#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g31 n ILE 2 N 0.00 1.79 0.01 0.55 2.08 -1.26 -4.77 119.36 117.77 2g31 n ILE 2 Ca 0.00 -4.00 0.02 0.00 0.56 0.00 0.00 62.75 59.33 2g31 n ILE 2 Cb 0.00 -0.33 -0.10 0.00 -0.75 0.00 0.00 39.64 38.46 2g31 n ILE 2 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2g31 n TYR 3 N -0.36 0.63 0.99 1.39 4.19 -1.26 -4.01 117.16 118.73 2g31 n TYR 3 Ca 0.26 0.20 0.10 0.00 3.31 0.00 0.00 57.90 61.78 2g31 n TYR 3 Cb 0.76 -0.94 -0.08 0.00 0.49 0.00 0.00 39.34 39.57 2g31 n TYR 3 CO 0.00 0.00 0.00 1.63 0.91 0.00 0.00 176.86 179.40 2g31 n LYS 4 N -2.72 0.47 0.30 2.98 5.02 -1.26 -4.29 118.16 118.66 2g31 n LYS 4 Ca -0.11 -0.35 0.14 0.00 -2.02 0.00 0.00 58.31 55.97 2g31 n LYS 4 Cb 0.80 -1.48 0.69 0.00 -0.02 0.00 0.00 35.03 35.02 2g31 n LYS 4 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2g31 h GLY 5 N 4.90 0.00 1.63 0.72 0.00 -1.89 0.96 103.07 109.39 2g31 h GLY 5 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 2g31 h GLY 5 CO 0.00 0.00 -0.47 -0.39 0.00 0.00 0.00 176.54 175.68 2g31 h VAL 6 N 0.00 1.32 0.00 4.60 -1.51 -1.84 -2.40 116.25 116.42 2g31 h VAL 6 Ca 0.03 -1.68 -0.06 0.00 -1.23 0.00 0.00 66.70 63.76 2g31 h VAL 6 Cb 0.93 1.72 -0.01 0.00 -2.13 0.00 0.00 31.29 31.81 2g31 h VAL 6 CO -0.00 0.51 -0.29 0.40 -1.23 0.00 0.00 177.57 176.97 2g31 h ILE 7 N 0.32 0.72 0.11 7.19 2.04 0.65 -0.64 117.51 127.91 2g31 h ILE 7 Ca 0.02 -1.25 -0.01 0.00 1.00 0.00 0.00 64.86 64.62 2g31 h ILE 7 Cb 0.95 1.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.84 2g31 h ILE 7 CO 0.08 0.28 -0.05 -0.61 0.00 0.00 0.00 178.15 177.85 2g31 h GLN 8 N 0.00 -0.15 -0.07 2.37 4.15 -1.27 0.11 115.11 120.26 2g31 h GLN 8 Ca -0.00 0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.37 2g31 h GLN 8 Cb 0.78 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.50 2g31 h GLN 8 CO 0.04 0.01 -0.18 0.00 -1.93 0.00 0.00 178.83 176.76 2g31 h ALA 9 N 0.60 0.11 -0.17 3.38 0.00 -1.47 0.22 119.26 121.92 2g31 h ALA 9 Ca -0.02 -0.37 0.05 0.00 0.00 0.00 0.00 54.91 54.57 2g31 h ALA 9 Cb 0.22 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2g31 h ALA 9 CO 0.03 0.05 0.30 0.82 0.00 0.00 0.00 179.25 180.44 2g31 h ILE 10 N -0.26 0.24 0.01 0.00 1.08 -1.09 1.13 117.51 118.61 2g31 h ILE 10 Ca -0.00 0.00 -0.26 0.00 -0.39 0.00 0.00 64.86 64.21 2g31 h ILE 10 Cb 0.80 0.74 -0.04 0.00 -3.07 0.00 0.00 36.82 35.25 2g31 h ILE 10 CO 0.04 0.00 -1.41 1.67 -0.69 0.00 0.00 178.15 177.76 2g31 n GLN 11 N -3.41 0.58 0.15 2.37 -0.06 0.39 -2.82 117.38 114.59 2g31 n GLN 11 Ca 0.02 0.53 0.05 0.00 -2.00 0.00 0.00 57.00 55.61 2g31 n GLN 11 Cb 0.40 -1.73 0.52 0.00 -4.06 0.00 0.00 30.24 25.37 2g31 n GLN 11 CO 0.00 0.00 0.00 -0.22 -0.20 0.00 0.00 177.06 176.64 2g31 h LYS 12 N -0.93 0.20 0.00 3.69 3.11 0.52 0.73 116.57 123.90 2g31 h LYS 12 Ca -0.38 -0.02 -0.08 0.00 -2.81 0.00 0.00 60.65 57.36 2g31 h LYS 12 Cb 1.38 -0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 32.56 2g31 h LYS 12 CO -0.21 0.19 -0.37 0.77 -2.81 0.00 0.00 179.45 177.03 2g31 h SER 13 N 0.20 0.00 0.75 4.20 0.02 0.11 1.42 113.55 120.26 2g31 h SER 13 Ca 0.05 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.81 2g31 h SER 13 Cb 0.09 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 2g31 h SER 13 CO -0.00 0.37 -0.90 -0.78 -1.14 0.00 0.00 176.83 174.38 2g31 h ASP 14 N 0.00 0.12 0.02 3.07 3.58 -0.78 -3.30 116.42 119.13 2g31 h ASP 14 Ca -0.00 -0.10 -0.33 0.00 0.42 0.00 0.00 57.03 57.01 2g31 h ASP 14 Cb 1.27 -0.04 -0.06 0.00 1.72 0.00 0.00 39.33 42.22 2g31 h ASP 14 CO 0.05 0.95 -2.33 -0.62 -2.88 0.00 0.00 179.24 174.40 2g31 n GLU 15 N -3.56 0.69 -3.30 0.28 1.02 -0.15 -5.04 120.64 110.58 2g31 n GLU 15 Ca -0.02 -0.02 -0.32 0.00 -0.02 0.00 0.00 57.16 56.78 2g31 n GLU 15 Cb 0.83 -1.53 0.03 0.00 -0.02 0.00 0.00 31.44 30.75 2g31 n GLU 15 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2g31 n GLY 16 N 1.70 -0.14 3.37 0.62 0.00 0.49 -4.97 105.19 106.27 2g31 n GLY 16 Ca -0.30 0.91 -0.26 0.00 0.00 0.00 0.00 46.02 46.37 2g31 n GLY 16 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2g31 s HIS 17 N -1.64 2.10 -0.05 1.61 4.02 -1.26 -5.07 115.29 115.01 2g31 s HIS 17 Ca 0.26 -0.40 -0.07 0.00 1.02 0.00 0.00 55.06 55.87 2g31 s HIS 17 Cb -0.03 -1.08 -0.04 0.00 -1.02 0.00 0.00 32.58 30.42 2g31 s HIS 17 CO 0.77 0.38 0.34 -1.00 1.02 0.00 0.00 174.74 176.25 2g31 h PRO 18 N 3.50 -0.24 0.00 8.40 0.13 -1.98 -3.23 132.00 138.58 2g31 h PRO 18 Ca -0.46 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2g31 h PRO 18 Cb 1.20 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2g31 h PRO 18 CO 0.45 -0.16 0.25 0.27 -0.23 0.00 0.00 178.00 178.59 2g31 h PHE 19 N -0.81 0.00 0.16 1.56 -5.15 -1.99 -0.90 116.94 109.81 2g31 h PHE 19 Ca -0.03 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.74 2g31 h PHE 19 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.36 2g31 h PHE 19 CO 0.01 0.00 -0.08 0.00 -2.00 0.00 0.00 178.31 176.25 2g31 h ARG 20 N 0.00 -0.21 -0.98 6.09 2.47 -1.99 -2.87 114.38 116.90 2g31 h ARG 20 Ca 0.00 0.01 0.06 0.00 -1.26 0.00 0.00 59.98 58.80 2g31 h ARG 20 Cb 0.50 0.05 -0.06 0.00 -1.65 0.00 0.00 29.97 28.81 2g31 h ARG 20 CO 0.00 0.06 0.63 0.00 0.56 0.00 0.00 179.97 181.22 2g31 h ALA 21 N 0.32 1.43 -0.31 0.04 0.00 -1.19 0.12 119.26 119.67 2g31 h ALA 21 Ca -0.02 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.95 2g31 h ALA 21 Cb 0.36 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2g31 h ALA 21 CO 0.04 0.42 0.31 1.88 0.00 0.00 0.00 179.25 181.90 2g31 h TYR 22 N 1.14 0.00 0.00 0.00 -1.99 -1.36 1.46 116.97 116.22 2g31 h TYR 22 Ca 0.42 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 61.14 2g31 h TYR 22 Cb 0.17 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.90 2g31 h TYR 22 CO -0.00 0.00 -0.06 -0.07 -0.00 0.00 0.00 178.16 178.03 2g31 h LEU 23 N 0.00 0.00 -2.00 3.88 3.38 -0.59 -2.93 115.31 117.05 2g31 h LEU 23 Ca 0.15 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 2g31 h LEU 23 Cb 0.76 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 2g31 h LEU 23 CO -0.00 0.69 -0.08 -0.33 0.09 0.00 0.00 178.44 178.80 2g31 h GLU 24 N -1.00 0.00 -0.17 1.13 4.39 -0.83 -0.99 114.58 117.11 2g31 h GLU 24 Ca -0.01 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.56 2g31 h GLU 24 Cb 0.36 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 2g31 h GLU 24 CO -0.01 0.08 -0.46 0.77 -1.16 0.00 0.00 179.01 178.24 2g31 h SER 25 N 0.00 0.44 0.36 1.42 0.02 0.19 -2.25 113.55 113.73 2g31 h SER 25 Ca -0.00 -0.21 -0.02 0.00 -0.84 0.00 0.00 61.79 60.72 2g31 h SER 25 Cb 0.17 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.58 2g31 h SER 25 CO 0.01 0.84 -0.10 -0.08 -1.14 0.00 0.00 176.83 176.37 2g31 h GLU 26 N 0.33 0.00 0.00 3.45 4.81 -0.98 -0.09 114.58 122.11 2g31 h GLU 26 Ca 0.02 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 2g31 h GLU 26 Cb 0.94 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.32 2g31 h GLU 26 CO 0.08 0.10 -0.07 0.28 -0.73 0.00 0.00 179.01 178.66 2g31 h VAL 27 N 0.00 0.66 -1.00 0.32 2.07 -1.36 -3.33 116.25 113.62 2g31 h VAL 27 Ca -0.00 -1.51 0.18 0.00 0.82 0.00 0.00 66.70 66.18 2g31 h VAL 27 Cb 0.30 1.27 -0.10 0.00 -1.52 0.00 0.00 31.29 31.24 2g31 h VAL 27 CO 0.01 0.22 0.61 0.00 0.02 0.00 0.00 177.57 178.44 2g31 h ALA 28 N -0.63 1.63 -0.51 1.67 0.00 -1.27 0.82 119.26 120.97 2g31 h ALA 28 Ca -0.01 0.07 0.15 0.00 0.00 0.00 0.00 54.91 55.11 2g31 h ALA 28 Cb 0.42 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2g31 h ALA 28 CO -0.01 0.00 0.55 0.97 0.00 0.00 0.00 179.25 180.77 2g31 h ILE 29 N 0.81 0.32 0.00 0.00 -0.00 -1.12 1.47 117.51 118.99 2g31 h ILE 29 Ca 0.56 0.00 -0.11 0.00 -0.00 0.00 0.00 64.86 65.31 2g31 h ILE 29 Cb 0.81 0.56 -0.02 0.00 -0.00 0.00 0.00 36.82 38.18 2g31 h ILE 29 CO -0.36 0.00 -0.53 0.28 -0.00 0.00 0.00 178.15 177.54 2g31 h SER 30 N 0.00 0.00 -0.16 2.19 0.02 0.57 -2.68 113.55 113.49 2g31 h SER 30 Ca 0.24 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.24 2g31 h SER 30 Cb 1.34 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.87 2g31 h SER 30 CO -0.00 0.53 0.19 -0.08 -1.14 0.00 0.00 176.83 176.33 2g31 h GLU 31 N 0.00 0.00 0.09 3.45 4.81 0.20 0.18 114.58 123.31 2g31 h GLU 31 Ca -0.01 0.00 -0.26 0.00 -0.13 0.00 0.00 59.36 58.97 2g31 h GLU 31 Cb 0.96 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.34 2g31 h GLU 31 CO 0.07 0.00 -1.17 1.49 -0.73 0.00 0.00 179.01 178.67 2g31 h GLU 32 N 0.00 0.21 -0.64 1.92 4.81 -1.53 -3.25 114.58 116.10 2g31 h GLU 32 Ca 0.08 -0.35 0.14 0.00 -0.13 0.00 0.00 59.36 59.09 2g31 h GLU 32 Cb 0.46 0.13 -0.11 0.00 0.63 0.00 0.00 28.75 29.86 2g31 h GLU 32 CO -0.00 1.16 0.01 -0.07 -0.73 0.00 0.00 179.01 179.38 2g31 h LEU 33 N 0.06 -0.27 -1.69 1.64 -0.00 -0.70 1.39 115.31 115.74 2g31 h LEU 33 Ca -0.10 0.16 -0.04 0.00 -0.00 0.00 0.00 57.88 57.90 2g31 h LEU 33 Cb 1.90 0.28 -0.01 0.00 -0.00 0.00 0.00 40.66 42.84 2g31 h LEU 33 CO 0.18 -0.12 -0.18 1.62 -0.00 0.00 0.00 178.44 179.95 2g31 h VAL 34 N 0.12 0.72 0.00 1.22 3.04 -1.62 -1.05 116.25 118.68 2g31 h VAL 34 Ca 0.34 -0.73 -0.04 0.00 -1.01 0.00 0.00 66.70 65.26 2g31 h VAL 34 Cb 0.55 1.45 -0.01 0.00 -2.01 0.00 0.00 31.29 31.28 2g31 h VAL 34 CO -0.55 0.17 -0.27 1.56 -1.01 0.00 0.00 177.57 177.48 2g31 h GLN 35 N 0.00 0.00 0.00 4.17 4.20 0.14 -3.13 115.11 120.49 2g31 h GLN 35 Ca -0.00 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.61 2g31 h GLN 35 Cb 0.44 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 2g31 h GLN 35 CO 0.02 0.15 -0.45 0.87 -0.67 0.00 0.00 178.83 178.76 2g31 h LYS 36 N 0.00 0.00 -0.04 1.46 1.57 0.19 -2.95 116.57 116.81 2g31 h LYS 36 Ca -0.01 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2g31 h LYS 36 Cb 1.13 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.44 2g31 h LYS 36 CO 0.02 0.45 0.05 -0.92 -0.57 0.00 0.00 179.45 178.48 2g31 h TYR 37 N 0.00 0.00 -0.06 -1.35 5.03 -1.44 1.70 116.97 120.85 2g31 h TYR 37 Ca -0.00 0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.27 2g31 h TYR 37 Cb 1.09 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.37 2g31 h TYR 37 CO 0.00 0.00 -0.12 0.77 -1.32 0.00 0.00 178.16 177.49 2g31 h SER 38 N 0.00 0.21 1.24 -2.11 0.02 -1.69 0.55 113.55 111.77 2g31 h SER 38 Ca 0.02 -0.56 -0.14 0.00 -0.84 0.00 0.00 61.79 60.27 2g31 h SER 38 Cb 0.12 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 2g31 h SER 38 CO -0.00 0.73 -0.79 0.78 -1.14 0.00 0.00 176.83 176.41 2g31 h ASN 39 N -0.31 0.00 1.32 3.07 4.21 -1.44 -3.22 115.58 119.22 2g31 h ASN 39 Ca 0.00 0.00 -0.14 0.00 1.21 0.00 0.00 56.30 57.38 2g31 h ASN 39 Cb 0.69 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.87 2g31 h ASN 39 CO 0.03 0.62 -0.65 0.28 -1.29 0.00 0.00 177.43 176.41 2g31 h SER 40 N 0.00 0.00 0.27 5.81 0.02 0.25 -2.99 113.55 116.92 2g31 h SER 40 Ca -0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 2g31 h SER 40 Cb 1.51 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.05 2g31 h SER 40 CO 0.07 0.65 0.00 0.00 -1.14 0.00 0.00 176.83 176.41 2g31 n ALA 41 N -2.27 1.72 -0.36 3.77 0.00 0.19 0.11 120.51 123.68 2g31 n ALA 41 Ca 0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 53.44 53.37 2g31 n ALA 41 Cb 0.79 -1.21 0.01 0.00 0.00 0.00 0.00 19.45 19.04 2g31 n ALA 41 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2g31 n LEU 42 N -1.32 -0.66 -0.03 0.00 -0.00 -1.13 -3.85 117.00 110.00 2g31 n LEU 42 Ca 0.06 1.59 -0.07 0.00 -0.00 0.00 0.00 56.01 57.59 2g31 n LEU 42 Cb 0.11 -0.33 -0.02 0.00 -0.00 0.00 0.00 43.42 43.17 2g31 n LEU 42 CO 0.10 -1.40 -0.62 0.61 -0.00 0.00 0.00 177.39 176.08 2g31 n GLY 43 N -1.39 -0.14 0.00 1.47 0.00 -1.23 -5.01 105.19 98.88 2g31 n GLY 43 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2g31 n GLY 43 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2g31 n HIS 44 N -3.47 0.00 -0.05 1.61 8.25 -1.21 -5.01 115.22 115.33 2g31 n HIS 44 Ca -0.13 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.34 2g31 n HIS 44 Cb 0.48 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.43 2g31 n HIS 44 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2g31 n VAL 45 N 0.00 0.66 0.23 1.59 0.31 0.12 -4.16 118.33 117.08 2g31 n VAL 45 Ca 0.00 -0.66 0.18 0.00 -0.01 0.00 0.00 64.34 63.85 2g31 n VAL 45 Cb 0.00 -0.22 0.86 0.00 -0.91 0.00 0.00 33.84 33.57 2g31 n VAL 45 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2g31 h ASN 46 N 0.00 0.00 0.93 4.52 7.08 -1.55 1.66 115.58 128.22 2g31 h ASN 46 Ca -0.26 0.00 -0.22 0.00 -3.08 0.00 0.00 56.30 52.74 2g31 h ASN 46 Cb 1.59 0.00 -0.03 0.00 -2.08 0.00 0.00 38.32 37.79 2g31 h ASN 46 CO 0.01 0.00 -1.11 0.00 -2.08 0.00 0.00 177.43 174.25 2g31 h THR 48 N 0.00 1.18 0.20 0.00 2.02 0.73 -3.16 112.91 113.88 2g31 h THR 48 Ca -0.06 -2.93 -0.31 0.00 0.77 0.00 0.00 66.41 63.88 2g31 h THR 48 Cb 1.79 2.65 0.02 0.00 -1.74 0.00 0.00 68.15 70.87 2g31 h THR 48 CO 0.12 0.74 -1.37 0.16 0.37 0.00 0.00 175.52 175.54 2g31 h ILE 49 N 0.02 1.37 0.63 3.11 -0.00 0.19 -2.87 117.51 119.96 2g31 h ILE 49 Ca -0.20 -2.83 -0.02 0.00 -0.00 0.00 0.00 64.86 61.81 2g31 h ILE 49 Cb 1.94 2.98 -0.01 0.00 -0.00 0.00 0.00 36.82 41.73 2g31 h ILE 49 CO 0.12 0.84 -0.49 0.11 -0.00 0.00 0.00 178.15 178.73 2g31 h LYS 50 N 0.13 -1.04 -0.05 0.16 1.79 -1.11 -0.81 116.57 115.64 2g31 h LYS 50 Ca -0.20 0.07 0.02 0.00 -2.18 0.00 0.00 60.65 58.35 2g31 h LYS 50 Cb 2.07 0.24 -0.00 0.00 -1.58 0.00 0.00 32.23 32.96 2g31 h LYS 50 CO 0.25 -0.69 0.09 1.05 -1.08 0.00 0.00 179.45 179.06 2g31 h GLU 51 N -1.08 0.00 -0.33 3.15 -0.00 -1.67 -2.20 114.58 112.44 2g31 h GLU 51 Ca -0.08 0.00 0.03 0.00 -0.00 0.00 0.00 59.36 59.31 2g31 h GLU 51 Cb 0.90 0.00 -0.05 0.00 -0.00 0.00 0.00 28.75 29.60 2g31 h GLU 51 CO 0.02 0.00 -0.28 1.25 -0.00 0.00 0.00 179.01 180.00 2g31 h LEU 52 N 0.00 -0.97 0.00 3.06 5.85 -0.90 0.11 115.31 122.46 2g31 h LEU 52 Ca 0.03 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.88 2g31 h LEU 52 Cb 0.21 0.41 0.00 0.00 0.37 0.00 0.00 40.66 41.65 2g31 h LEU 52 CO -0.00 -0.15 -0.08 -1.14 -0.34 0.00 0.00 178.44 176.73 2g31 n ARG 53 N -4.03 0.06 -0.27 1.25 0.00 -1.09 -4.48 116.66 108.09 2g31 n ARG 53 Ca -0.00 0.22 0.07 0.00 -0.00 0.00 0.00 57.85 58.14 2g31 n ARG 53 Cb 0.15 -0.81 0.20 0.00 0.00 0.00 0.00 32.46 31.99 2g31 n ARG 53 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 2g31 h ARG 54 N -0.13 0.16 -0.36 -0.14 9.65 -1.55 -3.44 114.38 118.57 2g31 h ARG 54 Ca 0.00 -0.01 -0.16 0.00 -1.10 0.00 0.00 59.98 58.71 2g31 h ARG 54 Cb 0.08 -0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 28.56 2g31 h ARG 54 CO 0.00 0.11 -0.14 -0.11 2.80 0.00 0.00 179.97 182.63 2g31 n LEU 55 N -5.27 -0.02 0.00 3.80 -0.00 0.38 -4.52 117.00 111.37 2g31 n LEU 55 Ca 0.16 0.19 0.00 0.00 -0.00 0.00 0.00 56.01 56.36 2g31 n LEU 55 Cb 0.53 -2.42 0.00 0.00 -0.00 0.00 0.00 43.42 41.53 2g31 n LEU 55 CO 0.07 -0.93 0.00 0.33 -0.00 0.00 0.00 177.39 176.86 2g31 n PHE 56 N -2.25 -0.11 -0.34 1.96 -0.00 -1.26 -4.88 117.46 110.58 2g31 n PHE 56 Ca -0.08 0.00 0.09 0.00 -0.00 0.00 0.00 57.45 57.46 2g31 n PHE 56 Cb 0.51 0.14 0.19 0.00 -0.00 0.00 0.00 39.48 40.32 2g31 n PHE 56 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.76 176.65 2g31 n LEU 57 N -1.78 -0.26 -3.10 -2.13 0.00 -1.26 -4.85 117.00 103.62 2g31 n LEU 57 Ca 0.00 1.66 -0.11 0.00 0.00 0.00 0.00 56.01 57.56 2g31 n LEU 57 Cb 0.00 -0.54 0.01 0.00 0.00 0.00 0.00 43.42 42.89 2g31 n LEU 57 CO 0.00 -1.62 -0.37 0.52 0.00 0.00 0.00 177.39 175.92 2g31 n VAL 58 N -5.53 -6.26 -3.05 1.96 0.31 -1.26 -4.15 118.33 100.35 2g31 n VAL 58 Ca 0.18 0.79 -0.00 0.00 -0.01 0.00 0.00 64.34 65.30 2g31 n VAL 58 Cb 0.58 -4.73 -0.00 0.00 -0.91 0.00 0.00 33.84 28.78 2g31 n VAL 58 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2g31 n ASP 59 N 0.57 -6.68 0.00 4.52 5.75 -1.24 -4.96 116.55 114.51 2g31 n ASP 59 Ca -0.00 0.75 0.00 0.00 -0.01 0.00 0.00 54.79 55.53 2g31 n ASP 59 Cb 0.42 -2.50 0.00 0.00 -1.03 0.00 0.00 41.12 38.01 2g31 n ASP 59 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42