#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 0.03 -0.98 -0.35 -0.00 -2.01 -2.78 115.31 109.22 2hgc h LEU 6 Ca 0.00 -0.03 0.08 0.00 -0.00 0.00 0.00 57.88 57.93 2hgc h LEU 6 Cb 0.00 -0.01 -0.07 0.00 -0.00 0.00 0.00 40.66 40.58 2hgc h LEU 6 CO 0.00 0.83 0.62 -0.09 -0.00 0.00 0.00 178.44 179.80 2hgc h ARG 7 N 0.01 1.06 -0.18 1.13 9.65 -1.97 0.38 114.38 124.46 2hgc h ARG 7 Ca -0.01 -0.06 -0.17 0.00 -1.10 0.00 0.00 59.98 58.64 2hgc h ARG 7 Cb 1.42 -0.24 0.00 0.00 -1.39 0.00 0.00 29.97 29.77 2hgc h ARG 7 CO 0.11 0.70 -0.54 -0.92 2.80 0.00 0.00 179.97 182.12 2hgc h TYR 8 N 1.09 0.88 -0.75 2.20 3.20 -1.93 -3.13 116.97 118.54 2hgc h TYR 8 Ca 0.44 -0.35 0.01 0.00 3.14 0.00 0.00 58.73 61.97 2hgc h TYR 8 Cb 0.25 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.33 2hgc h TYR 8 CO -0.01 1.15 0.49 0.00 -1.64 0.00 0.00 178.16 178.15 2hgc h ALA 9 N 0.56 0.95 0.28 1.82 0.00 -1.04 -0.35 119.26 121.49 2hgc h ALA 9 Ca -0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2hgc h ALA 9 Cb 1.16 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2hgc h ALA 9 CO 0.12 0.34 -0.13 0.82 0.00 0.00 0.00 179.25 180.40 2hgc h ILE 10 N 0.99 0.73 -0.66 0.00 1.08 -1.03 -1.39 117.51 117.24 2hgc h ILE 10 Ca 0.28 -0.05 0.02 0.00 -0.39 0.00 0.00 64.86 64.73 2hgc h ILE 10 Cb -0.09 0.76 -0.04 0.00 -3.07 0.00 0.00 36.82 34.38 2hgc h ILE 10 CO -0.07 0.01 0.42 -0.07 -0.69 0.00 0.00 178.15 177.75 2hgc h LEU 11 N -0.40 0.69 -0.43 1.44 3.38 -1.42 -0.25 115.31 118.32 2hgc h LEU 11 Ca -0.04 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2hgc h LEU 11 Cb 0.30 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2hgc h LEU 11 CO 0.06 0.48 0.18 0.50 0.09 0.00 0.00 178.44 179.75 2hgc h LYS 12 N 0.82 0.65 -0.05 1.13 3.64 -0.95 -0.87 116.57 120.94 2hgc h LYS 12 Ca 0.26 -0.12 -0.07 0.00 -1.27 0.00 0.00 60.65 59.45 2hgc h LYS 12 Cb -0.00 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 2hgc h LYS 12 CO -0.10 0.60 -0.30 0.93 -2.27 0.00 0.00 179.45 178.31 2hgc h GLU 13 N 0.56 0.09 -0.30 1.90 4.39 -0.85 -2.32 114.58 118.05 2hgc h GLU 13 Ca 0.15 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.77 2hgc h GLU 13 Cb 0.19 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 2hgc h GLU 13 CO -0.01 0.39 0.02 0.82 -1.16 0.00 0.00 179.01 179.06 2hgc h ILE 14 N 0.08 1.25 0.02 3.13 2.04 -0.54 0.98 117.51 124.47 2hgc h ILE 14 Ca 0.01 -0.90 -0.00 0.00 1.00 0.00 0.00 64.86 64.97 2hgc h ILE 14 Cb 0.58 1.24 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 2hgc h ILE 14 CO 0.04 0.29 -0.01 0.15 0.00 0.00 0.00 178.15 178.62 2hgc h PHE 15 N 0.33 -0.02 0.00 1.37 3.57 -0.72 0.20 116.94 121.67 2hgc h PHE 15 Ca 0.09 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2hgc h PHE 15 Cb 0.41 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.15 2hgc h PHE 15 CO 0.03 0.13 -0.67 1.05 -2.23 0.00 0.00 178.31 176.63 2hgc h GLU 16 N -0.17 0.00 0.00 1.11 4.11 -1.52 -3.32 114.58 114.78 2hgc h GLU 16 Ca -0.00 0.00 -0.22 0.00 0.07 0.00 0.00 59.36 59.21 2hgc h GLU 16 Cb 0.16 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 2hgc h GLU 16 CO 0.00 0.00 -1.43 0.78 0.07 0.00 0.00 179.01 178.43 2hgc h GLY 17 N 4.27 0.00 -0.08 1.06 0.00 -0.69 -3.48 103.07 104.15 2hgc h GLY 17 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2hgc h GLY 17 CO 0.00 0.00 -0.03 -2.01 0.00 0.00 0.00 176.54 174.50 2hgc n ASN 18 N -3.01 -4.68 -1.24 0.19 5.15 0.69 -4.76 115.26 107.59 2hgc n ASN 18 Ca -0.11 0.04 0.14 0.00 -0.60 0.00 0.00 54.58 54.05 2hgc n ASN 18 Cb 0.92 -2.34 -0.07 0.00 -0.53 0.00 0.00 39.78 37.77 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 -2.46 -0.55 -2.21 -0.44 -2.24 -1.25 -4.84 114.28 100.29 2hgc n THR 19 Ca -0.02 0.65 -0.32 0.00 -2.27 0.00 0.00 64.05 62.10 2hgc n THR 19 Cb 0.30 -1.03 -0.02 0.00 -2.10 0.00 0.00 70.33 67.49 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 -4.18 3.80 -0.07 -0.78 0.04 -1.26 -4.63 135.00 127.92 2hgc s PRO 20 Ca 0.00 0.91 0.04 0.00 0.04 0.00 0.00 61.00 61.99 2hgc s PRO 20 Cb 0.00 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.43 2hgc s PRO 20 CO 0.00 -0.40 -0.18 -0.48 0.04 0.00 0.00 177.00 175.98 2hgc s LEU 21 N -4.44 1.90 0.58 -3.56 2.34 -1.26 -5.08 118.68 109.17 2hgc s LEU 21 Ca 0.58 -0.41 -0.07 0.00 0.06 0.00 0.00 54.13 54.29 2hgc s LEU 21 Cb -0.11 -1.09 -0.01 0.00 -0.56 0.00 0.00 46.19 44.43 2hgc s LEU 21 CO 0.38 0.13 0.91 -0.44 -1.06 0.00 0.00 176.35 176.28 2hgc s SER 22 N 0.26 5.83 0.37 1.48 0.01 -1.26 -4.97 113.70 115.42 2hgc s SER 22 Ca -0.11 0.91 0.08 0.00 1.31 0.00 0.00 55.95 58.14 2hgc s SER 22 Cb -0.15 -1.97 0.71 0.00 0.21 0.00 0.00 66.02 64.82 2hgc s SER 22 CO 0.05 -0.95 1.90 1.05 0.41 0.00 0.00 173.24 175.69 2hgc h GLU 23 N -0.15 0.34 -0.29 12.44 -0.00 -1.93 -1.61 114.58 123.39 2hgc h GLU 23 Ca -0.46 -0.08 -0.07 0.00 -0.00 0.00 0.00 59.36 58.76 2hgc h GLU 23 Cb 1.23 -0.05 -0.02 0.00 -0.00 0.00 0.00 28.75 29.92 2hgc h GLU 23 CO 0.61 0.45 -0.12 -0.91 -0.00 0.00 0.00 179.01 179.04 2hgc h ASN 24 N 0.33 0.48 -0.30 3.06 2.35 -1.94 0.28 115.58 119.83 2hgc h ASN 24 Ca 0.07 -0.12 -0.09 0.00 -0.55 0.00 0.00 56.30 55.61 2hgc h ASN 24 Cb 0.37 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 2hgc h ASN 24 CO 0.02 0.63 -0.15 0.44 -1.65 0.00 0.00 177.43 176.73 2hgc h ASP 25 N 0.46 0.65 1.16 5.81 3.32 -1.67 -3.05 116.42 123.11 2hgc h ASP 25 Ca 0.08 -0.41 -0.15 0.00 0.02 0.00 0.00 57.03 56.58 2hgc h ASP 25 Cb 0.49 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 2hgc h ASP 25 CO 0.03 0.92 -0.70 -0.29 -1.72 0.00 0.00 179.24 177.47 2hgc h ILE 26 N 0.39 1.26 -0.02 0.35 -0.00 -1.35 -3.48 117.51 114.65 2hgc h ILE 26 Ca 0.07 -2.65 0.00 0.00 -0.00 0.00 0.00 64.86 62.28 2hgc h ILE 26 Cb 0.67 2.53 0.00 0.00 -0.00 0.00 0.00 36.82 40.02 2hgc h ILE 26 CO 0.04 0.69 0.00 0.61 -0.00 0.00 0.00 178.15 179.49 2hgc n GLY 27 N 1.11 1.55 3.37 8.18 0.00 0.78 -5.04 105.19 115.14 2hgc n GLY 27 Ca 0.01 -0.04 -0.20 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.02 0.35 0.49 1.61 -7.23 -0.04 -5.01 120.40 108.55 2hgc s VAL 28 Ca 0.00 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.06 2hgc s VAL 28 Cb 0.00 -2.48 -0.06 0.00 0.56 0.00 0.00 36.38 34.41 2hgc s VAL 28 CO 0.00 0.00 0.87 0.42 -0.31 0.00 0.00 175.10 176.08 2hgc s THR 29 N -3.49 4.75 0.22 5.32 -4.23 -1.26 -4.03 115.64 112.91 2hgc s THR 29 Ca 0.34 0.70 0.33 0.00 -1.18 0.00 0.00 61.69 61.88 2hgc s THR 29 Cb 0.04 -3.79 0.36 0.00 1.34 0.00 0.00 72.50 70.46 2hgc s THR 29 CO 0.18 -0.76 2.02 1.05 -0.54 0.00 0.00 174.62 176.58 2hgc h GLU 30 N 0.64 0.00 -0.29 3.99 -0.00 -1.98 0.33 114.58 117.26 2hgc h GLU 30 Ca -0.46 0.00 -0.06 0.00 -0.00 0.00 0.00 59.36 58.84 2hgc h GLU 30 Cb 1.19 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.93 2hgc h GLU 30 CO 0.62 0.05 -0.05 0.22 -0.00 0.00 0.00 179.01 179.86 2hgc h ASP 31 N 0.00 0.55 0.41 3.06 3.58 -1.99 0.05 116.42 122.08 2hgc h ASP 31 Ca -0.00 -0.35 -0.08 0.00 0.42 0.00 0.00 57.03 57.02 2hgc h ASP 31 Cb 0.46 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.35 2hgc h ASP 31 CO 0.01 0.77 -0.40 1.56 -2.88 0.00 0.00 179.24 178.30 2hgc h GLN 32 N 0.32 0.00 -0.09 0.28 4.20 -1.73 -1.12 115.11 116.97 2hgc h GLN 32 Ca 0.08 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 2hgc h GLN 32 Cb 0.51 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.29 2hgc h GLN 32 CO 0.02 0.40 0.02 0.35 -0.67 0.00 0.00 178.83 178.95 2hgc h PHE 33 N 0.00 0.15 0.00 2.96 3.57 -0.65 0.11 116.94 123.08 2hgc h PHE 33 Ca -0.00 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.51 2hgc h PHE 33 Cb 0.71 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.36 2hgc h PHE 33 CO 0.00 0.32 -0.23 -0.44 -2.23 0.00 0.00 178.31 175.73 2hgc h ASP 34 N -0.07 -0.67 -0.50 0.41 3.32 -0.77 -1.10 116.42 117.03 2hgc h ASP 34 Ca 0.03 0.09 0.10 0.00 0.02 0.00 0.00 57.03 57.27 2hgc h ASP 34 Cb 0.25 0.28 -0.09 0.00 0.22 0.00 0.00 39.33 39.98 2hgc h ASP 34 CO 0.00 -0.30 -0.09 -0.78 -1.72 0.00 0.00 179.24 176.35 2hgc h ASP 35 N -0.36 -0.40 0.41 6.45 3.58 -1.07 -0.63 116.42 124.40 2hgc h ASP 35 Ca 0.06 0.14 -0.02 0.00 0.42 0.00 0.00 57.03 57.63 2hgc h ASP 35 Cb 0.44 0.29 0.00 0.00 1.72 0.00 0.00 39.33 41.78 2hgc h ASP 35 CO -0.21 -0.14 -0.19 0.00 -2.88 0.00 0.00 179.24 175.82 2hgc h ALA 36 N 1.49 -0.55 -0.76 -0.78 0.00 -0.48 -2.21 119.26 115.97 2hgc h ALA 36 Ca 0.25 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2hgc h ALA 36 Cb 0.38 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 2hgc h ALA 36 CO -0.49 -0.76 0.38 0.28 0.00 0.00 0.00 179.25 178.66 2hgc h VAL 37 N -0.64 1.24 -0.06 0.00 2.07 -0.96 0.14 116.25 118.04 2hgc h VAL 37 Ca -0.06 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 2hgc h VAL 37 Cb 0.47 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 2hgc h VAL 37 CO 0.09 0.28 0.03 0.78 0.02 0.00 0.00 177.57 178.77 2hgc h ASN 38 N 1.07 0.07 -0.57 0.57 2.35 -1.08 -1.01 115.58 116.99 2hgc h ASN 38 Ca 0.26 -0.04 -0.07 0.00 -0.55 0.00 0.00 56.30 55.91 2hgc h ASN 38 Cb 0.08 -0.02 -0.03 0.00 0.05 0.00 0.00 38.32 38.41 2hgc h ASN 38 CO -0.04 0.09 0.10 0.15 -1.65 0.00 0.00 177.43 176.09 2hgc h PHE 39 N 0.04 1.02 -0.73 1.19 3.57 -0.85 -1.37 116.94 119.80 2hgc h PHE 39 Ca 0.02 -0.12 -0.01 0.00 3.53 0.00 0.00 57.97 61.39 2hgc h PHE 39 Cb 0.03 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 38.45 2hgc h PHE 39 CO -0.06 0.86 0.43 -0.07 -2.23 0.00 0.00 178.31 177.24 2hgc h LEU 40 N 0.92 0.89 -0.27 0.59 3.38 -0.48 -1.33 115.31 119.00 2hgc h LEU 40 Ca 0.19 -0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.93 2hgc h LEU 40 Cb 0.39 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2hgc h LEU 40 CO 0.01 0.69 -0.52 0.50 0.09 0.00 0.00 178.44 179.22 2hgc h LYS 41 N 1.01 0.82 -0.26 1.13 3.11 -0.72 0.37 116.57 122.04 2hgc h LYS 41 Ca 0.26 -0.53 -0.00 0.00 -2.81 0.00 0.00 60.65 57.58 2hgc h LYS 41 Cb -0.02 0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.27 2hgc h LYS 41 CO -0.05 1.16 0.16 0.00 -2.81 0.00 0.00 179.45 177.91 2hgc h ARG 42 N 0.58 0.35 -0.04 1.90 3.08 -0.78 -1.89 114.38 117.58 2hgc h ARG 42 Ca 0.01 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2hgc h ARG 42 Cb 1.12 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.10 2hgc h ARG 42 CO 0.12 0.27 0.00 0.39 -1.07 0.00 0.00 179.97 179.68 2hgc n GLU 43 N -4.88 1.17 -3.33 0.04 -0.58 -0.55 -4.91 120.64 107.61 2hgc n GLU 43 Ca -0.02 -0.26 -0.17 0.00 -0.42 0.00 0.00 57.16 56.28 2hgc n GLU 43 Cb 0.05 -1.29 0.08 0.00 -0.57 0.00 0.00 31.44 29.70 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 0.85 -0.30 0.12 0.62 0.00 -0.71 -4.89 105.19 100.88 2hgc n GLY 44 Ca 0.13 0.07 -0.19 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.93 0.46 -3.98 1.61 0.05 -0.52 -3.37 116.97 109.29 2hgc h TYR 45 Ca -0.51 -0.33 -0.20 0.00 0.05 0.00 0.00 58.73 57.73 2hgc h TYR 45 Cb 1.31 -0.02 -0.21 0.00 1.01 0.00 0.00 36.73 38.82 2hgc h TYR 45 CO 0.41 1.54 -0.71 0.96 -1.05 0.00 0.00 178.16 179.30 2hgc s ILE 46 N -2.58 0.26 0.32 -2.88 -5.25 -1.23 -1.23 121.20 108.60 2hgc s ILE 46 Ca -0.15 -1.00 0.03 0.00 -0.99 0.00 0.00 60.65 58.55 2hgc s ILE 46 Cb 0.07 -0.42 -0.04 0.00 2.95 0.00 0.00 42.46 45.02 2hgc s ILE 46 CO 0.82 -0.48 0.13 0.27 -1.79 0.00 0.00 174.94 173.89 2hgc s ILE 47 N -1.52 0.55 0.00 8.37 -0.00 0.06 -4.53 121.20 124.13 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 -2.54 0.00 0.00 -0.00 0.00 0.00 42.46 39.82 2hgc s ILE 47 CO -0.01 0.00 0.00 0.61 -0.00 0.00 0.00 174.94 175.54 2hgc n GLY 48 N -0.64 0.72 3.68 6.27 0.00 -1.26 -0.40 105.19 113.56 2hgc n GLY 48 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.08 4.74 -0.41 1.61 1.01 -1.26 -3.41 120.40 120.60 2hgc s VAL 49 Ca 0.00 2.02 -0.20 0.00 0.00 0.00 0.00 61.98 63.80 2hgc s VAL 49 Cb 0.00 -4.30 0.02 0.00 0.00 0.00 0.00 36.38 32.10 2hgc s VAL 49 CO 0.00 -0.01 0.60 -2.28 0.00 0.00 0.00 175.10 173.41 2hgc s HIS 50 N 2.14 3.10 -0.09 5.22 2.46 -1.15 -4.92 115.29 122.05 2hgc s HIS 50 Ca 0.48 -0.00 -0.20 0.00 0.47 0.00 0.00 55.06 55.81 2hgc s HIS 50 Cb -0.18 -3.22 -0.04 0.00 -0.13 0.00 0.00 32.58 29.01 2hgc s HIS 50 CO 0.17 -0.78 0.56 0.71 -2.47 0.00 0.00 174.74 172.93 2hgc s TYR 51 N 2.68 3.55 -0.20 3.88 2.02 -1.26 -0.54 117.35 127.49 2hgc s TYR 51 Ca 0.21 1.04 -0.02 0.00 -0.37 0.00 0.00 57.07 57.93 2hgc s TYR 51 Cb -0.15 -2.64 0.06 0.00 -0.40 0.00 0.00 41.96 38.83 2hgc s TYR 51 CO 0.17 0.16 0.02 -1.12 -1.57 0.00 0.00 175.55 173.21 2hgc s SER 52 N 0.59 3.02 0.00 2.29 0.01 -1.12 -4.98 113.70 113.51 2hgc s SER 52 Ca 0.30 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 56.71 2hgc s SER 52 Cb -0.16 -0.69 0.00 0.00 0.21 0.00 0.00 66.02 65.38 2hgc s SER 52 CO 0.14 -0.29 0.00 0.47 0.41 0.00 0.00 173.24 173.96 2hgc n ASP 53 N 4.99 0.00 -3.02 2.44 8.00 -1.26 -3.46 116.55 124.24 2hgc n ASP 53 Ca -0.09 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.27 2hgc n ASP 53 Cb 0.47 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.53 2hgc n ASP 53 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2hgc s ASP 54 N -4.00 -0.27 0.00 -2.24 2.15 -1.26 -5.09 116.67 105.96 2hgc s ASP 54 Ca 0.00 -2.29 0.00 0.00 0.43 0.00 0.00 52.55 50.69 2hgc s ASP 54 Cb 0.00 0.94 0.00 0.00 -0.30 0.00 0.00 42.92 43.56 2hgc s ASP 54 CO 0.00 -0.10 0.00 -1.14 -0.17 0.00 0.00 175.17 173.76 2hgc n ARG 55 N 2.90 0.00 -2.11 4.34 3.00 -1.22 -5.10 116.66 118.47 2hgc n ARG 55 Ca 0.23 0.00 -0.39 0.00 -0.00 0.00 0.00 57.85 57.69 2hgc n ARG 55 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 32.46 32.96 2hgc n ARG 55 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.63 175.49 2hgc s PRO 56 N 0.00 2.70 -0.48 -0.14 0.02 -1.26 -2.79 135.00 133.05 2hgc s PRO 56 Ca 0.00 0.48 -0.28 0.00 0.02 0.00 0.00 61.00 61.23 2hgc s PRO 56 Cb 0.00 -4.37 0.03 0.00 0.02 0.00 0.00 34.50 30.18 2hgc s PRO 56 CO 0.00 -2.66 1.06 -1.01 -0.33 0.00 0.00 177.00 174.06 2hgc s HIS 57 N 8.64 2.84 -0.53 6.54 3.76 0.30 -4.94 115.29 131.90 2hgc s HIS 57 Ca 0.63 0.56 -0.22 0.00 -0.15 0.00 0.00 55.06 55.88 2hgc s HIS 57 Cb -0.12 -4.27 0.05 0.00 1.11 0.00 0.00 32.58 29.35 2hgc s HIS 57 CO 0.20 -1.23 0.83 -0.51 -0.85 0.00 0.00 174.74 173.18 2hgc s LEU 58 N 4.21 4.41 0.52 0.89 1.43 -1.26 -2.92 118.68 125.95 2hgc s LEU 58 Ca 0.43 -0.55 0.06 0.00 -1.03 0.00 0.00 54.13 53.05 2hgc s LEU 58 Cb -0.08 -2.69 0.05 0.00 0.03 0.00 0.00 46.19 43.49 2hgc s LEU 58 CO 0.29 -1.10 0.71 -0.31 0.23 0.00 0.00 176.35 176.17 2hgc s TYR 59 N 3.47 2.31 0.32 0.29 2.02 -1.26 -4.45 117.35 120.05 2hgc s TYR 59 Ca 0.25 -0.41 0.20 0.00 -0.37 0.00 0.00 57.07 56.74 2hgc s TYR 59 Cb -0.15 -2.46 0.98 0.00 -0.40 0.00 0.00 41.96 39.94 2hgc s TYR 59 CO 0.17 -0.83 1.89 0.87 -1.57 0.00 0.00 175.55 176.08 2hgc h LYS 60 N 0.30 0.00 -4.97 -0.62 1.57 -1.88 -3.39 116.57 107.58 2hgc h LYS 60 Ca -0.37 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 57.74 2hgc h LYS 60 Cb 1.28 0.00 -0.31 0.00 0.08 0.00 0.00 32.23 33.28 2hgc h LYS 60 CO 0.45 0.27 -0.76 -0.51 -0.57 0.00 0.00 179.45 178.32 2hgc s LEU 61 N -7.50 2.86 0.00 2.94 1.43 -1.26 -4.82 118.68 112.33 2hgc s LEU 61 Ca -0.02 -0.67 0.00 0.00 -1.03 0.00 0.00 54.13 52.41 2hgc s LEU 61 Cb 0.13 -1.65 0.00 0.00 0.03 0.00 0.00 46.19 44.70 2hgc s LEU 61 CO 0.66 -0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.78 2hgc n GLY 62 N 4.70 0.85 3.69 -3.19 0.00 -1.26 -5.01 105.19 104.97 2hgc n GLY 62 Ca -0.18 -0.08 -0.51 0.00 0.00 0.00 0.00 46.02 45.25 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 1.88 -4.42 1.61 -0.02 -1.22 -4.24 135.00 128.59 2hgc n PRO 63 Ca 0.00 0.69 -0.21 0.00 -2.02 0.00 0.00 63.50 61.96 2hgc n PRO 63 Cb 0.00 -2.49 -0.14 0.00 -0.02 0.00 0.00 33.50 30.86 2hgc n PRO 63 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2hgc s GLU 64 N 3.84 0.98 0.02 -0.52 0.41 0.46 -4.99 118.70 118.91 2hgc s GLU 64 Ca 0.94 -0.70 -0.06 0.00 -0.41 0.00 0.00 54.97 54.74 2hgc s GLU 64 Cb -0.80 -0.98 -0.05 0.00 -1.78 0.00 0.00 34.13 30.52 2hgc s GLU 64 CO 0.55 0.25 0.27 -0.51 -0.49 0.00 0.00 175.26 175.33 2hgc s LEU 65 N -0.96 4.36 0.57 1.80 1.02 -1.26 -0.76 118.68 123.45 2hgc s LEU 65 Ca 0.02 0.53 0.04 0.00 0.02 0.00 0.00 54.13 54.74 2hgc s LEU 65 Cb -0.07 -2.76 0.06 0.00 0.02 0.00 0.00 46.19 43.45 2hgc s LEU 65 CO 0.01 0.23 0.78 0.42 0.02 0.00 0.00 176.35 177.81 2hgc s THR 66 N -1.35 2.49 0.25 5.49 -4.23 -0.36 -4.92 115.64 113.01 2hgc s THR 66 Ca 0.29 -0.80 -0.03 0.00 -1.18 0.00 0.00 61.69 59.98 2hgc s THR 66 Cb -0.13 -2.69 0.11 0.00 1.34 0.00 0.00 72.50 71.13 2hgc s THR 66 CO 0.18 0.00 1.75 -0.08 -0.54 0.00 0.00 174.62 175.93 2hgc h GLU 67 N 0.08 0.82 -0.79 3.99 4.57 -1.89 0.20 114.58 121.56 2hgc h GLU 67 Ca -0.37 -0.22 -0.04 0.00 -1.18 0.00 0.00 59.36 57.54 2hgc h GLU 67 Cb 1.28 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 29.74 2hgc h GLU 67 CO 0.45 0.82 0.34 -0.22 -1.18 0.00 0.00 179.01 179.22 2hgc h LYS 68 N 0.76 1.16 -0.26 1.92 3.11 -1.90 0.16 116.57 121.53 2hgc h LYS 68 Ca 0.15 -0.20 -0.14 0.00 -2.81 0.00 0.00 60.65 57.65 2hgc h LYS 68 Cb 0.46 -0.20 -0.00 0.00 -1.00 0.00 0.00 32.23 31.49 2hgc h LYS 68 CO 0.02 0.93 -0.40 0.78 -2.81 0.00 0.00 179.45 177.96 2hgc h GLY 69 N 1.13 0.80 1.21 5.01 0.00 -1.59 -2.22 103.07 107.40 2hgc h GLY 69 Ca 0.27 -0.90 -0.09 0.00 0.00 0.00 0.00 47.33 46.61 2hgc h GLY 69 CO -0.03 0.81 -0.04 -2.09 0.00 0.00 0.00 176.54 175.19 2hgc h GLU 70 N 0.46 0.94 -0.47 4.80 4.81 -0.33 -2.12 114.58 122.68 2hgc h GLU 70 Ca 0.02 -0.30 -0.07 0.00 -0.13 0.00 0.00 59.36 58.88 2hgc h GLU 70 Cb 1.00 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.27 2hgc h GLU 70 CO 0.09 0.95 -0.00 -0.91 -0.73 0.00 0.00 179.01 178.42 2hgc h ASN 71 N 0.86 0.73 -0.53 1.04 -0.26 -0.70 -2.54 115.58 114.18 2hgc h ASN 71 Ca 0.15 -0.17 -0.02 0.00 -0.56 0.00 0.00 56.30 55.70 2hgc h ASN 71 Cb 0.56 -0.19 -0.03 0.00 -1.06 0.00 0.00 38.32 37.60 2hgc h ASN 71 CO 0.03 0.80 0.27 0.22 -1.06 0.00 0.00 177.43 177.70 2hgc h TYR 72 N 0.72 0.77 -0.59 1.19 3.20 -0.85 -1.14 116.97 120.27 2hgc h TYR 72 Ca 0.14 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.02 2hgc h TYR 72 Cb 0.44 -0.24 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 2hgc h TYR 72 CO 0.02 0.56 0.35 -0.07 -1.64 0.00 0.00 178.16 177.38 2hgc h LEU 73 N 0.78 0.56 -0.70 2.82 3.38 -0.96 0.37 115.31 121.56 2hgc h LEU 73 Ca 0.20 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 58.03 2hgc h LEU 73 Cb 0.07 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2hgc h LEU 73 CO -0.03 0.39 -0.60 0.11 0.09 0.00 0.00 178.44 178.40 2hgc h LYS 74 N 0.69 0.16 0.02 1.13 1.79 -1.28 0.63 116.57 119.71 2hgc h LYS 74 Ca 0.24 -0.11 -0.15 0.00 -2.18 0.00 0.00 60.65 58.45 2hgc h LYS 74 Cb 0.04 0.02 0.01 0.00 -1.58 0.00 0.00 32.23 30.72 2hgc h LYS 74 CO -0.11 0.71 -0.59 0.93 -1.08 0.00 0.00 179.45 179.31 2hgc h GLU 75 N 0.12 0.37 -0.10 3.15 5.08 -0.76 -3.25 114.58 119.19 2hgc h GLU 75 Ca -0.01 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2hgc h GLU 75 Cb 1.09 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2hgc h GLU 75 CO 0.09 1.10 0.00 -1.71 -1.00 0.00 0.00 179.01 177.49 2hgc n ASN 76 N -4.24 1.27 0.00 1.42 4.05 0.13 -3.90 115.26 113.99 2hgc n ASN 76 Ca -0.11 -1.58 0.06 0.00 0.45 0.00 0.00 54.58 53.41 2hgc n ASN 76 Cb 0.67 -0.06 0.37 0.00 1.23 0.00 0.00 39.78 42.00 2hgc n ASN 76 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2hgc n GLY 77 N 1.08 -0.40 1.15 8.20 0.00 0.21 -2.24 105.19 113.19 2hgc n GLY 77 Ca 0.17 -0.08 0.04 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.00 1.30 -3.42 2.61 5.66 -1.25 -4.89 114.28 113.28 2hgc n THR 78 Ca 0.09 -0.67 -0.36 0.00 -3.05 0.00 0.00 64.05 60.06 2hgc n THR 78 Cb 0.04 -0.34 -0.06 0.00 -1.55 0.00 0.00 70.33 68.42 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 -1.84 3.65 0.16 1.09 -0.00 -0.95 -4.93 118.94 116.11 2hgc s TRP 79 Ca 0.27 1.01 0.00 0.00 -0.00 0.00 0.00 56.10 57.38 2hgc s TRP 79 Cb 0.20 -2.32 0.00 0.00 -0.00 0.00 0.00 33.47 31.35 2hgc s TRP 79 CO 0.09 0.51 0.00 0.43 -0.00 0.00 0.00 176.95 177.97 2hgc n SER 80 N 1.11 -2.26 -2.94 5.86 7.64 -1.26 -5.10 113.62 116.67 2hgc n SER 80 Ca -0.08 0.48 -0.16 0.00 1.01 0.00 0.00 58.87 60.12 2hgc n SER 80 Cb 0.52 -0.88 -0.06 0.00 -1.01 0.00 0.00 64.21 62.78 2hgc n SER 80 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2hgc n LYS 81 N -2.07 0.43 -0.64 1.43 5.02 -1.26 -5.18 118.16 115.89 2hgc n LYS 81 Ca -0.01 -2.86 0.00 0.00 -2.02 0.00 0.00 58.31 53.42 2hgc n LYS 81 Cb 0.15 2.44 0.00 0.00 -0.02 0.00 0.00 35.03 37.60 2hgc n LYS 81 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88