#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 -0.29 -0.35 4.07 -2.01 -1.43 115.31 115.31 2hgc h LEU 6 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2hgc h LEU 6 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 2hgc h LEU 6 CO 0.00 0.44 0.00 0.54 -1.08 0.00 0.00 178.44 178.34 2hgc n ARG 7 N -3.57 0.08 -0.14 1.13 1.74 -1.26 -0.26 116.66 114.39 2hgc n ARG 7 Ca -0.00 0.33 -0.25 0.00 -0.77 0.00 0.00 57.85 57.16 2hgc n ARG 7 Cb 0.55 -1.65 -0.11 0.00 -1.02 0.00 0.00 32.46 30.23 2hgc n ARG 7 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 2hgc n TYR 8 N -1.79 0.00 -0.02 -1.55 9.36 -0.96 -4.29 117.16 117.91 2hgc n TYR 8 Ca 0.03 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 61.14 2hgc n TYR 8 Cb 0.19 -0.99 -0.05 0.00 -0.63 0.00 0.00 39.34 37.85 2hgc n TYR 8 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2hgc h ALA 9 N -0.60 0.18 -0.18 2.98 0.00 -0.86 0.93 119.26 121.71 2hgc h ALA 9 Ca -0.66 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.23 2hgc h ALA 9 Cb 1.73 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 2hgc h ALA 9 CO -0.29 -0.32 0.08 0.82 0.00 0.00 0.00 179.25 179.53 2hgc h ILE 10 N 0.18 1.15 -0.20 0.00 2.04 -0.89 -0.95 117.51 118.84 2hgc h ILE 10 Ca 0.05 -0.45 -0.05 0.00 1.00 0.00 0.00 64.86 65.41 2hgc h ILE 10 Cb -0.00 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 2hgc h ILE 10 CO -0.01 0.14 -0.10 -0.07 0.00 0.00 0.00 178.15 178.11 2hgc h LEU 11 N 0.15 0.29 -0.36 1.44 4.07 -1.71 -0.44 115.31 118.75 2hgc h LEU 11 Ca 0.06 -0.06 -0.04 0.00 0.08 0.00 0.00 57.88 57.92 2hgc h LEU 11 Cb 0.16 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 41.81 2hgc h LEU 11 CO -0.01 0.43 0.06 0.50 -1.08 0.00 0.00 178.44 178.35 2hgc h LYS 12 N 0.30 0.59 -0.79 1.13 3.64 -0.36 0.25 116.57 121.32 2hgc h LYS 12 Ca 0.06 -0.16 -0.02 0.00 -1.27 0.00 0.00 60.65 59.26 2hgc h LYS 12 Cb 0.37 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.08 2hgc h LYS 12 CO 0.02 0.66 0.41 0.93 -2.27 0.00 0.00 179.45 179.20 2hgc h GLU 13 N 0.43 1.13 -0.66 1.90 4.39 -0.64 0.18 114.58 121.31 2hgc h GLU 13 Ca 0.11 -0.15 -0.07 0.00 0.34 0.00 0.00 59.36 59.59 2hgc h GLU 13 Cb 0.35 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.76 2hgc h GLU 13 CO 0.01 0.85 0.14 0.82 -1.16 0.00 0.00 179.01 179.67 2hgc h ILE 14 N 1.11 1.26 0.01 3.13 2.04 -0.84 0.34 117.51 124.55 2hgc h ILE 14 Ca 0.28 -0.97 -0.00 0.00 1.00 0.00 0.00 64.86 65.17 2hgc h ILE 14 Cb 0.08 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 2hgc h ILE 14 CO -0.04 0.37 -0.00 0.15 0.00 0.00 0.00 178.15 178.62 2hgc h PHE 15 N 1.00 -0.01 0.23 1.37 3.04 0.13 -0.49 116.94 122.20 2hgc h PHE 15 Ca 0.21 -0.00 -0.31 0.00 3.98 0.00 0.00 57.97 61.84 2hgc h PHE 15 Cb 0.38 0.00 0.04 0.00 2.56 0.00 0.00 35.95 38.93 2hgc h PHE 15 CO 0.03 0.42 -1.37 0.93 -2.02 0.00 0.00 178.31 176.30 2hgc h GLU 16 N -0.44 0.50 0.00 1.11 4.39 -0.66 -3.32 114.58 116.15 2hgc h GLU 16 Ca -0.00 -0.85 0.00 0.00 0.34 0.00 0.00 59.36 58.85 2hgc h GLU 16 Cb 0.43 0.32 0.00 0.00 -0.10 0.00 0.00 28.75 29.40 2hgc h GLU 16 CO 0.00 1.41 -0.59 0.78 -1.16 0.00 0.00 179.01 179.45 2hgc h GLY 17 N 0.07 0.00 -1.65 -3.84 0.00 -0.44 -3.47 103.07 93.73 2hgc h GLY 17 Ca -0.24 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 46.71 2hgc h GLY 17 CO 0.25 0.00 -0.40 -2.01 0.00 0.00 0.00 176.54 174.38 2hgc n ASN 18 N -2.64 -5.30 -1.21 0.19 2.85 -0.19 -4.76 115.26 104.20 2hgc n ASN 18 Ca 0.02 0.25 0.14 0.00 -0.11 0.00 0.00 54.58 54.89 2hgc n ASN 18 Cb 0.51 -4.40 -0.05 0.00 1.24 0.00 0.00 39.78 37.08 2hgc n ASN 18 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2hgc n THR 19 N -3.13 0.00 -2.22 -0.44 -2.24 -1.24 -4.55 114.28 100.46 2hgc n THR 19 Ca -0.20 0.30 -0.27 0.00 -2.27 0.00 0.00 64.05 61.61 2hgc n THR 19 Cb 0.64 -0.68 0.17 0.00 -2.10 0.00 0.00 70.33 68.36 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 -2.97 0.83 -0.23 -0.78 0.04 -1.26 -4.42 135.00 126.21 2hgc s PRO 20 Ca 0.00 -0.82 -0.10 0.00 0.04 0.00 0.00 61.00 60.12 2hgc s PRO 20 Cb 0.00 -2.03 0.09 0.00 0.04 0.00 0.00 34.50 32.60 2hgc s PRO 20 CO 0.00 -2.17 0.52 -0.48 0.04 0.00 0.00 177.00 174.91 2hgc s LEU 21 N -5.64 -0.69 0.75 -3.56 2.34 -1.26 -5.04 118.68 105.58 2hgc s LEU 21 Ca 0.73 1.20 -0.11 0.00 0.06 0.00 0.00 54.13 56.01 2hgc s LEU 21 Cb -0.03 1.76 0.04 0.00 -0.56 0.00 0.00 46.19 47.40 2hgc s LEU 21 CO 0.50 -0.22 1.09 -0.44 -1.06 0.00 0.00 176.35 176.22 2hgc s SER 22 N 2.22 4.97 0.17 1.48 0.01 -1.26 -4.84 113.70 116.45 2hgc s SER 22 Ca -0.06 1.34 -0.13 0.00 1.31 0.00 0.00 55.95 58.41 2hgc s SER 22 Cb -0.10 -2.13 0.08 0.00 0.21 0.00 0.00 66.02 64.08 2hgc s SER 22 CO -0.16 -1.67 1.79 1.05 0.41 0.00 0.00 173.24 174.67 2hgc h GLU 23 N -0.88 0.80 0.00 12.44 -0.00 -1.92 0.28 114.58 125.31 2hgc h GLU 23 Ca -0.46 -0.09 0.00 0.00 -0.00 0.00 0.00 59.36 58.81 2hgc h GLU 23 Cb 1.25 -0.16 0.00 0.00 -0.00 0.00 0.00 28.75 29.84 2hgc h GLU 23 CO 0.60 0.61 0.00 -2.95 -0.00 0.00 0.00 179.01 177.27 2hgc h ASN 24 N 0.78 0.00 0.20 3.06 7.08 -1.93 0.15 115.58 124.92 2hgc h ASN 24 Ca 0.20 0.00 -0.27 0.00 -3.08 0.00 0.00 56.30 53.15 2hgc h ASN 24 Cb 0.04 0.00 0.03 0.00 -2.08 0.00 0.00 38.32 36.30 2hgc h ASN 24 CO -0.03 0.00 -1.22 -0.78 -2.08 0.00 0.00 177.43 173.32 2hgc h ASP 25 N 0.00 0.65 0.18 6.14 3.58 -1.57 -3.33 116.42 122.07 2hgc h ASP 25 Ca 0.00 -0.93 -0.28 0.00 0.42 0.00 0.00 57.03 56.24 2hgc h ASP 25 Cb 0.62 -0.21 0.02 0.00 1.72 0.00 0.00 39.33 41.47 2hgc h ASP 25 CO 0.00 1.58 -1.15 -0.29 -2.88 0.00 0.00 179.24 176.50 2hgc h ILE 26 N -0.10 1.32 0.00 2.25 2.10 -0.91 -3.48 117.51 118.69 2hgc h ILE 26 Ca -0.22 -2.46 0.00 0.00 1.08 0.00 0.00 64.86 63.26 2hgc h ILE 26 Cb 1.92 2.60 0.00 0.00 -1.09 0.00 0.00 36.82 40.25 2hgc h ILE 26 CO 0.21 0.75 0.00 0.61 -1.08 0.00 0.00 178.15 178.63 2hgc n GLY 27 N 1.25 1.41 3.31 8.18 0.00 -0.07 -5.11 105.19 114.16 2hgc n GLY 27 Ca -0.11 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.73 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 0.22 0.46 1.61 -7.23 0.33 -5.01 120.40 108.78 2hgc s VAL 28 Ca 0.00 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.07 2hgc s VAL 28 Cb 0.00 -2.50 -0.06 0.00 0.56 0.00 0.00 36.38 34.38 2hgc s VAL 28 CO 0.00 0.00 0.83 0.42 -0.31 0.00 0.00 175.10 176.04 2hgc s THR 29 N -3.65 4.77 0.27 5.32 -4.23 -1.26 -3.67 115.64 113.19 2hgc s THR 29 Ca 0.37 0.63 -0.01 0.00 -1.18 0.00 0.00 61.69 61.49 2hgc s THR 29 Cb 0.05 -3.78 0.26 0.00 1.34 0.00 0.00 72.50 70.37 2hgc s THR 29 CO 0.19 -0.68 1.84 -0.33 -0.54 0.00 0.00 174.62 175.09 2hgc h GLU 30 N 0.81 0.94 -0.40 3.99 5.08 -1.98 0.68 114.58 123.70 2hgc h GLU 30 Ca -0.47 -0.06 0.05 0.00 -1.00 0.00 0.00 59.36 57.88 2hgc h GLU 30 Cb 1.19 -0.21 -0.08 0.00 0.50 0.00 0.00 28.75 30.15 2hgc h GLU 30 CO 0.63 0.62 -0.52 -0.44 -1.00 0.00 0.00 179.01 178.30 2hgc h ASP 31 N 0.97 -1.75 0.35 1.42 3.32 -2.00 0.21 116.42 118.94 2hgc h ASP 31 Ca 0.45 0.23 -0.13 0.00 0.02 0.00 0.00 57.03 57.60 2hgc h ASP 31 Cb 0.38 0.72 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 2hgc h ASP 31 CO -0.24 -0.37 -0.55 1.56 -1.72 0.00 0.00 179.24 177.92 2hgc h GLN 32 N -0.36 0.22 0.70 3.56 4.20 -1.83 -2.72 115.11 118.87 2hgc h GLN 32 Ca 0.07 -0.14 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 2hgc h GLN 32 Cb 0.55 0.01 0.01 0.00 0.30 0.00 0.00 27.48 28.35 2hgc h GLN 32 CO -0.57 0.71 -0.34 0.35 -0.67 0.00 0.00 178.83 178.32 2hgc h PHE 33 N 0.17 -0.87 -0.67 2.96 3.57 -0.09 -0.22 116.94 121.79 2hgc h PHE 33 Ca 0.00 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.53 2hgc h PHE 33 Cb 1.02 0.29 -0.05 0.00 2.79 0.00 0.00 35.95 40.00 2hgc h PHE 33 CO 0.02 -0.52 0.38 -0.44 -2.23 0.00 0.00 178.31 175.52 2hgc h ASP 34 N -1.19 0.59 -0.47 0.41 5.19 -0.69 -0.08 116.42 120.17 2hgc h ASP 34 Ca -0.10 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.34 2hgc h ASP 34 Cb 0.74 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 40.13 2hgc h ASP 34 CO 0.16 0.38 0.30 -0.78 -3.12 0.00 0.00 179.24 176.18 2hgc h ASP 35 N 0.72 0.55 -0.12 6.45 3.58 -1.48 -1.98 116.42 124.14 2hgc h ASP 35 Ca 0.29 -0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.69 2hgc h ASP 35 Cb 0.15 -0.14 -0.00 0.00 1.72 0.00 0.00 39.33 41.06 2hgc h ASP 35 CO -0.16 0.42 0.01 0.00 -2.88 0.00 0.00 179.24 176.63 2hgc h ALA 36 N 1.16 0.17 -0.79 -0.78 0.00 -0.40 -2.06 119.26 116.56 2hgc h ALA 36 Ca 0.17 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2hgc h ALA 36 Cb -0.04 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2hgc h ALA 36 CO -0.03 -0.15 0.51 0.28 0.00 0.00 0.00 179.25 179.85 2hgc h VAL 37 N -0.04 1.15 -0.41 0.00 2.07 -0.93 0.30 116.25 118.40 2hgc h VAL 37 Ca 0.04 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 2hgc h VAL 37 Cb 0.34 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 2hgc h VAL 37 CO 0.00 0.18 0.15 0.78 0.02 0.00 0.00 177.57 178.71 2hgc h ASN 38 N 1.01 0.57 -0.65 0.57 2.35 -1.32 -1.96 115.58 116.15 2hgc h ASN 38 Ca 0.31 -0.18 -0.02 0.00 -0.55 0.00 0.00 56.30 55.86 2hgc h ASN 38 Cb -0.03 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.16 2hgc h ASN 38 CO -0.10 0.59 0.33 0.15 -1.65 0.00 0.00 177.43 176.75 2hgc h PHE 39 N 0.51 0.93 -0.73 1.19 3.57 -0.64 0.57 116.94 122.34 2hgc h PHE 39 Ca 0.13 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.62 2hgc h PHE 39 Cb 0.21 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 38.62 2hgc h PHE 39 CO 0.00 0.69 0.47 -0.07 -2.23 0.00 0.00 178.31 177.17 2hgc h LEU 40 N 0.90 0.79 -0.09 0.59 3.38 -0.15 0.28 115.31 121.00 2hgc h LEU 40 Ca 0.23 -0.01 -0.25 0.00 0.09 0.00 0.00 57.88 57.94 2hgc h LEU 40 Cb 0.10 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 40.68 2hgc h LEU 40 CO -0.03 0.55 -0.98 0.50 0.09 0.00 0.00 178.44 178.58 2hgc h LYS 41 N 0.93 0.60 -0.87 1.13 3.64 -1.16 0.12 116.57 120.96 2hgc h LYS 41 Ca 0.28 -0.62 -0.03 0.00 -1.27 0.00 0.00 60.65 59.01 2hgc h LYS 41 Cb -0.03 0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 31.92 2hgc h LYS 41 CO -0.09 1.23 0.43 -0.09 -2.27 0.00 0.00 179.45 178.66 2hgc h ARG 42 N 0.35 1.24 -0.00 1.90 1.12 -0.41 -1.14 114.38 117.44 2hgc h ARG 42 Ca -0.10 -0.17 0.00 0.00 -1.11 0.00 0.00 59.98 58.60 2hgc h ARG 42 Cb 1.62 -0.23 0.00 0.00 -0.01 0.00 0.00 29.97 31.35 2hgc h ARG 42 CO 0.18 0.94 -0.04 -1.91 -3.11 0.00 0.00 179.97 176.03 2hgc n GLU 43 N -4.31 0.63 -2.54 0.20 0.00 0.93 -4.92 120.64 110.64 2hgc n GLU 43 Ca 0.09 -0.10 -0.05 0.00 0.00 0.00 0.00 57.16 57.10 2hgc n GLU 43 Cb 0.13 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.08 2hgc n GLU 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2hgc n GLY 44 N 1.23 0.50 0.10 8.31 0.00 -0.43 -4.97 105.19 109.94 2hgc n GLY 44 Ca 0.16 -0.55 -0.19 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.41 0.21 -3.73 1.61 0.05 -0.98 -3.36 116.97 110.36 2hgc h TYR 45 Ca -0.12 -0.15 -0.26 0.00 0.05 0.00 0.00 58.73 58.25 2hgc h TYR 45 Cb 1.08 -0.01 -0.15 0.00 1.01 0.00 0.00 36.73 38.66 2hgc h TYR 45 CO 0.11 1.29 -0.69 0.96 -1.05 0.00 0.00 178.16 178.79 2hgc s ILE 46 N -2.35 0.76 0.40 -2.88 -0.00 -1.24 -1.82 121.20 114.08 2hgc s ILE 46 Ca -0.20 -1.97 0.04 0.00 -0.00 0.00 0.00 60.65 58.51 2hgc s ILE 46 Cb 0.01 -1.86 -0.03 0.00 -0.00 0.00 0.00 42.46 40.59 2hgc s ILE 46 CO 0.71 -0.72 0.12 0.27 -0.00 0.00 0.00 174.94 175.33 2hgc s ILE 47 N -3.59 0.64 0.00 8.37 -4.36 0.11 -4.36 121.20 118.01 2hgc s ILE 47 Ca 0.17 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.56 2hgc s ILE 47 Cb 0.05 -2.39 0.00 0.00 1.25 0.00 0.00 42.46 41.37 2hgc s ILE 47 CO -0.01 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.78 2hgc n GLY 48 N -0.89 0.70 3.67 6.27 0.00 -1.26 -0.25 105.19 113.45 2hgc n GLY 48 Ca -0.06 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 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 4.50 -0.19 1.61 1.01 -1.26 -3.41 120.40 120.66 2hgc s VAL 49 Ca 0.00 1.81 -0.09 0.00 0.00 0.00 0.00 61.98 63.70 2hgc s VAL 49 Cb 0.00 -4.17 -0.05 0.00 0.00 0.00 0.00 36.38 32.17 2hgc s VAL 49 CO 0.00 -0.11 0.09 -1.00 0.00 0.00 0.00 175.10 174.09 2hgc s HIS 50 N 2.94 3.32 -0.10 5.22 3.76 -1.17 -4.95 115.29 124.30 2hgc s HIS 50 Ca 0.50 0.19 0.02 0.00 -0.15 0.00 0.00 55.06 55.62 2hgc s HIS 50 Cb -0.19 -2.12 -0.01 0.00 1.11 0.00 0.00 32.58 31.36 2hgc s HIS 50 CO 0.13 0.21 -0.16 0.71 -0.85 0.00 0.00 174.74 174.78 2hgc s TYR 51 N 0.39 2.71 -0.51 1.40 1.51 -1.26 -0.52 117.35 121.07 2hgc s TYR 51 Ca 0.05 -0.61 0.02 0.00 -1.01 0.00 0.00 57.07 55.53 2hgc s TYR 51 Cb -0.12 -1.75 0.55 0.00 -0.11 0.00 0.00 41.96 40.53 2hgc s TYR 51 CO -0.01 -0.16 1.87 -1.13 -1.11 0.00 0.00 175.55 175.02 2hgc n SER 52 N 3.20 5.34 -3.65 2.29 3.41 -1.26 -4.90 113.62 118.05 2hgc n SER 52 Ca -0.18 -3.71 -0.28 0.00 -0.26 0.00 0.00 58.87 54.43 2hgc n SER 52 Cb 0.53 -0.84 0.04 0.00 -0.26 0.00 0.00 64.21 63.67 2hgc n SER 52 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2hgc n ASP 53 N -1.02 -4.80 0.00 4.04 2.03 -1.26 -4.83 116.55 110.71 2hgc n ASP 53 Ca 0.57 -0.96 0.00 0.00 0.52 0.00 0.00 54.79 54.92 2hgc n ASP 53 Cb 1.14 -3.63 0.00 0.00 -0.72 0.00 0.00 41.12 37.91 2hgc n ASP 53 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2hgc n ASP 54 N -2.79 0.00 -3.61 1.67 5.75 -1.26 -5.16 116.55 111.15 2hgc n ASP 54 Ca -0.12 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 54.64 2hgc n ASP 54 Cb 0.61 0.28 -0.01 0.00 -1.03 0.00 0.00 41.12 40.96 2hgc n ASP 54 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2hgc s ARG 55 N -1.67 0.25 0.07 0.11 1.70 -1.26 -5.14 118.95 113.02 2hgc s ARG 55 Ca 0.00 -0.11 -0.31 0.00 -0.47 0.00 0.00 55.73 54.84 2hgc s ARG 55 Cb 0.00 0.10 -0.08 0.00 -0.57 0.00 0.00 34.95 34.40 2hgc s ARG 55 CO 0.00 -0.11 1.57 -1.25 -1.08 0.00 0.00 175.30 174.43 2hgc s PRO 56 N -2.31 4.22 -0.11 3.89 0.04 -1.26 -4.10 135.00 135.37 2hgc s PRO 56 Ca 0.12 2.25 0.02 0.00 0.04 0.00 0.00 61.00 63.42 2hgc s PRO 56 Cb 0.01 -3.51 -0.01 0.00 0.04 0.00 0.00 34.50 31.03 2hgc s PRO 56 CO -0.04 -0.67 -0.18 -1.01 0.04 0.00 0.00 177.00 175.14 2hgc s HIS 57 N 2.29 2.68 -0.11 0.56 3.76 0.33 -5.01 115.29 119.79 2hgc s HIS 57 Ca 0.71 -0.80 -0.06 0.00 -0.15 0.00 0.00 55.06 54.76 2hgc s HIS 57 Cb -0.38 -1.77 -0.04 0.00 1.11 0.00 0.00 32.58 31.50 2hgc s HIS 57 CO 0.31 -0.28 0.12 -0.51 -0.85 0.00 0.00 174.74 173.53 2hgc s LEU 58 N 0.27 4.27 0.33 0.89 1.43 -1.26 -3.07 118.68 121.55 2hgc s LEU 58 Ca -0.13 0.42 0.06 0.00 -1.03 0.00 0.00 54.13 53.44 2hgc s LEU 58 Cb -0.16 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 43.97 2hgc s LEU 58 CO 0.07 0.40 0.23 -0.31 0.23 0.00 0.00 176.35 176.97 2hgc s TYR 59 N -1.02 1.71 -0.54 0.29 2.02 -1.26 -4.67 117.35 113.87 2hgc s TYR 59 Ca 0.15 -1.56 0.24 0.00 -0.37 0.00 0.00 57.07 55.53 2hgc s TYR 59 Cb -0.12 -0.79 0.53 0.00 -0.40 0.00 0.00 41.96 41.19 2hgc s TYR 59 CO 0.04 -0.74 1.68 0.87 -1.57 0.00 0.00 175.55 175.83 2hgc h LYS 60 N 2.12 0.00 -4.30 -0.62 1.57 -1.80 -3.37 116.57 110.17 2hgc h LYS 60 Ca -0.28 0.00 -0.74 0.00 -1.87 0.00 0.00 60.65 57.76 2hgc h LYS 60 Cb 1.24 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 33.31 2hgc h LYS 60 CO 0.42 0.00 -0.34 -0.51 -0.57 0.00 0.00 179.45 178.45 2hgc s LEU 61 N -5.58 5.63 0.00 2.94 2.01 -1.26 -4.66 118.68 117.77 2hgc s LEU 61 Ca 0.08 -1.46 0.00 0.00 0.01 0.00 0.00 54.13 52.76 2hgc s LEU 61 Cb 0.08 -2.14 0.00 0.00 0.01 0.00 0.00 46.19 44.14 2hgc s LEU 61 CO 0.64 -0.66 0.00 0.61 1.01 0.00 0.00 176.35 177.95 2hgc n GLY 62 N 5.14 1.99 3.68 -3.19 0.00 -1.26 -4.99 105.19 106.56 2hgc n GLY 62 Ca -0.12 -0.32 -0.58 0.00 0.00 0.00 0.00 46.02 45.00 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 1.00 -4.44 1.61 -0.02 -1.22 -4.09 135.00 127.84 2hgc n PRO 63 Ca 0.00 0.36 -0.20 0.00 -2.02 0.00 0.00 63.50 61.64 2hgc n PRO 63 Cb 0.00 -2.05 -0.14 0.00 -0.02 0.00 0.00 33.50 31.29 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 3.79 0.92 -0.04 -0.52 2.02 0.66 -4.96 118.70 120.57 2hgc s GLU 64 Ca 1.01 -0.55 -0.10 0.00 0.02 0.00 0.00 54.97 55.35 2hgc s GLU 64 Cb -1.11 -0.90 -0.05 0.00 0.10 0.00 0.00 34.13 32.17 2hgc s GLU 64 CO 0.66 0.24 0.28 -0.51 0.02 0.00 0.00 175.26 175.95 2hgc s LEU 65 N -0.63 4.42 0.45 1.80 1.02 -1.26 0.07 118.68 124.55 2hgc s LEU 65 Ca 0.03 0.69 0.08 0.00 0.02 0.00 0.00 54.13 54.95 2hgc s LEU 65 Cb -0.06 -2.41 0.02 0.00 0.02 0.00 0.00 46.19 43.77 2hgc s LEU 65 CO 0.00 0.34 0.59 0.42 0.02 0.00 0.00 176.35 177.73 2hgc s THR 66 N -1.11 2.79 0.40 5.49 -4.23 -0.75 -4.93 115.64 113.30 2hgc s THR 66 Ca 0.21 -1.03 0.08 0.00 -1.18 0.00 0.00 61.69 59.77 2hgc s THR 66 Cb -0.14 -2.83 0.21 0.00 1.34 0.00 0.00 72.50 71.09 2hgc s THR 66 CO 0.10 0.00 1.99 -0.08 -0.54 0.00 0.00 174.62 176.09 2hgc h GLU 67 N 0.59 0.38 0.20 3.99 4.81 -1.90 0.17 114.58 122.81 2hgc h GLU 67 Ca -0.38 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.79 2hgc h GLU 67 Cb 1.28 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.59 2hgc h GLU 67 CO 0.45 0.36 -0.10 -0.22 -0.73 0.00 0.00 179.01 178.77 2hgc h LYS 68 N 0.38 -0.26 -0.19 1.92 1.63 -1.85 -0.06 116.57 118.13 2hgc h LYS 68 Ca 0.09 0.02 -0.13 0.00 -0.85 0.00 0.00 60.65 59.78 2hgc h LYS 68 Cb 0.15 0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.83 2hgc h LYS 68 CO -0.00 -0.13 -0.42 0.78 -3.45 0.00 0.00 179.45 176.22 2hgc h GLY 69 N -0.32 0.50 0.94 5.01 0.00 -1.45 -2.26 103.07 105.48 2hgc h GLY 69 Ca -0.03 -0.50 -0.02 0.00 0.00 0.00 0.00 47.33 46.79 2hgc h GLY 69 CO 0.04 0.45 0.15 -2.09 0.00 0.00 0.00 176.54 175.09 2hgc h GLU 70 N 0.37 0.54 0.00 4.80 4.22 -0.53 -1.23 114.58 122.76 2hgc h GLU 70 Ca 0.03 -0.10 -0.00 0.00 0.08 0.00 0.00 59.36 59.37 2hgc h GLU 70 Cb 0.90 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.06 2hgc h GLU 70 CO 0.08 0.52 -0.02 -0.91 -2.18 0.00 0.00 179.01 176.50 2hgc h ASN 71 N 0.44 0.00 -0.11 1.04 2.35 -0.96 -2.05 115.58 116.30 2hgc h ASN 71 Ca 0.12 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.82 2hgc h ASN 71 Cb 0.18 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.55 2hgc h ASN 71 CO -0.01 0.02 -0.12 0.22 -1.65 0.00 0.00 177.43 175.89 2hgc h TYR 72 N 0.00 0.32 -0.24 1.19 3.20 -0.87 -3.13 116.97 117.44 2hgc h TYR 72 Ca -0.00 -0.10 -0.00 0.00 3.14 0.00 0.00 58.73 61.77 2hgc h TYR 72 Cb 0.68 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 2hgc h TYR 72 CO 0.00 0.70 0.15 -0.07 -1.64 0.00 0.00 178.16 177.29 2hgc h LEU 73 N -0.14 0.28 0.39 2.82 3.38 -0.92 0.10 115.31 121.23 2hgc h LEU 73 Ca 0.02 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2hgc h LEU 73 Cb 0.65 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 2hgc h LEU 73 CO 0.03 0.22 -0.31 0.50 0.09 0.00 0.00 178.44 178.97 2hgc h LYS 74 N 0.33 -0.67 0.05 1.13 3.64 -1.32 0.14 116.57 119.86 2hgc h LYS 74 Ca 0.09 0.05 -0.28 0.00 -1.27 0.00 0.00 60.65 59.24 2hgc h LYS 74 Cb -0.01 0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 2hgc h LYS 74 CO -0.02 -0.45 -1.46 1.05 -2.27 0.00 0.00 179.45 176.31 2hgc h GLU 75 N -0.70 0.10 0.00 1.90 4.11 -1.51 -3.19 114.58 115.29 2hgc h GLU 75 Ca -0.03 -0.17 0.00 0.00 0.07 0.00 0.00 59.36 59.23 2hgc h GLU 75 Cb 0.60 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.92 2hgc h GLU 75 CO -0.01 0.88 0.00 -1.71 0.07 0.00 0.00 179.01 178.25 2hgc n ASN 76 N -3.29 0.00 0.27 3.06 5.15 0.34 -3.28 115.26 117.51 2hgc n ASN 76 Ca -0.13 -1.28 0.18 0.00 -0.60 0.00 0.00 54.58 52.75 2hgc n ASN 76 Cb 1.02 0.00 0.84 0.00 -0.53 0.00 0.00 39.78 41.10 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 5.28 0.00 0.75 8.20 0.00 -0.70 -2.23 103.07 114.37 2hgc h GLY 77 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2hgc h GLY 77 CO 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 176.54 176.52 2hgc h THR 78 N 0.00 1.28 0.00 4.70 1.03 -1.80 -3.45 112.91 114.67 2hgc h THR 78 Ca 0.00 -0.93 0.00 0.00 -0.01 0.00 0.00 66.41 65.47 2hgc h THR 78 Cb 0.29 1.64 0.00 0.00 -1.07 0.00 0.00 68.15 69.00 2hgc h THR 78 CO 0.00 0.27 0.00 1.87 -0.01 0.00 0.00 175.52 177.65 2hgc n TRP 79 N -4.74 0.00 0.10 0.00 -0.00 -0.84 -3.06 117.44 108.89 2hgc n TRP 79 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.44 2hgc n TRP 79 Cb 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.55 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 1.22 -1.42 0.00 5.87 7.64 -1.26 -4.95 113.62 120.72 2hgc n SER 80 Ca 0.00 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.24 2hgc n SER 80 Cb 0.00 1.54 0.00 0.00 -1.01 0.00 0.00 64.21 64.74 2hgc n SER 80 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2hgc n LYS 81 N -2.94 0.00 0.00 1.43 4.81 -1.17 -5.25 118.16 115.03 2hgc n LYS 81 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2hgc n LYS 81 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2hgc n LYS 81 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57