#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 2.97 -0.05 5.15 -5.35 -1.26 -4.15 119.36 116.67 2g31 n ILE 2 Ca 0.00 -2.02 -0.19 0.00 -0.27 0.00 0.00 62.75 60.27 2g31 n ILE 2 Cb 0.00 -1.35 -0.13 0.00 -1.74 0.00 0.00 39.64 36.42 2g31 n ILE 2 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2g31 n TYR 3 N 0.26 0.76 -0.11 4.28 4.02 -1.26 -4.98 117.16 120.13 2g31 n TYR 3 Ca 0.37 0.17 0.00 0.00 -0.01 0.00 0.00 57.90 58.43 2g31 n TYR 3 Cb 0.58 -1.10 0.00 0.00 -0.02 0.00 0.00 39.34 38.80 2g31 n TYR 3 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 2g31 n LYS 4 N -3.37 3.11 0.00 -0.72 0.00 -1.26 -4.80 118.16 111.12 2g31 n LYS 4 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 57.95 2g31 n LYS 4 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 36.06 2g31 n LYS 4 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2g31 n GLY 5 N 5.00 2.86 0.10 2.58 0.00 -1.26 -4.68 105.19 109.80 2g31 n GLY 5 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.00 0.52 0.25 1.61 0.24 -1.26 -4.52 118.33 113.17 2g31 n VAL 6 Ca 0.00 -0.19 0.17 0.00 -2.04 0.00 0.00 64.34 62.27 2g31 n VAL 6 Cb 0.00 -0.89 0.88 0.00 -1.47 0.00 0.00 33.84 32.35 2g31 n VAL 6 CO 0.00 0.00 0.00 0.16 -2.14 0.00 0.00 176.83 174.85 2g31 h ILE 7 N -0.03 0.46 0.52 1.34 3.07 -1.90 -0.36 117.51 120.60 2g31 h ILE 7 Ca -0.21 0.00 -0.03 0.00 1.55 0.00 0.00 64.86 66.18 2g31 h ILE 7 Cb 1.31 0.90 0.01 0.00 -0.27 0.00 0.00 36.82 38.76 2g31 h ILE 7 CO -0.04 0.00 -0.25 -0.61 -1.05 0.00 0.00 178.15 176.20 2g31 h GLN 8 N 0.00 -0.67 0.01 0.16 4.15 -1.94 -0.47 115.11 116.35 2g31 h GLN 8 Ca 0.05 0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.51 2g31 h GLN 8 Cb 0.29 0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.13 2g31 h GLN 8 CO -0.00 -0.41 -0.01 0.00 -1.93 0.00 0.00 178.83 176.48 2g31 h ALA 9 N -0.32 -0.02 -0.31 3.38 0.00 -1.59 -2.10 119.26 118.30 2g31 h ALA 9 Ca -0.07 -0.15 0.09 0.00 0.00 0.00 0.00 54.91 54.78 2g31 h ALA 9 Cb 0.57 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2g31 h ALA 9 CO 0.12 -0.37 0.53 0.82 0.00 0.00 0.00 179.25 180.35 2g31 h ILE 10 N -0.31 0.18 -0.19 0.00 2.04 -1.08 1.09 117.51 119.23 2g31 h ILE 10 Ca -0.00 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.72 2g31 h ILE 10 Cb 0.30 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 2g31 h ILE 10 CO 0.00 0.00 -0.47 -0.61 0.00 0.00 0.00 178.15 177.07 2g31 h GLN 11 N 0.00 0.50 -0.72 2.37 4.15 -0.35 -0.38 115.11 120.68 2g31 h GLN 11 Ca 0.15 -0.28 -0.01 0.00 0.77 0.00 0.00 58.65 59.27 2g31 h GLN 11 Cb 1.21 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.88 2g31 h GLN 11 CO -0.00 0.86 0.39 0.87 -1.93 0.00 0.00 178.83 179.03 2g31 h LYS 12 N 0.40 0.99 0.00 1.69 1.79 0.13 1.48 116.57 123.05 2g31 h LYS 12 Ca 0.02 -0.11 -0.07 0.00 -2.18 0.00 0.00 60.65 58.32 2g31 h LYS 12 Cb 0.97 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 31.41 2g31 h LYS 12 CO 0.09 0.72 -0.41 1.03 -1.08 0.00 0.00 179.45 179.80 2g31 h SER 13 N 1.00 0.00 1.09 0.86 0.87 -1.40 0.77 113.55 116.73 2g31 h SER 13 Ca 0.25 0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.69 2g31 h SER 13 Cb 0.02 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 2g31 h SER 13 CO -0.04 0.33 -0.96 -0.78 -0.53 0.00 0.00 176.83 174.85 2g31 h ASP 14 N 0.00 0.00 0.03 6.23 3.58 0.27 -3.33 116.42 123.20 2g31 h ASP 14 Ca -0.01 0.00 -0.18 0.00 0.42 0.00 0.00 57.03 57.26 2g31 h ASP 14 Cb 1.26 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.28 2g31 h ASP 14 CO 0.04 0.50 -2.15 -0.62 -2.88 0.00 0.00 179.24 174.13 2g31 n GLU 15 N -3.03 0.67 -1.05 0.28 -0.58 0.50 -4.36 120.64 113.07 2g31 n GLU 15 Ca -0.04 -0.09 -0.20 0.00 -0.42 0.00 0.00 57.16 56.41 2g31 n GLU 15 Cb 0.77 -1.53 0.02 0.00 -0.57 0.00 0.00 31.44 30.12 2g31 n GLU 15 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2g31 n GLY 16 N 1.49 4.22 3.40 0.62 0.00 0.27 -4.85 105.19 110.33 2g31 n GLY 16 Ca -0.18 -1.32 -0.42 0.00 0.00 0.00 0.00 46.02 44.10 2g31 n GLY 16 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2g31 s HIS 17 N -1.84 3.25 0.75 1.61 -3.43 -1.26 -4.89 115.29 109.48 2g31 s HIS 17 Ca 0.39 -0.87 -0.11 0.00 -0.80 0.00 0.00 55.06 53.67 2g31 s HIS 17 Cb 0.29 -2.55 0.04 0.00 -1.43 0.00 0.00 32.58 28.92 2g31 s HIS 17 CO -0.05 -0.65 1.08 -1.25 -2.00 0.00 0.00 174.74 171.87 2g31 s PRO 18 N 1.59 2.47 0.62 -0.38 0.04 -1.26 -4.83 135.00 133.26 2g31 s PRO 18 Ca 0.03 0.78 0.24 0.00 0.04 0.00 0.00 61.00 62.09 2g31 s PRO 18 Cb -0.20 -1.95 1.13 0.00 0.04 0.00 0.00 34.50 33.52 2g31 s PRO 18 CO 0.08 -1.38 1.59 0.74 0.04 0.00 0.00 177.00 178.07 2g31 h PHE 19 N -0.92 0.00 0.18 0.56 -1.00 -1.98 0.30 116.94 114.08 2g31 h PHE 19 Ca -0.46 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.32 2g31 h PHE 19 Cb 1.24 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.80 2g31 h PHE 19 CO 0.53 0.00 -0.09 0.00 -1.61 0.00 0.00 178.31 177.15 2g31 h ARG 20 N 0.00 -0.23 0.00 1.51 3.08 -1.99 0.76 114.38 117.50 2g31 h ARG 20 Ca 0.22 0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.27 2g31 h ARG 20 Cb 1.71 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.81 2g31 h ARG 20 CO -0.00 0.01 -0.09 0.00 -1.07 0.00 0.00 179.97 178.82 2g31 h ALA 21 N 0.32 1.34 0.00 0.04 0.00 -0.76 0.05 119.26 120.24 2g31 h ALA 21 Ca -0.02 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 2g31 h ALA 21 Cb 0.35 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2g31 h ALA 21 CO 0.04 0.11 -0.67 -0.92 0.00 0.00 0.00 179.25 177.81 2g31 h TYR 22 N 0.00 0.00 0.00 0.00 5.03 -0.93 -2.23 116.97 118.85 2g31 h TYR 22 Ca -0.00 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.30 2g31 h TYR 22 Cb 0.25 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.53 2g31 h TYR 22 CO 0.00 0.67 -0.05 1.25 -1.32 0.00 0.00 178.16 178.71 2g31 h LEU 23 N 0.00 0.00 -2.17 2.82 7.12 0.65 -3.23 115.31 120.51 2g31 h LEU 23 Ca -0.01 -0.41 0.05 0.00 0.13 0.00 0.00 57.88 57.65 2g31 h LEU 23 Cb 1.43 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.56 2g31 h LEU 23 CO 0.09 0.73 0.15 -0.08 -0.13 0.00 0.00 178.44 179.20 2g31 h GLU 24 N -1.00 0.00 0.54 1.25 4.81 -1.18 -2.03 114.58 116.98 2g31 h GLU 24 Ca -0.01 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 2g31 h GLU 24 Cb 0.45 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.83 2g31 h GLU 24 CO -0.01 0.00 -0.26 1.03 -0.73 0.00 0.00 179.01 179.04 2g31 h SER 25 N 0.00 -0.62 -0.37 1.04 0.87 -1.48 0.39 113.55 113.38 2g31 h SER 25 Ca 0.08 0.01 0.11 0.00 -1.23 0.00 0.00 61.79 60.76 2g31 h SER 25 Cb 0.38 0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 2g31 h SER 25 CO -0.00 -0.42 0.41 -0.33 -0.53 0.00 0.00 176.83 175.96 2g31 h GLU 26 N -0.76 0.00 0.03 2.24 5.08 -1.38 0.96 114.58 120.75 2g31 h GLU 26 Ca -0.07 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 2g31 h GLU 26 Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 2g31 h GLU 26 CO 0.12 0.00 -0.38 0.28 -1.00 0.00 0.00 179.01 178.04 2g31 h VAL 27 N 0.00 1.60 0.00 3.13 2.07 -1.17 -2.59 116.25 119.29 2g31 h VAL 27 Ca 0.17 -2.37 -0.02 0.00 0.82 0.00 0.00 66.70 65.30 2g31 h VAL 27 Cb 1.00 3.19 -0.00 0.00 -1.52 0.00 0.00 31.29 33.96 2g31 h VAL 27 CO -0.00 0.60 -0.09 0.00 0.02 0.00 0.00 177.57 178.10 2g31 h ALA 28 N -0.04 1.17 0.00 1.67 0.00 0.19 -1.04 119.26 121.21 2g31 h ALA 28 Ca -0.08 -0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.54 2g31 h ALA 28 Cb 1.20 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 2g31 h ALA 28 CO 0.01 0.11 -0.97 0.97 0.00 0.00 0.00 179.25 179.37 2g31 h ILE 29 N 0.00 1.69 0.00 0.00 -0.00 0.79 -3.12 117.51 116.87 2g31 h ILE 29 Ca -0.00 -3.30 -0.03 0.00 -0.00 0.00 0.00 64.86 61.53 2g31 h ILE 29 Cb 0.35 2.78 -0.00 0.00 -0.00 0.00 0.00 36.82 39.95 2g31 h ILE 29 CO 0.01 0.94 -0.13 0.28 -0.00 0.00 0.00 178.15 179.25 2g31 h SER 30 N 0.00 0.00 0.36 2.19 0.02 -0.77 -0.98 113.55 114.38 2g31 h SER 30 Ca -0.01 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 2g31 h SER 30 Cb 1.71 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.24 2g31 h SER 30 CO 0.13 0.13 -0.13 -0.33 -1.14 0.00 0.00 176.83 175.49 2g31 h GLU 31 N 0.00 0.00 0.00 3.45 4.39 -1.46 -1.23 114.58 119.73 2g31 h GLU 31 Ca -0.00 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 2g31 h GLU 31 Cb 0.32 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 2g31 h GLU 31 CO 0.02 0.13 -0.74 0.93 -1.16 0.00 0.00 179.01 178.19 2g31 h GLU 32 N 0.00 0.00 -0.10 2.33 5.08 -1.32 -3.19 114.58 117.37 2g31 h GLU 32 Ca -0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2g31 h GLU 32 Cb 0.34 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2g31 h GLU 32 CO 0.02 0.25 0.03 -0.07 -1.00 0.00 0.00 179.01 178.24 2g31 h LEU 33 N 0.00 0.04 -1.26 1.33 -0.00 -1.09 1.63 115.31 115.96 2g31 h LEU 33 Ca -0.04 0.01 -0.07 0.00 -0.00 0.00 0.00 57.88 57.77 2g31 h LEU 33 Cb 1.28 0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 41.94 2g31 h LEU 33 CO 0.03 0.04 -0.34 1.62 -0.00 0.00 0.00 178.44 179.79 2g31 h VAL 34 N 0.08 1.06 0.00 1.22 3.04 -1.65 -1.83 116.25 118.17 2g31 h VAL 34 Ca 0.04 -1.26 0.00 0.00 -1.01 0.00 0.00 66.70 64.47 2g31 h VAL 34 Cb 0.02 1.72 0.00 0.00 -2.01 0.00 0.00 31.29 31.02 2g31 h VAL 34 CO -0.04 0.34 -0.24 1.56 -1.01 0.00 0.00 177.57 178.18 2g31 h GLN 35 N 0.00 0.00 0.00 4.17 4.20 -1.23 -3.16 115.11 119.09 2g31 h GLN 35 Ca -0.00 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 2g31 h GLN 35 Cb 0.69 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.45 2g31 h GLN 35 CO 0.04 0.00 -0.47 -0.22 -0.67 0.00 0.00 178.83 177.51 2g31 h LYS 36 N 0.00 0.00 -0.44 1.46 3.64 0.32 -3.11 116.57 118.45 2g31 h LYS 36 Ca 0.00 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.51 2g31 h LYS 36 Cb 0.92 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.72 2g31 h LYS 36 CO 0.00 0.47 0.32 -0.92 -2.27 0.00 0.00 179.45 177.05 2g31 h TYR 37 N 0.00 0.00 -0.29 1.91 5.03 -1.46 1.84 116.97 123.99 2g31 h TYR 37 Ca -0.00 0.00 -0.13 0.00 2.58 0.00 0.00 58.73 61.17 2g31 h TYR 37 Cb 1.20 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 39.47 2g31 h TYR 37 CO 0.00 0.00 -0.33 1.03 -1.32 0.00 0.00 178.16 177.54 2g31 h SER 38 N 0.00 0.79 1.25 -2.11 0.87 -1.73 0.53 113.55 113.15 2g31 h SER 38 Ca 0.21 -0.48 -0.13 0.00 -1.23 0.00 0.00 61.79 60.15 2g31 h SER 38 Cb 0.84 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.56 2g31 h SER 38 CO -0.00 1.11 -0.78 -1.13 -0.53 0.00 0.00 176.83 175.51 2g31 h ASN 39 N 0.48 0.00 1.23 6.23 -0.73 -1.12 -3.23 115.58 118.44 2g31 h ASN 39 Ca 0.04 0.00 -0.16 0.00 1.87 0.00 0.00 56.30 58.05 2g31 h ASN 39 Cb 0.91 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 39.48 2g31 h ASN 39 CO 0.08 0.56 -0.77 0.28 -0.37 0.00 0.00 177.43 177.21 2g31 h SER 40 N 0.00 0.00 -0.16 1.15 0.02 0.28 -3.16 113.55 111.69 2g31 h SER 40 Ca -0.05 0.00 0.05 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 0.06 0.77 0.48 0.00 -1.14 0.00 0.00 176.83 177.00 2g31 h ALA 41 N 1.23 1.70 -0.34 3.77 0.00 0.04 0.17 119.26 125.84 2g31 h ALA 41 Ca -0.01 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2g31 h ALA 41 Cb 1.58 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.35 2g31 h ALA 41 CO 0.10 -0.56 -0.20 1.28 0.00 0.00 0.00 179.25 179.86 2g31 n LEU 42 N -3.08 -0.36 -3.36 0.00 4.77 -1.20 -2.19 117.00 111.59 2g31 n LEU 42 Ca 0.02 1.24 -0.33 0.00 -0.03 0.00 0.00 56.01 56.91 2g31 n LEU 42 Cb 0.57 -0.40 -0.03 0.00 -2.33 0.00 0.00 43.42 41.24 2g31 n LEU 42 CO 0.16 -0.81 0.59 0.61 -1.33 0.00 0.00 177.39 176.61 2g31 n GLY 43 N -1.08 5.53 2.63 -0.72 0.00 -0.92 -4.84 105.19 105.79 2g31 n GLY 43 Ca 0.01 -2.72 -0.07 0.00 0.00 0.00 0.00 46.02 43.23 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 0.23 -1.62 0.07 1.61 8.25 -0.93 -4.67 115.22 118.17 2g31 n HIS 44 Ca 0.34 0.12 0.01 0.00 -0.26 0.00 0.00 57.72 57.92 2g31 n HIS 44 Cb 0.35 -1.03 -0.04 0.00 1.12 0.00 0.00 29.99 30.39 2g31 n HIS 44 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2g31 h VAL 45 N -0.15 0.70 0.00 1.59 2.07 -1.19 -3.25 116.25 116.02 2g31 h VAL 45 Ca -0.10 -2.15 0.00 0.00 0.82 0.00 0.00 66.70 65.27 2g31 h VAL 45 Cb 0.95 2.22 0.00 0.00 -1.52 0.00 0.00 31.29 32.93 2g31 h VAL 45 CO 0.15 0.40 0.15 -0.55 0.02 0.00 0.00 177.57 177.74 2g31 h ASN 46 N 0.00 0.00 0.73 0.57 7.08 -1.60 1.22 115.58 123.58 2g31 h ASN 46 Ca -0.10 0.00 -0.21 0.00 -3.08 0.00 0.00 56.30 52.91 2g31 h ASN 46 Cb 1.52 0.00 -0.04 0.00 -2.08 0.00 0.00 38.32 37.72 2g31 h ASN 46 CO 0.06 0.00 -1.40 0.00 -2.08 0.00 0.00 177.43 174.01 2g31 h THR 48 N 0.00 1.08 -0.86 0.00 2.02 0.89 -3.06 112.91 112.98 2g31 h THR 48 Ca -0.18 -2.47 -0.03 0.00 0.77 0.00 0.00 66.41 64.50 2g31 h THR 48 Cb 1.74 2.81 -0.04 0.00 -1.74 0.00 0.00 68.15 70.93 2g31 h THR 48 CO 0.07 0.76 0.43 0.16 0.37 0.00 0.00 175.52 177.30 2g31 h ILE 49 N -0.17 1.26 0.72 3.11 -0.00 0.68 -0.18 117.51 122.93 2g31 h ILE 49 Ca -0.29 -0.72 -0.04 0.00 -0.00 0.00 0.00 64.86 63.81 2g31 h ILE 49 Cb 1.87 0.14 0.01 0.00 -0.00 0.00 0.00 36.82 38.84 2g31 h ILE 49 CO 0.12 0.31 -0.34 0.50 -0.00 0.00 0.00 178.15 178.74 2g31 h LYS 50 N 1.23 -0.93 0.00 0.16 1.63 -1.65 -1.63 116.57 115.38 2g31 h LYS 50 Ca 0.30 0.06 0.00 0.00 -0.85 0.00 0.00 60.65 60.16 2g31 h LYS 50 Cb 0.10 0.21 0.00 0.00 -0.60 0.00 0.00 32.23 31.94 2g31 h LYS 50 CO -0.04 -0.62 0.21 0.93 -3.45 0.00 0.00 179.45 176.48 2g31 h GLU 51 N -0.97 0.00 0.31 1.90 4.39 -1.44 0.33 114.58 119.10 2g31 h GLU 51 Ca -0.10 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.59 2g31 h GLU 51 Cb 0.74 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.39 2g31 h GLU 51 CO 0.16 0.00 -0.15 1.25 -1.16 0.00 0.00 179.01 179.11 2g31 h LEU 52 N 0.00 -0.35 0.00 1.33 5.85 -0.10 -3.01 115.31 119.03 2g31 h LEU 52 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2g31 h LEU 52 Cb 0.41 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.53 2g31 h LEU 52 CO 0.00 -0.13 -0.06 -0.09 -0.34 0.00 0.00 178.44 177.82 2g31 h ARG 53 N -0.66 0.00 -0.40 1.25 1.12 -0.75 -3.39 114.38 111.55 2g31 h ARG 53 Ca -0.04 0.00 0.08 0.00 -1.11 0.00 0.00 59.98 58.91 2g31 h ARG 53 Cb 0.32 0.00 -0.09 0.00 -0.01 0.00 0.00 29.97 30.19 2g31 h ARG 53 CO 0.07 0.00 -0.19 0.00 -3.11 0.00 0.00 179.97 176.74 2g31 h ARG 54 N -0.24 -0.10 -0.30 0.20 2.47 -0.65 -3.44 114.38 112.32 2g31 h ARG 54 Ca 0.00 0.01 -0.13 0.00 -1.26 0.00 0.00 59.98 58.60 2g31 h ARG 54 Cb 0.06 0.02 -0.05 0.00 -1.65 0.00 0.00 29.97 28.35 2g31 h ARG 54 CO 0.00 -0.07 -0.12 -0.11 0.56 0.00 0.00 179.97 180.24 2g31 n LEU 55 N -5.37 0.12 0.00 3.04 0.00 -0.19 -4.49 117.00 110.11 2g31 n LEU 55 Ca 0.02 0.15 0.00 0.00 0.00 0.00 0.00 56.01 56.19 2g31 n LEU 55 Cb 0.28 -2.35 0.00 0.00 0.00 0.00 0.00 43.42 41.35 2g31 n LEU 55 CO 0.11 -0.90 0.00 0.49 0.00 0.00 0.00 177.39 177.10 2g31 n PHE 56 N -2.25 0.00 -0.09 1.96 3.72 -1.26 -4.89 117.46 114.65 2g31 n PHE 56 Ca -0.06 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.24 2g31 n PHE 56 Cb 0.49 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.00 2g31 n PHE 56 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2g31 h LEU 57 N 0.00 0.40 -3.03 4.37 6.46 -1.85 -3.48 115.31 118.18 2g31 h LEU 57 Ca 0.00 -0.16 0.00 0.00 -0.12 0.00 0.00 57.88 57.61 2g31 h LEU 57 Cb 0.00 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 39.81 2g31 h LEU 57 CO 0.00 0.44 -0.66 0.55 -0.62 0.00 0.00 178.44 178.15 2g31 n VAL 58 N -4.76 -3.71 -3.08 1.05 3.14 -1.26 -4.18 118.33 105.53 2g31 n VAL 58 Ca -0.02 0.67 -0.00 0.00 -2.96 0.00 0.00 64.34 62.02 2g31 n VAL 58 Cb 0.13 -3.55 -0.00 0.00 -1.06 0.00 0.00 33.84 29.35 2g31 n VAL 58 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2g31 n ASP 59 N 1.79 -6.69 0.00 6.55 2.03 -1.20 -4.95 116.55 114.08 2g31 n ASP 59 Ca -0.04 0.73 0.00 0.00 0.52 0.00 0.00 54.79 56.00 2g31 n ASP 59 Cb 0.27 -2.15 0.00 0.00 -0.72 0.00 0.00 41.12 38.52 2g31 n ASP 59 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61