#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 0.28 -1.82 -0.35 -0.00 -2.06 -2.62 115.31 108.74 2hgc h LEU 6 Ca 0.00 -0.21 -0.03 0.00 -0.00 0.00 0.00 57.88 57.64 2hgc h LEU 6 Cb 0.00 -0.08 -0.00 0.00 -0.00 0.00 0.00 40.66 40.57 2hgc h LEU 6 CO 0.00 0.98 -0.13 0.03 -0.00 0.00 0.00 178.44 179.33 2hgc h ARG 7 N 0.13 0.00 -0.34 1.13 -0.00 -2.00 -1.82 114.38 111.49 2hgc h ARG 7 Ca -0.04 0.00 -0.14 0.00 -0.50 0.00 0.00 59.98 59.30 2hgc h ARG 7 Cb 1.43 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 31.39 2hgc h ARG 7 CO 0.13 0.13 -0.33 -0.92 0.00 0.00 0.00 179.97 178.97 2hgc h TYR 8 N 0.00 0.98 -0.47 3.04 3.20 -1.92 -2.86 116.97 118.94 2hgc h TYR 8 Ca -0.00 -0.29 0.05 0.00 3.14 0.00 0.00 58.73 61.63 2hgc h TYR 8 Cb 0.24 -0.21 -0.05 0.00 1.54 0.00 0.00 36.73 38.26 2hgc h TYR 8 CO 0.00 1.08 0.20 0.00 -1.64 0.00 0.00 178.16 177.80 2hgc h ALA 9 N 0.74 0.58 -0.34 1.82 0.00 -1.05 -0.69 119.26 120.31 2hgc h ALA 9 Ca 0.05 0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.06 2hgc h ALA 9 Cb 0.91 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.63 2hgc h ALA 9 CO 0.08 -0.17 0.01 0.82 0.00 0.00 0.00 179.25 179.99 2hgc h ILE 10 N 0.40 0.76 -0.70 0.00 1.08 -1.43 0.14 117.51 117.76 2hgc h ILE 10 Ca 0.21 -0.04 0.07 0.00 -0.39 0.00 0.00 64.86 64.71 2hgc h ILE 10 Cb 0.17 0.64 -0.06 0.00 -3.07 0.00 0.00 36.82 34.50 2hgc h ILE 10 CO -0.18 0.02 0.39 -0.07 -0.69 0.00 0.00 178.15 177.61 2hgc h LEU 11 N 0.11 0.57 -0.28 1.44 3.38 -1.15 0.68 115.31 120.06 2hgc h LEU 11 Ca 0.17 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.14 2hgc h LEU 11 Cb 0.22 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2hgc h LEU 11 CO -0.27 0.36 0.04 0.50 0.09 0.00 0.00 178.44 179.16 2hgc h LYS 12 N 0.70 0.47 0.00 1.13 3.64 -0.22 -2.07 116.57 120.21 2hgc h LYS 12 Ca 0.32 -0.13 -0.07 0.00 -1.27 0.00 0.00 60.65 59.50 2hgc h LYS 12 Cb 0.22 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2hgc h LYS 12 CO -0.20 0.59 -0.32 0.93 -2.27 0.00 0.00 179.45 178.18 2hgc h GLU 13 N 0.28 0.00 -0.30 1.90 3.07 -0.34 0.29 114.58 119.47 2hgc h GLU 13 Ca 0.08 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.94 2hgc h GLU 13 Cb 0.35 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 2hgc h GLU 13 CO 0.01 0.32 0.16 0.82 -1.40 0.00 0.00 179.01 178.91 2hgc h ILE 14 N 0.00 1.14 -0.36 3.13 2.04 -0.62 0.12 117.51 122.96 2hgc h ILE 14 Ca -0.00 -0.39 -0.09 0.00 1.00 0.00 0.00 64.86 65.38 2hgc h ILE 14 Cb 0.57 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 2hgc h ILE 14 CO 0.04 0.14 -0.13 0.15 0.00 0.00 0.00 178.15 178.36 2hgc h PHE 15 N 0.36 0.83 -0.33 1.37 3.04 -0.58 -0.15 116.94 121.48 2hgc h PHE 15 Ca 0.10 -0.19 -0.17 0.00 3.98 0.00 0.00 57.97 61.69 2hgc h PHE 15 Cb 0.09 -0.20 -0.00 0.00 2.56 0.00 0.00 35.95 38.40 2hgc h PHE 15 CO -0.03 0.90 -0.47 0.93 -2.02 0.00 0.00 178.31 177.62 2hgc h GLU 16 N 0.52 0.91 0.00 1.11 4.39 -0.43 -3.22 114.58 117.86 2hgc h GLU 16 Ca 0.09 -0.53 -0.02 0.00 0.34 0.00 0.00 59.36 59.24 2hgc h GLU 16 Cb 0.65 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.35 2hgc h GLU 16 CO 0.04 1.18 -0.52 0.78 -1.16 0.00 0.00 179.01 179.33 2hgc h GLY 17 N 0.71 0.00 -0.84 -3.84 0.00 -0.76 -3.47 103.07 94.87 2hgc h GLY 17 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.03 2hgc h GLY 17 CO 0.11 0.00 -0.31 -2.01 0.00 0.00 0.00 176.54 174.33 2hgc n ASN 18 N -2.94 -4.95 -1.56 0.19 4.05 -0.07 -4.69 115.26 105.30 2hgc n ASN 18 Ca 0.01 0.38 0.01 0.00 0.45 0.00 0.00 54.58 55.44 2hgc n ASN 18 Cb 0.57 -3.89 -0.01 0.00 1.23 0.00 0.00 39.78 37.69 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 -2.59 -2.63 -2.60 -0.44 -2.24 -1.21 -4.59 114.28 97.98 2hgc n THR 19 Ca -0.16 1.35 -0.27 0.00 -2.27 0.00 0.00 64.05 62.69 2hgc n THR 19 Cb 0.54 -2.23 0.01 0.00 -2.10 0.00 0.00 70.33 66.54 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 -5.29 3.41 -0.10 -0.78 0.04 -0.89 -4.43 135.00 126.97 2hgc s PRO 20 Ca 0.00 0.14 -0.00 0.00 0.04 0.00 0.00 61.00 61.18 2hgc s PRO 20 Cb 0.00 -2.36 0.02 0.00 0.04 0.00 0.00 34.50 32.20 2hgc s PRO 20 CO 0.00 -0.30 -0.06 -0.48 0.04 0.00 0.00 177.00 176.20 2hgc s LEU 21 N -4.78 1.05 0.66 -3.56 2.34 -1.26 -5.02 118.68 108.11 2hgc s LEU 21 Ca 0.49 -0.23 -0.09 0.00 0.06 0.00 0.00 54.13 54.35 2hgc s LEU 21 Cb -0.10 -0.71 0.01 0.00 -0.56 0.00 0.00 46.19 44.83 2hgc s LEU 21 CO 0.45 -0.13 1.02 -0.44 -1.06 0.00 0.00 176.35 176.19 2hgc s SER 22 N 1.69 5.47 0.18 1.48 0.01 -1.26 -4.84 113.70 116.43 2hgc s SER 22 Ca 0.03 0.94 -0.13 0.00 1.31 0.00 0.00 55.95 58.10 2hgc s SER 22 Cb -0.13 -1.81 0.09 0.00 0.21 0.00 0.00 66.02 64.39 2hgc s SER 22 CO -0.06 -1.25 1.83 1.05 0.41 0.00 0.00 173.24 175.22 2hgc h GLU 23 N -0.47 0.68 0.00 12.44 9.09 -1.92 0.14 114.58 134.54 2hgc h GLU 23 Ca -0.45 -0.04 -0.02 0.00 0.05 0.00 0.00 59.36 58.90 2hgc h GLU 23 Cb 1.26 -0.15 -0.00 0.00 -1.65 0.00 0.00 28.75 28.20 2hgc h GLU 23 CO 0.63 0.45 -0.08 -0.91 0.05 0.00 0.00 179.01 179.15 2hgc h ASN 24 N 0.70 0.00 0.08 3.06 2.35 -1.94 0.13 115.58 119.96 2hgc h ASN 24 Ca 0.21 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.85 2hgc h ASN 24 Cb -0.03 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.35 2hgc h ASN 24 CO -0.07 0.08 -0.48 -0.78 -1.65 0.00 0.00 177.43 174.52 2hgc h ASP 25 N 0.00 0.28 -0.02 5.81 3.58 -1.59 -3.31 116.42 121.16 2hgc h ASP 25 Ca -0.00 -0.97 -0.17 0.00 0.42 0.00 0.00 57.03 56.30 2hgc h ASP 25 Cb 0.60 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.56 2hgc h ASP 25 CO 0.01 1.23 -0.58 -0.29 -2.88 0.00 0.00 179.24 176.73 2hgc h ILE 26 N -0.63 1.31 0.00 2.25 -0.00 -0.75 -3.47 117.51 116.22 2hgc h ILE 26 Ca -0.08 -1.83 0.00 0.00 -0.00 0.00 0.00 64.86 62.94 2hgc h ILE 26 Cb 1.38 1.79 0.00 0.00 -0.00 0.00 0.00 36.82 39.99 2hgc h ILE 26 CO 0.09 0.57 0.00 0.61 -0.00 0.00 0.00 178.15 179.42 2hgc n GLY 27 N 0.34 1.40 3.22 8.18 0.00 0.02 -5.10 105.19 113.25 2hgc n GLY 27 Ca -0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.86 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 0.00 0.68 1.61 -7.23 0.22 -5.01 120.40 108.67 2hgc s VAL 28 Ca 0.00 -1.98 -0.11 0.00 -1.81 0.00 0.00 61.98 58.08 2hgc s VAL 28 Cb 0.00 -2.49 -0.00 0.00 0.56 0.00 0.00 36.38 34.45 2hgc s VAL 28 CO 0.00 0.00 1.05 0.42 -0.31 0.00 0.00 175.10 176.26 2hgc s THR 29 N -4.14 4.15 0.13 5.32 -4.23 -1.26 -3.82 115.64 111.79 2hgc s THR 29 Ca 0.38 0.70 -0.19 0.00 -1.18 0.00 0.00 61.69 61.40 2hgc s THR 29 Cb 0.07 -3.53 -0.04 0.00 1.34 0.00 0.00 72.50 70.33 2hgc s THR 29 CO 0.12 -0.91 1.74 -0.33 -0.54 0.00 0.00 174.62 174.69 2hgc h GLU 30 N -0.62 0.12 -0.82 3.99 5.08 -1.98 -1.19 114.58 119.17 2hgc h GLU 30 Ca -0.44 -0.01 0.20 0.00 -1.00 0.00 0.00 59.36 58.11 2hgc h GLU 30 Cb 1.21 -0.03 -0.13 0.00 0.50 0.00 0.00 28.75 30.30 2hgc h GLU 30 CO 0.59 0.08 0.17 -0.44 -1.00 0.00 0.00 179.01 178.41 2hgc h ASP 31 N 0.12 -0.07 0.02 1.42 5.19 -1.99 0.90 116.42 122.02 2hgc h ASP 31 Ca 0.09 0.18 -0.23 0.00 -0.62 0.00 0.00 57.03 56.45 2hgc h ASP 31 Cb 0.09 0.26 0.01 0.00 0.18 0.00 0.00 39.33 39.87 2hgc h ASP 31 CO -0.13 -0.12 -0.89 1.56 -3.12 0.00 0.00 179.24 176.54 2hgc h GLN 32 N 0.21 0.66 -0.21 3.56 4.20 -1.86 -2.78 115.11 118.88 2hgc h GLN 32 Ca 0.48 -0.62 -0.02 0.00 0.06 0.00 0.00 58.65 58.55 2hgc h GLN 32 Cb 0.91 0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.84 2hgc h GLN 32 CO -0.62 1.23 0.04 0.35 -0.67 0.00 0.00 178.83 179.16 2hgc h PHE 33 N 0.42 0.37 0.09 2.96 3.57 0.48 0.16 116.94 124.98 2hgc h PHE 33 Ca -0.08 -0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.39 2hgc h PHE 33 Cb 1.52 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 40.11 2hgc h PHE 33 CO 0.08 0.47 -0.38 -0.44 -2.23 0.00 0.00 178.31 175.82 2hgc h ASP 34 N 0.16 -1.12 -0.31 0.41 5.19 0.61 -0.77 116.42 120.59 2hgc h ASP 34 Ca 0.07 0.13 -0.03 0.00 -0.62 0.00 0.00 57.03 56.57 2hgc h ASP 34 Cb 0.30 0.43 -0.02 0.00 0.18 0.00 0.00 39.33 40.22 2hgc h ASP 34 CO 0.00 -0.45 0.10 -0.78 -3.12 0.00 0.00 179.24 174.99 2hgc h ASP 35 N -0.59 0.51 0.27 6.45 3.58 -1.42 -1.86 116.42 123.36 2hgc h ASP 35 Ca 0.03 -0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.40 2hgc h ASP 35 Cb 0.64 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.56 2hgc h ASP 35 CO -0.24 0.51 -0.13 0.00 -2.88 0.00 0.00 179.24 176.50 2hgc h ALA 36 N 1.56 -0.37 -0.67 -0.78 0.00 -0.10 0.02 119.26 118.93 2hgc h ALA 36 Ca 0.13 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2hgc h ALA 36 Cb 0.20 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2hgc h ALA 36 CO -0.00 -0.70 0.16 0.28 0.00 0.00 0.00 179.25 178.98 2hgc h VAL 37 N -0.38 1.26 -0.65 0.00 2.07 -0.91 -0.27 116.25 117.38 2hgc h VAL 37 Ca -0.04 -0.97 -0.04 0.00 0.82 0.00 0.00 66.70 66.48 2hgc h VAL 37 Cb 0.29 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 2hgc h VAL 37 CO 0.06 0.37 0.25 0.78 0.02 0.00 0.00 177.57 179.05 2hgc h ASN 38 N 1.01 0.90 -0.12 0.57 2.35 -1.25 -1.16 115.58 117.88 2hgc h ASN 38 Ca 0.21 -0.18 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 2hgc h ASN 38 Cb 0.38 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 2hgc h ASN 38 CO 0.00 0.84 0.03 0.15 -1.65 0.00 0.00 177.43 176.80 2hgc h PHE 39 N 0.91 0.20 -0.54 1.19 3.57 -0.64 -1.43 116.94 120.21 2hgc h PHE 39 Ca 0.21 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 2hgc h PHE 39 Cb 0.22 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 2hgc h PHE 39 CO 0.01 0.34 0.24 -0.07 -2.23 0.00 0.00 178.31 176.61 2hgc h LEU 40 N 0.00 0.69 -0.46 0.59 3.38 -0.89 -0.57 115.31 118.05 2hgc h LEU 40 Ca 0.04 -0.07 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 2hgc h LEU 40 Cb 0.24 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2hgc h LEU 40 CO -0.00 0.60 -0.68 0.50 0.09 0.00 0.00 178.44 178.95 2hgc h LYS 41 N 0.76 0.00 0.07 1.13 3.11 -1.10 0.32 116.57 120.86 2hgc h LYS 41 Ca 0.19 0.00 -0.18 0.00 -2.81 0.00 0.00 60.65 57.85 2hgc h LYS 41 Cb 0.10 0.00 0.02 0.00 -1.00 0.00 0.00 32.23 31.35 2hgc h LYS 41 CO -0.02 0.68 -0.74 -0.09 -2.81 0.00 0.00 179.45 176.46 2hgc h ARG 42 N 0.00 0.39 0.00 1.90 2.43 -0.36 -3.19 114.38 115.54 2hgc h ARG 42 Ca -0.01 -0.51 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 2hgc h ARG 42 Cb 1.31 0.16 0.00 0.00 -0.42 0.00 0.00 29.97 31.02 2hgc h ARG 42 CO 0.09 1.18 0.00 0.39 -1.51 0.00 0.00 179.97 180.12 2hgc n GLU 43 N -4.14 0.15 -1.68 0.20 -0.58 -0.31 -4.93 120.64 109.36 2hgc n GLU 43 Ca -0.12 0.22 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 2hgc n GLU 43 Cb 0.76 -1.71 0.00 0.00 -0.57 0.00 0.00 31.44 29.92 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 0.86 0.53 0.13 0.62 0.00 -0.90 -5.00 105.19 101.42 2hgc n GLY 44 Ca 0.05 -0.41 -0.18 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.96 0.23 -4.00 1.61 4.01 0.11 -4.29 117.16 113.87 2hgc n TYR 45 Ca 0.00 0.05 -0.10 0.00 -0.16 0.00 0.00 57.90 57.69 2hgc n TYR 45 Cb 0.44 -1.03 -0.11 0.00 -0.31 0.00 0.00 39.34 38.32 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 -2.53 0.23 0.25 -0.72 -5.25 -1.19 -1.05 121.20 110.94 2hgc s ILE 46 Ca -0.31 -0.91 0.02 0.00 -0.99 0.00 0.00 60.65 58.46 2hgc s ILE 46 Cb 0.08 -0.35 -0.05 0.00 2.95 0.00 0.00 42.46 45.09 2hgc s ILE 46 CO 0.65 -0.43 0.07 0.27 -1.79 0.00 0.00 174.94 173.71 2hgc s ILE 47 N -1.35 0.64 0.00 8.37 -0.00 0.56 -4.21 121.20 125.21 2hgc s ILE 47 Ca -0.13 -2.00 0.00 0.00 -0.00 0.00 0.00 60.65 58.52 2hgc s ILE 47 Cb -0.09 -2.55 0.00 0.00 -0.00 0.00 0.00 42.46 39.82 2hgc s ILE 47 CO -0.01 -0.10 0.00 0.61 -0.00 0.00 0.00 174.94 175.45 2hgc n GLY 48 N -0.44 0.80 3.70 6.27 0.00 -1.26 0.16 105.19 114.42 2hgc n GLY 48 Ca -0.01 -0.62 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 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 4.76 -0.20 1.61 1.01 -1.26 -3.79 120.40 120.53 2hgc s VAL 49 Ca 0.00 2.00 -0.15 0.00 0.00 0.00 0.00 61.98 63.82 2hgc s VAL 49 Cb 0.00 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 2hgc s VAL 49 CO 0.00 0.10 0.37 -1.00 0.00 0.00 0.00 175.10 174.57 2hgc s HIS 50 N 1.40 3.39 -0.01 5.22 3.76 -1.24 -4.99 115.29 122.81 2hgc s HIS 50 Ca 0.51 0.60 -0.03 0.00 -0.15 0.00 0.00 55.06 55.99 2hgc s HIS 50 Cb -0.21 -2.49 -0.04 0.00 1.11 0.00 0.00 32.58 30.96 2hgc s HIS 50 CO 0.24 0.03 0.17 0.71 -0.85 0.00 0.00 174.74 175.04 2hgc s TYR 51 N 1.16 3.52 0.00 1.40 1.51 -1.26 -0.47 117.35 123.21 2hgc s TYR 51 Ca 0.18 0.34 0.00 0.00 -1.01 0.00 0.00 57.07 56.59 2hgc s TYR 51 Cb -0.14 -1.82 0.00 0.00 -0.11 0.00 0.00 41.96 39.88 2hgc s TYR 51 CO 0.07 0.64 0.00 0.45 -1.11 0.00 0.00 175.55 175.60 2hgc n SER 52 N 1.02 0.00 -0.28 2.29 2.88 0.77 -4.91 113.62 115.39 2hgc n SER 52 Ca -0.12 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.35 2hgc n SER 52 Cb 0.53 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.95 2hgc n SER 52 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 2hgc h ASP 53 N 0.00 -1.65 0.00 -3.46 3.58 -2.00 -3.39 116.42 109.51 2hgc h ASP 53 Ca 0.00 0.28 0.00 0.00 0.42 0.00 0.00 57.03 57.73 2hgc h ASP 53 Cb 0.00 0.76 0.00 0.00 1.72 0.00 0.00 39.33 41.81 2hgc h ASP 53 CO 0.00 -0.31 0.00 -0.67 -2.88 0.00 0.00 179.24 175.38 2hgc n ASP 54 N -5.39 0.00 -4.77 2.28 2.03 -1.26 -5.12 116.55 104.33 2hgc n ASP 54 Ca 0.03 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 55.03 2hgc n ASP 54 Cb 0.34 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.67 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 2.92 0.59 -0.67 0.52 -1.26 -5.09 118.95 115.96 2hgc s ARG 55 Ca 0.00 -0.63 -0.17 0.00 -0.52 0.00 0.00 55.73 54.41 2hgc s ARG 55 Cb 0.00 -2.76 -0.04 0.00 0.52 0.00 0.00 34.95 32.68 2hgc s ARG 55 CO 0.00 0.59 1.08 -1.25 0.02 0.00 0.00 175.30 175.75 2hgc s PRO 56 N -2.15 3.23 -0.03 3.54 0.04 -1.26 -0.17 135.00 138.19 2hgc s PRO 56 Ca 0.27 1.36 -0.05 0.00 0.04 0.00 0.00 61.00 62.61 2hgc s PRO 56 Cb -0.12 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.42 2hgc s PRO 56 CO 0.19 -0.90 0.13 -1.01 0.04 0.00 0.00 177.00 175.45 2hgc s HIS 57 N -2.23 -0.08 -0.09 0.56 3.76 0.38 -4.81 115.29 112.78 2hgc s HIS 57 Ca 0.67 0.19 0.01 0.00 -0.15 0.00 0.00 55.06 55.78 2hgc s HIS 57 Cb -0.19 0.01 -0.02 0.00 1.11 0.00 0.00 32.58 33.49 2hgc s HIS 57 CO 0.34 -0.14 -0.10 -0.51 -0.85 0.00 0.00 174.74 173.48 2hgc s LEU 58 N -0.42 2.94 0.00 0.89 1.43 -1.26 -3.64 118.68 118.62 2hgc s LEU 58 Ca -0.05 -0.15 0.00 0.00 -1.03 0.00 0.00 54.13 52.89 2hgc s LEU 58 Cb -0.03 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.55 2hgc s LEU 58 CO 0.01 0.29 0.00 -1.22 0.23 0.00 0.00 176.35 175.66 2hgc n TYR 59 N 2.68 -1.55 0.59 0.29 4.02 -1.26 -4.70 117.16 117.24 2hgc n TYR 59 Ca -0.18 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 57.84 2hgc n TYR 59 Cb 0.53 0.00 0.45 0.00 -0.02 0.00 0.00 39.34 40.30 2hgc n TYR 59 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2hgc n LYS 60 N -0.52 0.18 -3.48 -0.72 5.02 -1.26 -2.09 118.16 115.29 2hgc n LYS 60 Ca 0.00 0.26 -0.11 0.00 -2.02 0.00 0.00 58.31 56.44 2hgc n LYS 60 Cb 0.00 -1.76 -0.02 0.00 -0.02 0.00 0.00 35.03 33.23 2hgc n LYS 60 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 2hgc s LEU 61 N -4.17 -0.49 0.00 -0.35 -0.00 -1.26 -4.55 118.68 107.85 2hgc s LEU 61 Ca 0.09 -0.06 0.00 0.00 -0.00 0.00 0.00 54.13 54.15 2hgc s LEU 61 Cb 0.12 2.49 0.00 0.00 -0.00 0.00 0.00 46.19 48.80 2hgc s LEU 61 CO 0.49 -0.93 0.00 0.61 -0.00 0.00 0.00 176.35 176.52 2hgc n GLY 62 N -0.36 3.04 3.77 -3.48 0.00 -1.26 -5.08 105.19 101.82 2hgc n GLY 62 Ca -0.14 -0.53 -0.40 0.00 0.00 0.00 0.00 46.02 44.95 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 4.03 0.14 1.61 0.04 -1.25 -4.76 135.00 134.82 2hgc s PRO 63 Ca 0.00 2.24 0.11 0.00 0.04 0.00 0.00 61.00 63.38 2hgc s PRO 63 Cb 0.00 -2.83 -0.04 0.00 0.04 0.00 0.00 34.50 31.67 2hgc s PRO 63 CO 0.00 -0.47 -0.26 -1.21 0.04 0.00 0.00 177.00 175.11 2hgc s GLU 64 N -2.15 1.40 0.02 4.56 0.41 0.12 -4.97 118.70 118.08 2hgc s GLU 64 Ca 0.55 -1.37 -0.07 0.00 -0.41 0.00 0.00 54.97 53.67 2hgc s GLU 64 Cb -0.40 -1.84 -0.05 0.00 -1.78 0.00 0.00 34.13 30.07 2hgc s GLU 64 CO 0.52 0.43 0.29 -0.51 -0.49 0.00 0.00 175.26 175.49 2hgc s LEU 65 N -2.18 4.37 0.92 1.80 1.02 -1.26 -0.32 118.68 123.02 2hgc s LEU 65 Ca 0.15 0.60 -0.12 0.00 0.02 0.00 0.00 54.13 54.77 2hgc s LEU 65 Cb -0.09 -2.73 0.20 0.00 0.02 0.00 0.00 46.19 43.59 2hgc s LEU 65 CO 0.07 0.24 1.26 0.42 0.02 0.00 0.00 176.35 178.36 2hgc s THR 66 N -1.32 2.01 0.18 5.49 -4.23 -0.22 -4.79 115.64 112.77 2hgc s THR 66 Ca 0.28 -0.17 -0.11 0.00 -1.18 0.00 0.00 61.69 60.51 2hgc s THR 66 Cb -0.13 -2.84 0.10 0.00 1.34 0.00 0.00 72.50 70.97 2hgc s THR 66 CO 0.16 0.00 1.78 -0.08 -0.54 0.00 0.00 174.62 175.95 2hgc h GLU 67 N -1.44 0.92 -0.10 3.99 4.57 -1.88 -0.17 114.58 120.47 2hgc h GLU 67 Ca -0.41 -0.13 0.00 0.00 -1.18 0.00 0.00 59.36 57.64 2hgc h GLU 67 Cb 1.23 -0.17 -0.00 0.00 -0.16 0.00 0.00 28.75 29.64 2hgc h GLU 67 CO 0.34 0.72 0.06 -0.22 -1.18 0.00 0.00 179.01 178.73 2hgc h LYS 68 N 0.89 0.13 -0.12 1.92 3.64 -1.89 -1.41 116.57 119.71 2hgc h LYS 68 Ca 0.22 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.57 2hgc h LYS 68 Cb 0.09 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2hgc h LYS 68 CO -0.03 0.09 -0.01 0.78 -2.27 0.00 0.00 179.45 178.01 2hgc h GLY 69 N 0.13 0.24 1.44 5.01 0.00 -1.62 0.80 103.07 109.07 2hgc h GLY 69 Ca 0.04 -0.19 -0.05 0.00 0.00 0.00 0.00 47.33 47.13 2hgc h GLY 69 CO -0.01 0.17 0.07 -2.09 0.00 0.00 0.00 176.54 174.69 2hgc h GLU 70 N -0.06 0.70 0.05 4.80 4.57 -1.02 -1.96 114.58 121.65 2hgc h GLU 70 Ca 0.03 -0.15 -0.24 0.00 -1.18 0.00 0.00 59.36 57.83 2hgc h GLU 70 Cb 0.39 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 2hgc h GLU 70 CO 0.01 0.67 -1.05 -0.91 -1.18 0.00 0.00 179.01 176.55 2hgc h ASN 71 N 0.68 0.48 -0.93 1.04 2.35 -1.21 -3.25 115.58 114.73 2hgc h ASN 71 Ca 0.15 -0.42 0.03 0.00 -0.55 0.00 0.00 56.30 55.51 2hgc h ASN 71 Cb 0.31 -0.15 -0.05 0.00 0.05 0.00 0.00 38.32 38.48 2hgc h ASN 71 CO 0.00 1.26 0.61 0.22 -1.65 0.00 0.00 177.43 177.87 2hgc h TYR 72 N 0.16 1.13 -0.39 1.19 3.20 -0.31 -0.30 116.97 121.65 2hgc h TYR 72 Ca -0.10 0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.83 2hgc h TYR 72 Cb 1.71 -0.38 -0.03 0.00 1.54 0.00 0.00 36.73 39.57 2hgc h TYR 72 CO 0.06 0.67 0.18 -0.07 -1.64 0.00 0.00 178.16 177.35 2hgc h LEU 73 N 1.18 0.25 -0.30 2.82 3.38 -1.41 0.38 115.31 121.61 2hgc h LEU 73 Ca 0.36 0.03 -0.19 0.00 0.09 0.00 0.00 57.88 58.17 2hgc h LEU 73 Cb -0.01 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2hgc h LEU 73 CO -0.11 0.18 -0.55 0.11 0.09 0.00 0.00 178.44 178.17 2hgc h LYS 74 N 0.37 0.88 -0.14 1.13 1.57 -1.34 0.22 116.57 119.26 2hgc h LYS 74 Ca 0.17 -0.56 -0.22 0.00 -1.87 0.00 0.00 60.65 58.17 2hgc h LYS 74 Cb 0.09 0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.48 2hgc h LYS 74 CO -0.13 1.20 -0.77 0.93 -0.57 0.00 0.00 179.45 180.10 2hgc h GLU 75 N 0.67 0.73 -0.28 3.15 5.08 -1.00 -3.08 114.58 119.86 2hgc h GLU 75 Ca 0.01 -0.59 0.00 0.00 -1.00 0.00 0.00 59.36 57.78 2hgc h GLU 75 Cb 1.16 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2hgc h GLU 75 CO 0.12 1.21 0.00 -1.71 -1.00 0.00 0.00 179.01 177.63 2hgc n ASN 76 N -3.92 2.27 0.08 1.42 5.15 0.11 -4.35 115.26 116.02 2hgc n ASN 76 Ca -0.07 -1.84 0.03 0.00 -0.60 0.00 0.00 54.58 52.10 2hgc n ASN 76 Cb 0.74 -0.18 0.18 0.00 -0.53 0.00 0.00 39.78 40.00 2hgc n ASN 76 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2hgc n GLY 77 N 1.24 -0.48 0.00 8.20 0.00 0.78 -3.45 105.19 111.49 2hgc n GLY 77 Ca 0.17 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.68 0.00 -2.92 2.61 5.66 -1.26 -4.97 114.28 111.72 2hgc n THR 78 Ca -0.00 0.07 0.00 0.00 -3.05 0.00 0.00 64.05 61.07 2hgc n THR 78 Cb 0.23 -0.40 0.00 0.00 -1.55 0.00 0.00 70.33 68.61 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 -0.13 -1.73 1.09 -0.00 -1.22 -4.80 117.44 110.65 2hgc n TRP 79 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.50 57.38 2hgc n TRP 79 Cb 0.00 0.07 -0.03 0.00 -0.00 0.00 0.00 31.31 31.35 2hgc n TRP 79 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 177.69 176.56 2hgc n SER 80 N -3.42 -3.33 -3.94 5.87 3.41 -1.26 -4.83 113.62 106.13 2hgc n SER 80 Ca 0.00 0.26 -0.42 0.00 -0.26 0.00 0.00 58.87 58.45 2hgc n SER 80 Cb 0.00 -3.04 0.00 0.00 -0.26 0.00 0.00 64.21 60.91 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 -2.13 3.03 0.00 4.33 5.02 -1.26 -5.32 118.16 121.82 2hgc n LYS 81 Ca -0.13 -2.88 0.12 0.00 -2.02 0.00 0.00 58.31 53.40 2hgc n LYS 81 Cb 0.46 -3.28 0.18 0.00 -0.02 0.00 0.00 35.03 32.37 2hgc n LYS 81 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88