#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 -3.80 0.03 5.15 5.41 -1.26 -4.86 119.36 120.03 2g31 n ILE 2 Ca 0.00 -0.40 0.02 0.00 1.00 0.00 0.00 62.75 63.37 2g31 n ILE 2 Cb 0.00 -3.08 -0.08 0.00 -0.71 0.00 0.00 39.64 35.78 2g31 n ILE 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2g31 n TYR 3 N -3.82 0.85 -2.43 1.39 9.36 -1.26 -4.28 117.16 116.96 2g31 n TYR 3 Ca -0.19 0.27 -0.40 0.00 3.32 0.00 0.00 57.90 60.90 2g31 n TYR 3 Cb 0.61 -1.01 0.02 0.00 -0.63 0.00 0.00 39.34 38.33 2g31 n TYR 3 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 2g31 n LYS 4 N -2.79 4.87 -1.10 2.98 5.02 -1.26 -4.69 118.16 121.20 2g31 n LYS 4 Ca -0.09 -4.31 -0.23 0.00 -2.02 0.00 0.00 58.31 51.66 2g31 n LYS 4 Cb 0.78 -2.45 0.13 0.00 -0.02 0.00 0.00 35.03 33.48 2g31 n LYS 4 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2g31 n GLY 5 N 0.07 4.49 0.11 0.72 0.00 -1.26 -3.86 105.19 105.46 2g31 n GLY 5 Ca 0.50 -1.22 -0.08 0.00 0.00 0.00 0.00 46.02 45.21 2g31 n GLY 5 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2g31 n VAL 6 N -0.83 0.66 0.09 1.61 0.24 -1.26 -3.91 118.33 114.93 2g31 n VAL 6 Ca 0.52 -0.25 0.02 0.00 -2.04 0.00 0.00 64.34 62.59 2g31 n VAL 6 Cb 1.27 -0.98 -0.03 0.00 -1.47 0.00 0.00 33.84 32.64 2g31 n VAL 6 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 2g31 h ILE 7 N -0.04 0.65 0.21 1.34 5.03 -1.98 -3.03 117.51 119.70 2g31 h ILE 7 Ca -0.26 -2.06 -0.30 0.00 -0.12 0.00 0.00 64.86 62.12 2g31 h ILE 7 Cb 1.39 2.19 0.03 0.00 -3.03 0.00 0.00 36.82 37.40 2g31 h ILE 7 CO -0.05 0.37 -1.35 -0.61 -0.68 0.00 0.00 178.15 175.83 2g31 h GLN 8 N 0.00 0.45 0.34 2.37 4.15 -1.81 -2.90 115.11 117.71 2g31 h GLN 8 Ca -0.08 -0.78 -0.02 0.00 0.77 0.00 0.00 58.65 58.55 2g31 h GLN 8 Cb 1.46 0.29 0.00 0.00 0.21 0.00 0.00 27.48 29.45 2g31 h GLN 8 CO 0.05 1.37 -0.16 0.00 -1.93 0.00 0.00 178.83 178.16 2g31 h ALA 9 N 0.12 -0.45 -0.09 3.38 0.00 -1.68 0.19 119.26 120.73 2g31 h ALA 9 Ca -0.24 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.57 2g31 h ALA 9 Cb 2.01 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.98 2g31 h ALA 9 CO 0.22 -0.72 0.11 0.82 0.00 0.00 0.00 179.25 179.69 2g31 h ILE 10 N -0.52 0.42 0.15 0.00 2.04 -1.66 -2.04 117.51 115.89 2g31 h ILE 10 Ca -0.05 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 2g31 h ILE 10 Cb 0.39 0.91 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 2g31 h ILE 10 CO 0.08 0.00 -0.07 1.56 0.00 0.00 0.00 178.15 179.72 2g31 h GLN 11 N 0.00 -0.19 -0.43 2.37 4.20 -1.04 -2.91 115.11 117.11 2g31 h GLN 11 Ca 0.04 0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.81 2g31 h GLN 11 Cb 0.27 0.04 -0.07 0.00 0.30 0.00 0.00 27.48 28.02 2g31 h GLN 11 CO -0.00 0.19 -0.47 0.87 -0.67 0.00 0.00 178.83 178.74 2g31 h LYS 12 N -0.95 -0.27 -0.39 1.46 1.57 0.02 1.75 116.57 119.76 2g31 h LYS 12 Ca -0.02 0.02 0.11 0.00 -1.87 0.00 0.00 60.65 58.89 2g31 h LYS 12 Cb 0.46 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 2g31 h LYS 12 CO 0.03 -0.18 0.50 0.77 -0.57 0.00 0.00 179.45 180.01 2g31 h SER 13 N -0.28 0.00 0.93 0.86 0.02 -1.57 1.85 113.55 115.37 2g31 h SER 13 Ca 0.07 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.84 2g31 h SER 13 Cb 0.47 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.98 2g31 h SER 13 CO -0.55 0.00 -1.15 -0.78 -1.14 0.00 0.00 176.83 173.21 2g31 h ASP 14 N 0.00 0.00 0.00 3.07 1.82 0.22 -3.29 116.42 118.24 2g31 h ASP 14 Ca 0.18 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.82 2g31 h ASP 14 Cb 1.18 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.19 2g31 h ASP 14 CO -0.00 0.71 -0.38 -0.08 -1.61 0.00 0.00 179.24 177.88 2g31 h GLU 15 N 0.00 0.00 -0.29 0.28 4.81 1.16 -3.41 114.58 117.13 2g31 h GLU 15 Ca -0.12 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.14 2g31 h GLU 15 Cb 1.64 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.99 2g31 h GLU 15 CO 0.07 0.00 -0.17 0.41 -0.73 0.00 0.00 179.01 178.59 2g31 n GLY 16 N 1.65 -2.61 3.54 1.92 0.00 0.51 -4.82 105.19 105.39 2g31 n GLY 16 Ca -0.05 0.69 -0.08 0.00 0.00 0.00 0.00 46.02 46.58 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 -3.80 -0.28 0.15 1.61 3.76 -1.24 -5.04 115.29 110.44 2g31 s HIS 17 Ca -0.03 0.25 -0.03 0.00 -0.15 0.00 0.00 55.06 55.09 2g31 s HIS 17 Cb 0.03 0.52 -0.04 0.00 1.11 0.00 0.00 32.58 34.20 2g31 s HIS 17 CO 0.18 -0.40 1.35 -1.00 -0.85 0.00 0.00 174.74 174.01 2g31 h PRO 18 N 2.10 0.40 -0.03 8.40 0.13 -1.86 -3.08 132.00 138.07 2g31 h PRO 18 Ca -0.18 -0.39 0.01 0.00 -0.87 0.00 0.00 66.00 64.57 2g31 h PRO 18 Cb 1.21 0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.44 2g31 h PRO 18 CO 0.28 1.05 0.39 0.74 -0.23 0.00 0.00 178.00 180.24 2g31 h PHE 19 N 0.24 0.00 -0.04 1.56 0.04 -1.96 0.39 116.94 117.17 2g31 h PHE 19 Ca -0.06 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.70 2g31 h PHE 19 Cb 1.48 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.62 2g31 h PHE 19 CO 0.05 0.00 -0.04 0.00 -0.60 0.00 0.00 178.31 177.72 2g31 h ARG 20 N 0.00 0.05 0.00 1.51 2.47 -1.80 -3.10 114.38 113.51 2g31 h ARG 20 Ca 0.01 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 2g31 h ARG 20 Cb 0.79 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.10 2g31 h ARG 20 CO -0.00 0.10 0.00 0.00 0.56 0.00 0.00 179.97 180.63 2g31 n ALA 21 N -2.52 -0.16 -0.20 0.04 0.00 0.14 0.14 120.51 117.94 2g31 n ALA 21 Ca -0.02 0.00 0.29 0.00 0.00 0.00 0.00 53.44 53.71 2g31 n ALA 21 Cb 0.14 0.33 0.57 0.00 0.00 0.00 0.00 19.45 20.49 2g31 n ALA 21 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2g31 h TYR 22 N 0.00 0.00 0.00 0.00 -1.99 -1.74 0.85 116.97 114.09 2g31 h TYR 22 Ca 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 2g31 h TYR 22 Cb 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.73 2g31 h TYR 22 CO -0.54 0.00 -0.04 1.25 -0.00 0.00 0.00 178.16 178.84 2g31 h LEU 23 N 0.00 0.00 -2.18 3.88 6.46 -0.13 -3.31 115.31 120.04 2g31 h LEU 23 Ca 0.47 -0.34 0.04 0.00 -0.12 0.00 0.00 57.88 57.93 2g31 h LEU 23 Cb 2.54 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 42.47 2g31 h LEU 23 CO -0.00 0.69 0.11 -0.08 -0.62 0.00 0.00 178.44 178.54 2g31 h GLU 24 N -1.00 0.00 0.12 1.25 4.81 0.55 -2.24 114.58 118.07 2g31 h GLU 24 Ca -0.01 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 2g31 h GLU 24 Cb 0.37 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.71 2g31 h GLU 24 CO -0.00 0.00 -0.33 1.03 -0.73 0.00 0.00 179.01 178.98 2g31 h SER 25 N 0.00 -0.95 -0.02 1.04 0.87 0.38 0.98 113.55 115.85 2g31 h SER 25 Ca 0.06 0.11 0.01 0.00 -1.23 0.00 0.00 61.79 60.73 2g31 h SER 25 Cb 0.28 0.36 -0.00 0.00 -0.44 0.00 0.00 62.40 62.60 2g31 h SER 25 CO -0.00 -0.42 0.03 -0.33 -0.53 0.00 0.00 176.83 175.58 2g31 h GLU 26 N -0.56 0.00 0.23 2.24 5.08 -1.49 1.06 114.58 121.16 2g31 h GLU 26 Ca 0.03 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.05 2g31 h GLU 26 Cb 0.59 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.87 2g31 h GLU 26 CO -0.19 0.00 -1.54 0.28 -1.00 0.00 0.00 179.01 176.55 2g31 h VAL 27 N 0.00 1.20 0.00 3.13 2.07 -0.70 -2.89 116.25 119.06 2g31 h VAL 27 Ca 0.01 -2.67 -0.09 0.00 0.82 0.00 0.00 66.70 64.76 2g31 h VAL 27 Cb 0.07 2.97 -0.01 0.00 -1.52 0.00 0.00 31.29 32.80 2g31 h VAL 27 CO -0.00 0.83 -0.45 0.00 0.02 0.00 0.00 177.57 177.97 2g31 h ALA 28 N 0.17 0.77 -0.01 1.67 0.00 0.26 -2.97 119.26 119.15 2g31 h ALA 28 Ca -0.28 -0.41 -0.13 0.00 0.00 0.00 0.00 54.91 54.10 2g31 h ALA 28 Cb 2.15 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.85 2g31 h ALA 28 CO 0.25 0.56 -0.59 0.97 0.00 0.00 0.00 179.25 180.44 2g31 h ILE 29 N 0.00 1.42 -0.02 0.00 -0.00 0.10 -2.84 117.51 116.17 2g31 h ILE 29 Ca -0.00 -2.02 -0.16 0.00 -0.00 0.00 0.00 64.86 62.68 2g31 h ILE 29 Cb 1.22 2.07 -0.02 0.00 -0.00 0.00 0.00 36.82 40.10 2g31 h ILE 29 CO 0.06 0.58 -0.73 0.28 -0.00 0.00 0.00 178.15 178.34 2g31 h SER 30 N 0.03 0.17 -0.44 2.19 0.02 -1.37 -2.99 113.55 111.16 2g31 h SER 30 Ca -0.01 -0.12 0.13 0.00 -0.84 0.00 0.00 61.79 60.96 2g31 h SER 30 Cb 1.06 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.53 2g31 h SER 30 CO 0.08 0.84 0.49 -0.08 -1.14 0.00 0.00 176.83 177.02 2g31 h GLU 31 N 0.09 0.00 -0.08 3.45 4.81 -1.35 0.48 114.58 121.99 2g31 h GLU 31 Ca -0.02 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 58.97 2g31 h GLU 31 Cb 1.29 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.68 2g31 h GLU 31 CO 0.11 0.00 -0.89 1.49 -0.73 0.00 0.00 179.01 178.99 2g31 h GLU 32 N 0.00 0.69 -0.84 1.92 4.81 -1.62 -3.18 114.58 116.35 2g31 h GLU 32 Ca 0.21 -0.64 0.15 0.00 -0.13 0.00 0.00 59.36 58.95 2g31 h GLU 32 Cb 1.20 0.16 -0.09 0.00 0.63 0.00 0.00 28.75 30.64 2g31 h GLU 32 CO -0.00 1.24 0.43 -0.07 -0.73 0.00 0.00 179.01 179.87 2g31 h LEU 33 N 0.43 0.51 -2.67 1.64 -0.00 -0.15 1.24 115.31 116.31 2g31 h LEU 33 Ca -0.08 0.09 -0.00 0.00 -0.00 0.00 0.00 57.88 57.89 2g31 h LEU 33 Cb 1.52 0.02 -0.00 0.00 -0.00 0.00 0.00 40.66 42.20 2g31 h LEU 33 CO 0.17 0.21 -0.01 0.58 -0.00 0.00 0.00 178.44 179.40 2g31 h VAL 34 N 0.61 0.21 0.00 1.22 2.07 -1.50 0.12 116.25 118.97 2g31 h VAL 34 Ca 0.46 -0.07 -0.18 0.00 0.82 0.00 0.00 66.70 67.73 2g31 h VAL 34 Cb 0.65 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2g31 h VAL 34 CO -0.37 0.01 -1.19 -0.61 0.02 0.00 0.00 177.57 175.43 2g31 h GLN 35 N 0.00 0.00 0.00 1.57 4.15 0.14 -3.27 115.11 117.70 2g31 h GLN 35 Ca -0.00 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.35 2g31 h GLN 35 Cb 0.05 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.73 2g31 h GLN 35 CO 0.00 0.49 -0.33 -0.22 -1.93 0.00 0.00 178.83 176.84 2g31 h LYS 36 N 0.00 0.00 -0.62 1.69 3.64 0.96 -2.98 116.57 119.26 2g31 h LYS 36 Ca -0.12 0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.37 2g31 h LYS 36 Cb 1.65 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.44 2g31 h LYS 36 CO 0.07 0.33 0.42 0.10 -2.27 0.00 0.00 179.45 178.10 2g31 h TYR 37 N 0.00 0.37 -0.47 1.91 -0.00 -1.41 1.60 116.97 118.98 2g31 h TYR 37 Ca -0.00 0.01 -0.05 0.00 -0.00 0.00 0.00 58.73 58.68 2g31 h TYR 37 Cb 0.92 -0.12 -0.02 0.00 -0.00 0.00 0.00 36.73 37.51 2g31 h TYR 37 CO 0.00 0.17 0.08 1.03 -0.00 0.00 0.00 178.16 179.44 2g31 h SER 38 N 0.34 0.75 1.26 0.10 0.87 -1.71 1.51 113.55 116.67 2g31 h SER 38 Ca 0.29 -0.26 -0.13 0.00 -1.23 0.00 0.00 61.79 60.47 2g31 h SER 38 Cb 0.68 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.42 2g31 h SER 38 CO -0.07 0.81 -0.76 -1.13 -0.53 0.00 0.00 176.83 175.15 2g31 h ASN 39 N 0.65 0.00 0.99 6.23 -1.24 -1.20 -3.24 115.58 117.77 2g31 h ASN 39 Ca 0.14 0.00 -0.21 0.00 0.71 0.00 0.00 56.30 56.94 2g31 h ASN 39 Cb 0.38 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.40 2g31 h ASN 39 CO 0.01 0.56 -1.01 0.28 -1.29 0.00 0.00 177.43 175.98 2g31 h SER 40 N 0.00 0.00 -0.14 1.15 0.02 0.25 -3.16 113.55 111.67 2g31 h SER 40 Ca -0.04 -0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.95 2g31 h SER 40 Cb 1.46 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.00 2g31 h SER 40 CO 0.07 1.00 0.47 0.00 -1.14 0.00 0.00 176.83 177.23 2g31 h ALA 41 N 1.00 1.67 -1.62 3.77 0.00 0.21 -0.25 119.26 124.04 2g31 h ALA 41 Ca -0.01 -0.01 0.51 0.00 0.00 0.00 0.00 54.91 55.40 2g31 h ALA 41 Cb 1.77 0.01 -0.11 0.00 0.00 0.00 0.00 17.79 19.46 2g31 h ALA 41 CO 0.13 -0.55 1.11 -0.07 0.00 0.00 0.00 179.25 179.87 2g31 h LEU 42 N 0.00 0.12 -5.55 0.00 -0.00 -1.72 -2.03 115.31 106.13 2g31 h LEU 42 Ca 0.07 0.09 -0.38 0.00 -0.00 0.00 0.00 57.88 57.66 2g31 h LEU 42 Cb 1.02 0.09 -0.29 0.00 -0.00 0.00 0.00 40.66 41.48 2g31 h LEU 42 CO -0.00 -0.14 -0.85 0.61 -0.00 0.00 0.00 178.44 178.05 2g31 n GLY 43 N -1.69 2.15 3.79 0.83 0.00 -0.22 -4.95 105.19 105.10 2g31 n GLY 43 Ca 0.42 -0.90 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 2g31 n GLY 43 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2g31 n HIS 44 N 0.51 -1.11 0.08 1.61 -0.00 -0.76 -4.71 115.22 110.83 2g31 n HIS 44 Ca 0.16 0.49 0.02 0.00 0.46 0.00 0.00 57.72 58.85 2g31 n HIS 44 Cb 0.66 -1.46 -0.04 0.00 -0.12 0.00 0.00 29.99 29.03 2g31 n HIS 44 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 2g31 h VAL 45 N -0.62 0.59 -0.92 3.57 2.07 -1.47 -3.31 116.25 116.16 2g31 h VAL 45 Ca -0.43 -2.00 0.08 0.00 0.82 0.00 0.00 66.70 65.17 2g31 h VAL 45 Cb 1.13 2.13 -0.07 0.00 -1.52 0.00 0.00 31.29 32.97 2g31 h VAL 45 CO 0.64 0.34 0.57 -0.55 0.02 0.00 0.00 177.57 178.59 2g31 h ASN 46 N 0.00 0.88 1.03 0.57 7.08 -1.75 0.83 115.58 124.23 2g31 h ASN 46 Ca -0.09 0.03 -0.01 0.00 -3.08 0.00 0.00 56.30 53.14 2g31 h ASN 46 Cb 1.47 -0.16 -0.00 0.00 -2.08 0.00 0.00 38.32 37.55 2g31 h ASN 46 CO 0.05 0.54 -0.03 0.00 -2.08 0.00 0.00 177.43 175.91 2g31 h THR 48 N 0.00 1.14 0.09 0.00 2.02 0.08 -2.85 112.91 113.39 2g31 h THR 48 Ca -0.00 -2.72 -0.19 0.00 0.77 0.00 0.00 66.41 64.27 2g31 h THR 48 Cb 0.56 2.83 0.00 0.00 -1.74 0.00 0.00 68.15 69.79 2g31 h THR 48 CO 0.00 0.83 -0.91 0.16 0.37 0.00 0.00 175.52 175.97 2g31 h ILE 49 N 0.09 1.33 -0.65 3.11 -0.00 0.68 -3.22 117.51 118.85 2g31 h ILE 49 Ca -0.27 -2.41 0.09 0.00 -0.00 0.00 0.00 64.86 62.27 2g31 h ILE 49 Cb 2.07 2.95 -0.07 0.00 -0.00 0.00 0.00 36.82 41.77 2g31 h ILE 49 CO 0.19 0.64 0.30 0.11 -0.00 0.00 0.00 178.15 179.40 2g31 h LYS 50 N -0.55 0.52 0.00 0.16 1.57 0.13 0.86 116.57 119.26 2g31 h LYS 50 Ca -0.20 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 2g31 h LYS 50 Cb 1.52 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.71 2g31 h LYS 50 CO 0.05 0.34 0.00 1.49 -0.57 0.00 0.00 179.45 180.76 2g31 h GLU 51 N 0.53 0.00 0.08 3.15 4.22 -1.62 1.29 114.58 122.24 2g31 h GLU 51 Ca 0.32 0.00 -0.37 0.00 0.08 0.00 0.00 59.36 59.39 2g31 h GLU 51 Cb 0.33 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.54 2g31 h GLU 51 CO -0.26 0.00 -2.17 -0.11 -2.18 0.00 0.00 179.01 174.29 2g31 n LEU 52 N -2.67 2.68 -0.01 1.64 7.94 0.19 -3.34 117.00 123.42 2g31 n LEU 52 Ca -0.01 0.09 -0.00 0.00 -1.11 0.00 0.00 56.01 54.98 2g31 n LEU 52 Cb 0.12 -1.00 -0.00 0.00 0.53 0.00 0.00 43.42 43.08 2g31 n LEU 52 CO 0.18 0.87 -0.02 -0.09 -1.11 0.00 0.00 177.39 177.22 2g31 h ARG 53 N 0.04 0.00 0.07 1.96 1.12 0.13 -3.42 114.38 114.29 2g31 h ARG 53 Ca -0.48 0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.39 2g31 h ARG 53 Cb 1.99 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.95 2g31 h ARG 53 CO 0.03 0.00 -0.03 -0.09 -3.11 0.00 0.00 179.97 176.76 2g31 h ARG 54 N -0.20 -0.09 0.00 0.20 1.12 0.11 -3.48 114.38 112.04 2g31 h ARG 54 Ca 0.00 0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.88 2g31 h ARG 54 Cb 0.03 0.02 0.00 0.00 -0.01 0.00 0.00 29.97 30.01 2g31 h ARG 54 CO 0.00 0.47 0.00 -0.11 -3.11 0.00 0.00 179.97 177.22 2g31 n LEU 55 N -4.83 0.00 0.00 3.80 -0.00 0.20 -4.75 117.00 111.43 2g31 n LEU 55 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.93 2g31 n LEU 55 Cb 0.30 -0.31 0.00 0.00 -0.00 0.00 0.00 43.42 43.41 2g31 n LEU 55 CO 0.29 0.00 0.00 0.33 -0.00 0.00 0.00 177.39 178.01 2g31 n PHE 56 N -2.63 -0.63 -0.34 1.96 7.35 -1.26 -4.91 117.46 117.00 2g31 n PHE 56 Ca 0.00 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.81 2g31 n PHE 56 Cb 0.00 0.19 0.25 0.00 0.35 0.00 0.00 39.48 40.27 2g31 n PHE 56 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 2g31 h LEU 57 N 0.00 -0.55 -3.68 -2.13 6.46 -1.81 -3.45 115.31 110.15 2g31 h LEU 57 Ca 0.00 0.28 -0.46 0.00 -0.12 0.00 0.00 57.88 57.58 2g31 h LEU 57 Cb 0.00 0.50 0.01 0.00 -0.73 0.00 0.00 40.66 40.43 2g31 h LEU 57 CO 0.00 -0.33 -1.15 0.52 -0.62 0.00 0.00 178.44 176.86 2g31 n VAL 58 N -5.50 -3.39 0.00 1.05 0.31 -1.26 -0.23 118.33 109.30 2g31 n VAL 58 Ca 0.21 0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.56 2g31 n VAL 58 Cb 0.69 -3.05 0.00 0.00 -0.91 0.00 0.00 33.84 30.56 2g31 n VAL 58 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2g31 n ASP 59 N -1.74 0.00 0.00 4.52 -0.08 -1.24 -4.73 116.55 113.28 2g31 n ASP 59 Ca -0.24 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.04 2g31 n ASP 59 Cb 0.69 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.15 2g31 n ASP 59 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65