ASN 76 N -3.97 3.39 0.30 3.06 5.15 -0.41 -4.05 115.26 118.73 2hgc n ASN 76 Ca -0.07 -1.98 0.19 0.00 -0.60 0.00 0.00 54.58 52.12 2hgc n ASN 76 Cb 0.73 -0.27 0.99 0.00 -0.53 0.00 0.00 39.78 40.70 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 4.57 0.00 2.00 8.20 0.00 -0.93 0.37 103.07 117.28 2hgc h GLY 77 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 2hgc h GLY 77 CO 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 176.54 176.31 2hgc h THR 78 N 0.00 0.44 -6.20 4.70 1.03 -1.77 -3.48 112.91 107.63 2hgc h THR 78 Ca 0.02 -1.37 -0.39 0.00 -0.01 0.00 0.00 66.41 64.67 2hgc h THR 78 Cb 0.29 2.01 0.07 0.00 -1.07 0.00 0.00 68.15 69.45 2hgc h THR 78 CO -0.00 0.22 -0.86 1.87 -0.01 0.00 0.00 175.52 176.75 2hgc n TRP 79 N -3.23 -2.04 -2.91 0.00 -0.00 0.13 -4.97 117.44 104.42 2hgc n TRP 79 Ca 0.02 0.57 0.03 0.00 -0.00 0.00 0.00 57.50 58.11 2hgc n TRP 79 Cb 0.54 -3.43 0.00 0.00 -0.00 0.00 0.00 31.31 28.43 2hgc n TRP 79 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 177.69 176.15 2hgc s SER 80 N -3.35 -0.44 -0.89 5.87 1.04 -1.26 -5.10 113.70 109.58 2hgc s SER 80 Ca 0.37 -0.14 -0.02 0.00 0.48 0.00 0.00 55.95 56.64 2hgc s SER 80 Cb -0.13 0.77 0.22 0.00 0.10 0.00 0.00 66.02 66.97 2hgc s SER 80 CO 0.85 -0.06 0.77 -0.54 0.98 0.00 0.00 173.24 175.25 2hgc s LYS 81 N 2.26 3.28 0.00 4.02 1.02 -1.26 -5.12 119.74 123.93 2hgc s LYS 81 Ca 0.18 -3.24 0.18 0.00 0.02 0.00 0.00 55.97 53.11 2hgc s LYS 81 Cb 0.01 -3.97 0.14 0.00 -0.52 0.00 0.00 37.83 33.49 2hgc s LYS 81 CO -0.17 -1.26 1.06 0.00 -0.92 0.00 0.00 175.35 174.06