#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 0.00 -0.10 -0.35 7.99 -1.26 -4.43 117.00 118.85 2hgc n LEU 6 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 56.01 55.94 2hgc n LEU 6 Cb 0.00 0.40 0.11 0.00 -0.11 0.00 0.00 43.42 43.82 2hgc n LEU 6 CO 0.00 0.40 0.78 0.03 -1.51 0.00 0.00 177.39 177.09 2hgc h ARG 7 N 0.00 0.80 -0.36 3.23 2.47 -2.00 -0.83 114.38 117.69 2hgc h ARG 7 Ca -0.44 -0.27 0.06 0.00 -1.26 0.00 0.00 59.98 58.06 2hgc h ARG 7 Cb 2.00 -0.06 -0.05 0.00 -1.65 0.00 0.00 29.97 30.21 2hgc h ARG 7 CO 0.02 0.88 0.06 -0.92 0.56 0.00 0.00 179.97 180.58 2hgc h TYR 8 N 0.72 0.10 0.00 3.04 3.20 -2.02 -2.64 116.97 119.37 2hgc h TYR 8 Ca 0.12 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.01 2hgc h TYR 8 Cb 0.61 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.89 2hgc h TYR 8 CO 0.03 0.00 0.00 0.00 -1.64 0.00 0.00 178.16 176.56 2hgc h ALA 9 N 1.28 1.00 -0.95 1.82 0.00 -1.60 -3.08 119.26 117.72 2hgc h ALA 9 Ca 0.17 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.12 2hgc h ALA 9 Cb 0.21 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 2hgc h ALA 9 CO -0.24 0.00 0.63 0.82 0.00 0.00 0.00 179.25 180.46 2hgc h ILE 10 N 0.00 1.16 -0.06 0.00 2.04 -0.79 -1.69 117.51 118.17 2hgc h ILE 10 Ca 0.00 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 65.42 2hgc h ILE 10 Cb 0.85 -0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2hgc h ILE 10 CO 0.00 0.22 -0.07 -0.07 0.00 0.00 0.00 178.15 178.22 2hgc h LEU 11 N 1.20 0.08 -0.50 1.44 3.38 -1.56 -2.29 115.31 117.06 2hgc h LEU 11 Ca 0.38 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.32 2hgc h LEU 11 Cb 0.02 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2hgc h LEU 11 CO -0.12 0.18 0.22 0.50 0.09 0.00 0.00 178.44 179.30 2hgc h LYS 12 N 0.09 0.74 -0.57 1.13 3.11 -1.45 0.14 116.57 119.76 2hgc h LYS 12 Ca 0.02 -0.13 -0.04 0.00 -2.81 0.00 0.00 60.65 57.70 2hgc h LYS 12 Cb 0.20 -0.12 -0.03 0.00 -1.00 0.00 0.00 32.23 31.28 2hgc h LYS 12 CO 0.01 0.65 0.22 0.93 -2.81 0.00 0.00 179.45 178.45 2hgc h GLU 13 N 0.67 0.86 -0.12 1.90 4.39 -1.37 -2.43 114.58 118.48 2hgc h GLU 13 Ca 0.17 -0.16 -0.07 0.00 0.34 0.00 0.00 59.36 59.64 2hgc h GLU 13 Cb 0.17 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2hgc h GLU 13 CO -0.02 0.75 -0.24 0.82 -1.16 0.00 0.00 179.01 179.17 2hgc h ILE 14 N 0.79 1.22 -0.00 3.13 2.04 -1.08 0.54 117.51 124.16 2hgc h ILE 14 Ca 0.19 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 65.01 2hgc h ILE 14 Cb 0.22 1.40 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 2hgc h ILE 14 CO -0.01 0.31 -0.00 0.15 0.00 0.00 0.00 178.15 178.60 2hgc h PHE 15 N 0.19 0.01 0.00 1.37 3.57 -0.27 0.04 116.94 121.85 2hgc h PHE 15 Ca 0.03 -0.00 -0.24 0.00 3.53 0.00 0.00 57.97 61.29 2hgc h PHE 15 Cb 0.53 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.22 2hgc h PHE 15 CO 0.01 0.42 -1.47 1.05 -2.23 0.00 0.00 178.31 176.09 2hgc h GLU 16 N -0.40 0.00 0.00 1.11 4.11 -1.44 -3.29 114.58 114.67 2hgc h GLU 16 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2hgc h GLU 16 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2hgc h GLU 16 CO 0.00 0.50 -0.49 0.41 0.07 0.00 0.00 179.01 179.51 2hgc n GLY 17 N 1.47 -1.47 5.53 1.06 0.00 0.18 -4.96 105.19 106.98 2hgc n GLY 17 Ca -0.12 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.13 0.00 0.00 1.61 4.05 0.00 -4.68 115.26 114.11 2hgc n ASN 18 Ca 0.04 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.07 2hgc n ASN 18 Cb 0.43 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.44 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 0.00 0.00 -2.06 -0.44 -2.24 -1.26 -4.68 114.28 103.60 2hgc n THR 19 Ca 0.00 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.65 2hgc n THR 19 Cb 0.00 0.00 0.07 0.00 -2.10 0.00 0.00 70.33 68.30 2hgc n THR 19 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2hgc n PRO 20 N -0.34 -0.08 -3.65 -0.78 -0.04 -1.25 -4.29 135.00 124.57 2hgc n PRO 20 Ca 0.00 -1.22 -0.07 0.00 -0.04 0.00 0.00 63.50 62.17 2hgc n PRO 20 Cb 0.00 -0.46 -0.07 0.00 -0.04 0.00 0.00 33.50 32.93 2hgc n PRO 20 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2hgc s LEU 21 N 0.00 -0.78 0.71 1.53 2.34 -1.26 -4.99 118.68 116.22 2hgc s LEU 21 Ca 0.34 1.36 -0.07 0.00 0.06 0.00 0.00 54.13 55.83 2hgc s LEU 21 Cb -0.02 2.09 0.06 0.00 -0.56 0.00 0.00 46.19 47.77 2hgc s LEU 21 CO 0.23 -0.23 1.02 -0.44 -1.06 0.00 0.00 176.35 175.88 2hgc s SER 22 N 1.85 4.79 0.36 1.48 0.01 -1.26 -4.81 113.70 116.12 2hgc s SER 22 Ca -0.09 0.45 0.05 0.00 1.31 0.00 0.00 55.95 57.67 2hgc s SER 22 Cb -0.07 -1.09 0.69 0.00 0.21 0.00 0.00 66.02 65.76 2hgc s SER 22 CO -0.18 -1.61 1.94 1.05 0.41 0.00 0.00 173.24 174.85 2hgc h GLU 23 N -0.61 0.53 0.00 12.44 9.09 -1.93 -0.21 114.58 133.89 2hgc h GLU 23 Ca -0.44 -0.08 -0.02 0.00 0.05 0.00 0.00 59.36 58.86 2hgc h GLU 23 Cb 1.32 -0.09 -0.00 0.00 -1.65 0.00 0.00 28.75 28.32 2hgc h GLU 23 CO 0.60 0.48 -0.11 -2.95 0.05 0.00 0.00 179.01 177.09 2hgc h ASN 24 N 0.52 0.00 0.12 3.06 -1.07 -1.94 -1.48 115.58 114.79 2hgc h ASN 24 Ca 0.12 0.00 -0.25 0.00 0.07 0.00 0.00 56.30 56.24 2hgc h ASN 24 Cb 0.19 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.45 2hgc h ASN 24 CO -0.00 0.11 -1.24 0.44 0.07 0.00 0.00 177.43 176.80 2hgc h ASP 25 N 0.00 0.41 -0.24 6.14 3.32 -1.44 -3.36 116.42 121.26 2hgc h ASP 25 Ca -0.00 -0.88 -0.16 0.00 0.02 0.00 0.00 57.03 56.01 2hgc h ASP 25 Cb 0.58 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 2hgc h ASP 25 CO 0.01 1.56 -0.43 -0.29 -1.72 0.00 0.00 179.24 178.37 2hgc h ILE 26 N -0.32 1.28 0.00 0.35 6.09 -1.18 -3.48 117.51 120.26 2hgc h ILE 26 Ca -0.26 -1.61 0.00 0.00 -1.37 0.00 0.00 64.86 61.62 2hgc h ILE 26 Cb 1.73 1.49 0.00 0.00 0.47 0.00 0.00 36.82 40.52 2hgc h ILE 26 CO 0.09 0.52 0.00 0.61 -3.07 0.00 0.00 178.15 176.30 2hgc n GLY 27 N 0.13 2.33 3.86 8.18 0.00 -0.56 -5.03 105.19 114.11 2hgc n GLY 27 Ca -0.02 0.00 -0.22 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 -2.09 4.66 0.93 1.61 -7.23 -1.21 -4.98 120.40 112.08 2hgc s VAL 28 Ca 0.00 -1.29 -0.12 0.00 -1.81 0.00 0.00 61.98 58.76 2hgc s VAL 28 Cb 0.00 -3.53 0.15 0.00 0.56 0.00 0.00 36.38 33.56 2hgc s VAL 28 CO 0.00 -0.34 1.09 0.28 -0.31 0.00 0.00 175.10 175.82 2hgc s THR 29 N -2.09 2.45 0.50 5.32 -1.32 -1.26 -4.43 115.64 114.80 2hgc s THR 29 Ca 0.33 0.15 0.18 0.00 -1.21 0.00 0.00 61.69 61.14 2hgc s THR 29 Cb -0.08 -2.66 0.25 0.00 -1.51 0.00 0.00 72.50 68.50 2hgc s THR 29 CO 0.26 -0.19 2.11 1.05 -2.21 0.00 0.00 174.62 175.64 2hgc h GLU 30 N -1.64 0.00 -0.44 7.08 4.11 -1.98 -0.63 114.58 121.08 2hgc h GLU 30 Ca -0.51 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 58.86 2hgc h GLU 30 Cb 1.30 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.53 2hgc h GLU 30 CO 0.56 0.07 0.05 -0.44 0.07 0.00 0.00 179.01 179.32 2hgc h ASP 31 N 0.00 0.72 0.39 3.06 3.32 -1.99 0.20 116.42 122.13 2hgc h ASP 31 Ca -0.00 -0.27 -0.14 0.00 0.02 0.00 0.00 57.03 56.64 2hgc h ASP 31 Cb 0.12 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2hgc h ASP 31 CO 0.01 0.81 -0.58 1.56 -1.72 0.00 0.00 179.24 179.32 2hgc h GLN 32 N 0.60 0.20 -0.23 3.56 4.20 -1.62 -0.93 115.11 120.89 2hgc h GLN 32 Ca 0.13 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 2hgc h GLN 32 Cb 0.41 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 2hgc h GLN 32 CO 0.01 0.72 0.05 0.35 -0.67 0.00 0.00 178.83 179.30 2hgc h PHE 33 N 0.15 0.40 0.10 2.96 3.57 -0.88 0.12 116.94 123.36 2hgc h PHE 33 Ca -0.00 -0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.46 2hgc h PHE 33 Cb 1.07 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.67 2hgc h PHE 33 CO 0.02 0.49 -0.19 0.22 -2.23 0.00 0.00 178.31 176.62 2hgc h ASP 34 N 0.20 -0.52 -0.80 0.41 3.58 -0.40 0.88 116.42 119.77 2hgc h ASP 34 Ca 0.07 0.06 0.03 0.00 0.42 0.00 0.00 57.03 57.62 2hgc h ASP 34 Cb 0.29 0.20 -0.04 0.00 1.72 0.00 0.00 39.33 41.50 2hgc h ASP 34 CO 0.00 -0.27 0.52 0.44 -2.88 0.00 0.00 179.24 177.06 2hgc h ASP 35 N -0.36 0.85 0.75 2.28 3.32 -1.12 -1.13 116.42 121.02 2hgc h ASP 35 Ca 0.03 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 2hgc h ASP 35 Cb 0.38 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 39.74 2hgc h ASP 35 CO -0.10 0.59 -0.36 0.00 -1.72 0.00 0.00 179.24 177.64 2hgc h ALA 36 N 1.53 -1.01 -0.69 3.45 0.00 -0.22 -1.94 119.26 120.39 2hgc h ALA 36 Ca 0.32 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 55.04 2hgc h ALA 36 Cb 0.03 0.39 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 2hgc h ALA 36 CO -0.09 -0.94 0.42 0.28 0.00 0.00 0.00 179.25 178.93 2hgc h VAL 37 N -1.26 1.06 -0.62 0.00 2.07 -0.71 0.33 116.25 117.11 2hgc h VAL 37 Ca -0.10 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.12 2hgc h VAL 37 Cb 0.78 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 2hgc h VAL 37 CO 0.17 0.15 0.31 0.78 0.02 0.00 0.00 177.57 179.00 2hgc h ASN 38 N 0.82 0.80 -0.19 0.57 2.35 -1.27 0.24 115.58 118.89 2hgc h ASN 38 Ca 0.29 -0.12 -0.06 0.00 -0.55 0.00 0.00 56.30 55.85 2hgc h ASN 38 Cb 0.07 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.23 2hgc h ASN 38 CO -0.13 0.70 -0.12 0.15 -1.65 0.00 0.00 177.43 176.37 2hgc h PHE 39 N 0.85 0.49 -0.58 1.19 3.57 -0.51 -0.54 116.94 121.41 2hgc h PHE 39 Ca 0.21 -0.13 -0.04 0.00 3.53 0.00 0.00 57.97 61.54 2hgc h PHE 39 Cb 0.10 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 2hgc h PHE 39 CO -0.00 0.74 0.19 -0.07 -2.23 0.00 0.00 178.31 176.94 2hgc h LEU 40 N 0.10 0.80 -0.30 0.59 3.38 -0.22 0.37 115.31 120.03 2hgc h LEU 40 Ca 0.04 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2hgc h LEU 40 Cb 0.63 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2hgc h LEU 40 CO 0.03 0.75 0.06 0.50 0.09 0.00 0.00 178.44 179.87 2hgc h LYS 41 N 0.84 0.48 -0.74 1.13 3.11 -0.44 0.26 116.57 121.22 2hgc h LYS 41 Ca 0.19 -0.12 -0.00 0.00 -2.81 0.00 0.00 60.65 57.91 2hgc h LYS 41 Cb 0.24 -0.06 -0.04 0.00 -1.00 0.00 0.00 32.23 31.37 2hgc h LYS 41 CO -0.01 0.57 0.45 -0.09 -2.81 0.00 0.00 179.45 177.56 2hgc h ARG 42 N 0.32 0.99 -0.52 1.90 2.43 -0.46 -2.48 114.38 116.56 2hgc h ARG 42 Ca 0.09 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2hgc h ARG 42 Cb 0.32 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 2hgc h ARG 42 CO 0.00 0.70 0.00 -1.91 -1.51 0.00 0.00 179.97 177.25 2hgc n GLU 43 N -4.52 2.31 -3.29 0.20 4.07 0.06 -4.91 120.64 114.57 2hgc n GLU 43 Ca 0.07 -1.56 -0.21 0.00 -0.06 0.00 0.00 57.16 55.40 2hgc n GLU 43 Cb 0.05 -1.50 0.06 0.00 -0.06 0.00 0.00 31.44 29.99 2hgc n GLU 43 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2hgc n GLY 44 N 0.91 -0.38 0.08 8.31 0.00 -0.77 -4.90 105.19 108.45 2hgc n GLY 44 Ca 0.14 0.11 -0.06 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.01 0.00 -3.60 1.61 0.05 -0.76 -3.41 116.97 108.85 2hgc h TYR 45 Ca -0.49 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.13 2hgc h TYR 45 Cb 1.33 0.00 -0.21 0.00 1.01 0.00 0.00 36.73 38.86 2hgc h TYR 45 CO 0.45 0.87 -0.54 0.96 -1.05 0.00 0.00 178.16 178.86 2hgc s ILE 46 N -2.71 0.08 0.07 -2.88 -5.25 -1.23 -1.26 121.20 108.03 2hgc s ILE 46 Ca -0.03 -0.69 0.04 0.00 -0.99 0.00 0.00 60.65 58.99 2hgc s ILE 46 Cb 0.08 -0.38 -0.03 0.00 2.95 0.00 0.00 42.46 45.08 2hgc s ILE 46 CO 0.82 -0.38 -0.13 0.27 -1.79 0.00 0.00 174.94 173.73 2hgc s ILE 47 N -1.30 1.00 0.00 8.37 -0.00 -0.04 -4.50 121.20 124.72 2hgc s ILE 47 Ca -0.14 -1.31 0.00 0.00 -0.00 0.00 0.00 60.65 59.20 2hgc s ILE 47 Cb -0.08 -1.03 0.00 0.00 -0.00 0.00 0.00 42.46 41.36 2hgc s ILE 47 CO 0.01 -0.29 0.00 0.61 -0.00 0.00 0.00 174.94 175.27 2hgc n GLY 48 N 1.22 1.21 3.63 6.27 0.00 -1.26 0.02 105.19 116.28 2hgc n GLY 48 Ca -0.21 -0.25 -0.43 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.17 3.84 0.11 1.61 1.01 -1.26 -2.51 120.40 121.03 2hgc s VAL 49 Ca 0.00 0.95 -0.28 0.00 0.00 0.00 0.00 61.98 62.66 2hgc s VAL 49 Cb 0.00 -3.84 -0.06 0.00 0.00 0.00 0.00 36.38 32.47 2hgc s VAL 49 CO 0.00 -0.34 0.87 -1.00 0.00 0.00 0.00 175.10 174.63 2hgc s HIS 50 N 4.88 3.82 -0.11 5.22 3.76 -1.26 -4.97 115.29 126.63 2hgc s HIS 50 Ca 0.66 1.68 -0.02 0.00 -0.15 0.00 0.00 55.06 57.23 2hgc s HIS 50 Cb -0.23 -2.93 -0.03 0.00 1.11 0.00 0.00 32.58 30.51 2hgc s HIS 50 CO 0.27 0.30 -0.02 0.71 -0.85 0.00 0.00 174.74 175.15 2hgc s TYR 51 N -0.30 3.08 0.28 1.40 2.02 -1.26 0.34 117.35 122.90 2hgc s TYR 51 Ca 0.42 -0.02 0.02 0.00 -0.37 0.00 0.00 57.07 57.12 2hgc s TYR 51 Cb -0.23 -1.86 0.39 0.00 -0.40 0.00 0.00 41.96 39.87 2hgc s TYR 51 CO 0.27 0.24 1.72 1.03 -1.57 0.00 0.00 175.55 177.24 2hgc h SER 52 N 5.84 0.51 0.00 2.29 0.87 -1.26 -3.45 113.55 118.35 2hgc h SER 52 Ca -0.42 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 59.96 2hgc h SER 52 Cb 1.19 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 63.01 2hgc h SER 52 CO 0.58 0.75 0.00 -0.67 -0.53 0.00 0.00 176.83 176.96 2hgc n ASP 53 N -4.12 0.00 0.00 6.23 2.03 -1.26 -4.96 116.55 114.47 2hgc n ASP 53 Ca -0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2hgc n ASP 53 Cb 0.40 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.80 2hgc n ASP 53 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2hgc n ASP 54 N 0.00 1.04 -4.69 1.67 2.03 -1.26 -5.10 116.55 110.24 2hgc n ASP 54 Ca 0.00 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 55.00 2hgc n ASP 54 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 2hgc n ASP 54 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 2hgc s ARG 55 N -1.61 2.69 0.26 -0.67 6.06 -1.26 -5.05 118.95 119.36 2hgc s ARG 55 Ca 0.00 -0.71 -0.30 0.00 -2.50 0.00 0.00 55.73 52.21 2hgc s ARG 55 Cb 0.00 -2.61 -0.13 0.00 0.06 0.00 0.00 34.95 32.26 2hgc s ARG 55 CO 0.00 0.59 1.30 -2.30 -2.50 0.00 0.00 175.30 172.39 2hgc n PRO 56 N 1.00 1.87 -3.32 5.12 -0.02 -1.26 -0.83 135.00 137.55 2hgc n PRO 56 Ca -0.13 0.66 -0.08 0.00 -2.02 0.00 0.00 63.50 61.93 2hgc n PRO 56 Cb 0.52 -2.25 -0.07 0.00 -0.02 0.00 0.00 33.50 31.69 2hgc n PRO 56 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2hgc s HIS 57 N -0.42 -0.96 0.16 6.00 2.46 0.15 -4.75 115.29 117.94 2hgc s HIS 57 Ca 0.65 0.66 -0.30 0.00 0.47 0.00 0.00 55.06 56.54 2hgc s HIS 57 Cb -0.66 -0.02 -0.07 0.00 -0.13 0.00 0.00 32.58 31.69 2hgc s HIS 57 CO 0.54 -0.85 1.16 -0.51 -2.47 0.00 0.00 174.74 172.61 2hgc s LEU 58 N 2.56 4.45 0.00 8.88 1.43 -1.26 -4.22 118.68 130.52 2hgc s LEU 58 Ca 0.12 2.14 0.02 0.00 -1.03 0.00 0.00 54.13 55.38 2hgc s LEU 58 Cb -0.14 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.47 2hgc s LEU 58 CO -0.23 -0.34 0.07 -1.22 0.23 0.00 0.00 176.35 174.87 2hgc n TYR 59 N 2.74 0.53 -0.28 0.29 4.01 -1.26 -4.18 117.16 119.01 2hgc n TYR 59 Ca 0.05 -2.24 -0.06 0.00 -0.16 0.00 0.00 57.90 55.49 2hgc n TYR 59 Cb 0.46 -0.13 -0.01 0.00 -0.31 0.00 0.00 39.34 39.34 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 -0.12 -5.61 -0.72 1.57 -1.95 -3.33 116.57 106.41 2hgc h LYS 60 Ca -0.32 0.01 -0.49 0.00 -1.87 0.00 0.00 60.65 57.98 2hgc h LYS 60 Cb 1.08 0.03 -0.25 0.00 0.08 0.00 0.00 32.23 33.18 2hgc h LYS 60 CO 0.52 -0.08 -0.81 -0.48 -0.57 0.00 0.00 179.45 178.03 2hgc s LEU 61 N -10.71 2.19 0.00 2.94 0.05 -1.26 -4.48 118.68 107.40 2hgc s LEU 61 Ca -0.14 -0.50 0.00 0.00 0.05 0.00 0.00 54.13 53.54 2hgc s LEU 61 Cb 0.16 -0.73 0.00 0.00 -2.05 0.00 0.00 46.19 43.57 2hgc s LEU 61 CO 0.68 0.07 0.00 0.61 -0.55 0.00 0.00 176.35 177.16 2hgc n GLY 62 N 1.78 2.63 3.67 -3.48 0.00 -1.26 -5.03 105.19 103.49 2hgc n GLY 62 Ca -0.18 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 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 4.22 0.15 1.61 0.04 -1.04 -4.50 135.00 135.48 2hgc s PRO 63 Ca 0.00 1.98 0.09 0.00 0.04 0.00 0.00 61.00 63.11 2hgc s PRO 63 Cb 0.00 -3.80 -0.04 0.00 0.04 0.00 0.00 34.50 30.70 2hgc s PRO 63 CO 0.00 -0.73 -0.12 -1.21 0.04 0.00 0.00 177.00 174.98 2hgc s GLU 64 N 3.40 1.99 -0.16 4.56 0.41 0.10 -4.96 118.70 124.04 2hgc s GLU 64 Ca 0.66 -1.20 -0.08 0.00 -0.41 0.00 0.00 54.97 53.93 2hgc s GLU 64 Cb -0.30 -2.17 -0.04 0.00 -1.78 0.00 0.00 34.13 29.84 2hgc s GLU 64 CO 0.25 0.46 0.11 -0.51 -0.49 0.00 0.00 175.26 175.08 2hgc s LEU 65 N -2.52 4.16 0.63 1.80 1.02 -1.26 -0.86 118.68 121.65 2hgc s LEU 65 Ca 0.22 0.29 -0.11 0.00 0.02 0.00 0.00 54.13 54.55 2hgc s LEU 65 Cb -0.10 -2.04 -0.03 0.00 0.02 0.00 0.00 46.19 44.04 2hgc s LEU 65 CO 0.13 0.28 1.04 0.42 0.02 0.00 0.00 176.35 178.24 2hgc s THR 66 N -0.25 4.46 0.15 5.49 -4.23 -0.39 -4.88 115.64 115.99 2hgc s THR 66 Ca 0.10 0.78 0.35 0.00 -1.18 0.00 0.00 61.69 61.73 2hgc s THR 66 Cb -0.12 -3.79 0.40 0.00 1.34 0.00 0.00 72.50 70.33 2hgc s THR 66 CO 0.01 -1.03 2.02 1.05 -0.54 0.00 0.00 174.62 176.12 2hgc h GLU 67 N -0.37 0.00 -0.19 3.99 4.11 -1.92 0.20 114.58 120.40 2hgc h GLU 67 Ca -0.44 0.00 0.01 0.00 0.07 0.00 0.00 59.36 59.00 2hgc h GLU 67 Cb 1.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 2hgc h GLU 67 CO 0.62 0.00 0.11 -0.22 0.07 0.00 0.00 179.01 179.59 2hgc h LYS 68 N 0.00 0.22 -0.03 1.06 3.64 -1.90 0.39 116.57 119.95 2hgc h LYS 68 Ca 0.00 -0.01 -0.21 0.00 -1.27 0.00 0.00 60.65 59.16 2hgc h LYS 68 Cb 0.47 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.24 2hgc h LYS 68 CO 0.00 0.14 -0.86 0.78 -2.27 0.00 0.00 179.45 177.25 2hgc h GLY 69 N 0.22 0.43 0.98 5.01 0.00 -1.54 -2.80 103.07 105.37 2hgc h GLY 69 Ca 0.07 -0.70 -0.03 0.00 0.00 0.00 0.00 47.33 46.67 2hgc h GLY 69 CO -0.04 0.62 0.23 -2.09 0.00 0.00 0.00 176.54 175.26 2hgc h GLU 70 N 0.24 0.81 -0.16 4.80 4.81 -0.36 0.41 114.58 125.14 2hgc h GLU 70 Ca -0.06 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 58.94 2hgc h GLU 70 Cb 1.47 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 2hgc h GLU 70 CO 0.15 0.70 -0.30 -0.91 -0.73 0.00 0.00 179.01 177.92 2hgc h ASN 71 N 0.75 0.30 -0.33 1.04 2.35 -0.28 -1.72 115.58 117.69 2hgc h ASN 71 Ca 0.18 -0.10 -0.06 0.00 -0.55 0.00 0.00 56.30 55.77 2hgc h ASN 71 Cb 0.19 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 2hgc h ASN 71 CO -0.02 0.60 0.03 0.22 -1.65 0.00 0.00 177.43 176.61 2hgc h TYR 72 N 0.26 0.69 0.00 1.19 3.20 -1.11 -2.55 116.97 118.65 2hgc h TYR 72 Ca 0.04 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.83 2hgc h TYR 72 Cb 0.67 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.74 2hgc h TYR 72 CO 0.01 0.64 0.00 -0.07 -1.64 0.00 0.00 178.16 177.11 2hgc h LEU 73 N 0.63 0.00 -1.28 2.82 3.38 -0.11 -3.23 115.31 117.52 2hgc h LEU 73 Ca 0.13 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.27 2hgc h LEU 73 Cb 0.35 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.03 2hgc h LEU 73 CO 0.01 0.00 0.59 0.50 0.09 0.00 0.00 178.44 179.63 2hgc h LYS 74 N 0.00 0.63 0.00 1.13 1.63 -0.90 0.32 116.57 119.38 2hgc h LYS 74 Ca 0.00 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 2hgc h LYS 74 Cb 0.71 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.20 2hgc h LYS 74 CO 0.00 0.42 -0.51 0.93 -3.45 0.00 0.00 179.45 176.84 2hgc h GLU 75 N 0.65 0.00 -0.00 1.90 4.39 -1.72 -3.28 114.58 116.51 2hgc h GLU 75 Ca 0.48 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.18 2hgc h GLU 75 Cb 0.86 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 2hgc h GLU 75 CO -0.23 0.00 -0.00 -1.71 -1.16 0.00 0.00 179.01 175.91 2hgc n ASN 76 N -2.87 0.00 0.31 1.42 4.05 0.10 -3.36 115.26 114.91 2hgc n ASN 76 Ca 0.02 0.47 0.20 0.00 0.45 0.00 0.00 54.58 55.72 2hgc n ASN 76 Cb 0.54 -0.49 1.01 0.00 1.23 0.00 0.00 39.78 42.06 2hgc n ASN 76 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 177.26 175.44 2hgc h GLY 77 N 5.00 0.00 -3.50 8.20 0.00 -1.31 -0.94 103.07 110.52 2hgc h GLY 77 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 2hgc h GLY 77 CO 0.00 0.00 0.07 -0.37 0.00 0.00 0.00 176.54 176.24 2hgc n THR 78 N -3.20 2.81 -4.15 4.70 5.66 -1.21 -4.89 114.28 114.00 2hgc n THR 78 Ca -0.02 -1.50 -0.34 0.00 -3.05 0.00 0.00 64.05 59.14 2hgc n THR 78 Cb 0.15 -0.30 -0.10 0.00 -1.55 0.00 0.00 70.33 68.53 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 -2.84 3.18 0.27 1.09 -0.11 -0.36 -5.11 118.94 115.06 2hgc s TRP 79 Ca 0.54 -0.03 0.12 0.00 1.22 0.00 0.00 56.10 57.95 2hgc s TRP 79 Cb 0.42 -2.02 -0.05 0.00 -1.50 0.00 0.00 33.47 30.32 2hgc s TRP 79 CO 0.15 0.13 -0.17 0.45 -4.62 0.00 0.00 176.95 172.89 2hgc s SER 80 N 0.26 3.75 -0.31 5.86 0.15 -1.26 -5.02 113.70 117.13 2hgc s SER 80 Ca 0.02 -0.95 0.04 0.00 0.70 0.00 0.00 55.95 55.75 2hgc s SER 80 Cb -0.13 -0.39 0.50 0.00 -1.71 0.00 0.00 66.02 64.29 2hgc s SER 80 CO 0.01 0.04 1.64 0.29 1.20 0.00 0.00 173.24 176.42 2hgc n LYS 81 N -0.60 2.15 0.00 5.44 5.02 -1.26 -5.18 118.16 123.73 2hgc n LYS 81 Ca -0.06 -2.22 0.14 0.00 -2.02 0.00 0.00 58.31 54.16 2hgc n LYS 81 Cb 0.60 -1.89 0.51 0.00 -0.02 0.00 0.00 35.03 34.23 2hgc n LYS 81 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88