#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 -3.67 0.00 5.15 2.08 -1.26 -1.58 119.36 120.08 2g31 n ILE 2 Ca 0.00 -0.71 0.00 0.00 0.56 0.00 0.00 62.75 62.60 2g31 n ILE 2 Cb 0.00 -2.91 0.00 0.00 -0.75 0.00 0.00 39.64 35.98 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 -4.81 0.00 0.00 1.39 4.19 -1.26 -4.63 117.16 112.04 2g31 n TYR 3 Ca -0.10 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.11 2g31 n TYR 3 Cb 0.57 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.40 2g31 n TYR 3 CO 0.00 0.00 0.00 0.36 0.91 0.00 0.00 176.86 178.13 2g31 n LYS 4 N 0.00 3.19 0.00 2.98 0.00 -0.61 -4.88 118.16 118.84 2g31 n LYS 4 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2g31 n LYS 4 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 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 2.19 0.91 2.58 0.00 -1.16 -2.67 105.19 112.03 2g31 n GLY 5 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 2g31 n GLY 5 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2g31 n VAL 6 N -1.28 0.25 0.28 1.61 0.31 -1.26 -4.49 118.33 113.74 2g31 n VAL 6 Ca 0.00 -0.01 0.13 0.00 -0.01 0.00 0.00 64.34 64.45 2g31 n VAL 6 Cb 0.00 -1.55 0.80 0.00 -0.91 0.00 0.00 33.84 32.18 2g31 n VAL 6 CO 0.00 0.00 0.00 0.16 -1.32 0.00 0.00 176.83 175.67 2g31 h ILE 7 N -0.11 0.56 0.33 2.52 3.07 -1.95 -0.55 117.51 121.38 2g31 h ILE 7 Ca -0.07 -0.32 -0.02 0.00 1.55 0.00 0.00 64.86 66.00 2g31 h ILE 7 Cb 1.00 1.21 0.00 0.00 -0.27 0.00 0.00 36.82 38.76 2g31 h ILE 7 CO -0.05 0.07 -0.16 -0.61 -1.05 0.00 0.00 178.15 176.36 2g31 h GLN 8 N 0.00 -0.43 -0.39 0.16 4.15 -1.94 -0.93 115.11 115.73 2g31 h GLN 8 Ca -0.00 0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.44 2g31 h GLN 8 Cb 0.20 0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.97 2g31 h GLN 8 CO 0.01 -0.11 0.20 0.00 -1.93 0.00 0.00 178.83 177.00 2g31 h ALA 9 N -0.25 0.50 -0.83 3.38 0.00 -1.69 -1.70 119.26 118.65 2g31 h ALA 9 Ca -0.05 -0.09 0.15 0.00 0.00 0.00 0.00 54.91 54.92 2g31 h ALA 9 Cb 0.51 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 2g31 h ALA 9 CO 0.07 0.04 0.54 0.82 0.00 0.00 0.00 179.25 180.73 2g31 h ILE 10 N 0.49 0.81 -0.51 0.00 2.04 -1.11 0.35 117.51 119.58 2g31 h ILE 10 Ca 0.13 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.80 2g31 h ILE 10 Cb 0.09 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 36.34 2g31 h ILE 10 CO -0.02 0.10 0.33 1.56 0.00 0.00 0.00 178.15 180.12 2g31 h GLN 11 N 0.56 0.67 -0.57 2.37 4.20 -0.21 0.63 115.11 122.76 2g31 h GLN 11 Ca 0.41 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 59.06 2g31 h GLN 11 Cb 0.79 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.39 2g31 h GLN 11 CO -0.17 0.45 0.27 0.87 -0.67 0.00 0.00 178.83 179.59 2g31 h LYS 12 N 0.69 0.82 0.00 1.46 6.56 -0.14 1.45 116.57 127.40 2g31 h LYS 12 Ca 0.19 -0.12 -0.02 0.00 -1.06 0.00 0.00 60.65 59.63 2g31 h LYS 12 Cb -0.07 -0.15 -0.00 0.00 -0.57 0.00 0.00 32.23 31.44 2g31 h LYS 12 CO -0.04 0.67 -0.11 1.03 -2.06 0.00 0.00 179.45 178.94 2g31 h SER 13 N 0.77 0.00 1.06 0.86 0.87 -1.06 0.86 113.55 116.91 2g31 h SER 13 Ca 0.20 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.62 2g31 h SER 13 Cb 0.12 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.06 2g31 h SER 13 CO -0.02 0.11 -1.00 -0.78 -0.53 0.00 0.00 176.83 174.61 2g31 h ASP 14 N 0.00 0.00 0.02 6.23 3.58 0.11 -3.34 116.42 123.02 2g31 h ASP 14 Ca -0.00 0.00 -0.22 0.00 0.42 0.00 0.00 57.03 57.23 2g31 h ASP 14 Cb 1.05 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.06 2g31 h ASP 14 CO 0.01 0.54 -2.20 -1.84 -2.88 0.00 0.00 179.24 172.87 2g31 n GLU 15 N -3.04 0.68 0.29 0.28 -0.00 0.49 -4.21 120.64 115.13 2g31 n GLU 15 Ca -0.04 -0.08 0.19 0.00 -0.00 0.00 0.00 57.16 57.23 2g31 n GLU 15 Cb 0.79 -1.53 0.98 0.00 -0.00 0.00 0.00 31.44 31.68 2g31 n GLU 15 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.13 177.91 2g31 h GLY 16 N 3.99 0.00 -1.56 -1.84 0.00 0.64 -3.42 103.07 100.88 2g31 h GLY 16 Ca -0.32 0.00 -0.47 0.00 0.00 0.00 0.00 47.33 46.54 2g31 h GLY 16 CO 0.02 0.00 0.15 0.30 0.00 0.00 0.00 176.54 177.01 2g31 s HIS 17 N -4.33 3.17 0.94 5.60 3.76 -1.26 -5.06 115.29 118.10 2g31 s HIS 17 Ca -0.05 0.54 -0.16 0.00 -0.15 0.00 0.00 55.06 55.24 2g31 s HIS 17 Cb 0.13 -2.79 0.23 0.00 1.11 0.00 0.00 32.58 31.26 2g31 s HIS 17 CO 0.43 -0.90 1.04 -0.35 -0.85 0.00 0.00 174.74 174.12 2g31 n PRO 18 N -2.59 -1.96 0.28 8.40 -0.04 -1.26 -4.86 135.00 132.97 2g31 n PRO 18 Ca 0.05 -1.63 0.19 0.00 -0.04 0.00 0.00 63.50 62.07 2g31 n PRO 18 Cb 0.58 -1.28 1.02 0.00 -0.04 0.00 0.00 33.50 33.78 2g31 n PRO 18 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2g31 h PHE 19 N -2.10 0.00 -0.28 0.54 -5.15 -1.98 -1.85 116.94 106.13 2g31 h PHE 19 Ca -0.36 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.40 2g31 h PHE 19 Cb 1.04 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.20 2g31 h PHE 19 CO 0.00 0.00 0.12 -0.09 -2.00 0.00 0.00 178.31 176.34 2g31 h ARG 20 N 0.00 0.41 -0.80 6.09 2.43 -2.01 -2.62 114.38 117.87 2g31 h ARG 20 Ca 0.00 -0.07 0.03 0.00 -0.81 0.00 0.00 59.98 59.13 2g31 h ARG 20 Cb 0.02 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.45 2g31 h ARG 20 CO 0.00 0.42 0.51 0.00 -1.51 0.00 0.00 179.97 179.39 2g31 h ALA 21 N 0.97 1.05 -0.91 2.80 0.00 -1.67 -0.43 119.26 121.07 2g31 h ALA 21 Ca 0.09 -0.03 0.26 0.00 0.00 0.00 0.00 54.91 55.23 2g31 h ALA 21 Cb 0.15 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2g31 h ALA 21 CO -0.01 0.34 0.72 -0.92 0.00 0.00 0.00 179.25 179.38 2g31 h TYR 22 N 1.01 0.00 0.00 0.00 3.20 -1.48 1.57 116.97 121.27 2g31 h TYR 22 Ca 0.32 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.18 2g31 h TYR 22 Cb -0.00 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.26 2g31 h TYR 22 CO -0.03 0.00 -0.07 1.25 -1.64 0.00 0.00 178.16 177.67 2g31 h LEU 23 N 0.00 0.00 -2.22 2.82 6.46 -1.01 -2.82 115.31 118.54 2g31 h LEU 23 Ca 0.43 -0.32 0.02 0.00 -0.12 0.00 0.00 57.88 57.88 2g31 h LEU 23 Cb 1.87 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.79 2g31 h LEU 23 CO -0.00 0.70 0.05 -0.33 -0.62 0.00 0.00 178.44 178.24 2g31 h GLU 24 N -1.00 0.00 0.35 1.25 4.39 -0.70 -0.04 114.58 118.83 2g31 h GLU 24 Ca -0.01 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 2g31 h GLU 24 Cb 0.38 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 2g31 h GLU 24 CO -0.01 0.00 -0.17 0.77 -1.16 0.00 0.00 179.01 178.44 2g31 h SER 25 N 0.00 -0.40 0.19 1.42 0.02 0.21 0.20 113.55 115.19 2g31 h SER 25 Ca 0.03 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 2g31 h SER 25 Cb 0.12 0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.76 2g31 h SER 25 CO -0.00 0.01 -0.03 -0.08 -1.14 0.00 0.00 176.83 175.60 2g31 h GLU 26 N -0.91 0.00 0.09 3.45 4.81 -1.16 1.26 114.58 122.11 2g31 h GLU 26 Ca -0.05 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.05 2g31 h GLU 26 Cb 0.53 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.93 2g31 h GLU 26 CO 0.08 0.03 -0.57 0.28 -0.73 0.00 0.00 179.01 178.10 2g31 h VAL 27 N 0.00 1.57 0.00 0.32 2.07 -0.86 -2.53 116.25 116.82 2g31 h VAL 27 Ca -0.00 -2.41 0.00 0.00 0.82 0.00 0.00 66.70 65.11 2g31 h VAL 27 Cb 0.13 3.16 0.00 0.00 -1.52 0.00 0.00 31.29 33.06 2g31 h VAL 27 CO 0.00 0.67 0.00 0.00 0.02 0.00 0.00 177.57 178.26 2g31 h ALA 28 N 0.10 1.00 0.00 1.67 0.00 0.18 -2.85 119.26 119.36 2g31 h ALA 28 Ca -0.10 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 2g31 h ALA 28 Cb 1.42 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 2g31 h ALA 28 CO 0.11 0.00 -0.37 0.82 0.00 0.00 0.00 179.25 179.80 2g31 h ILE 29 N 0.00 0.67 0.00 0.00 1.08 0.15 -3.07 117.51 116.34 2g31 h ILE 29 Ca 0.00 -1.85 -0.07 0.00 -0.39 0.00 0.00 64.86 62.55 2g31 h ILE 29 Cb 0.87 2.26 -0.01 0.00 -3.07 0.00 0.00 36.82 36.86 2g31 h ILE 29 CO 0.00 0.37 -0.33 0.77 -0.69 0.00 0.00 178.15 178.26 2g31 h SER 30 N 0.00 0.00 -0.22 1.72 4.64 -1.20 -2.45 113.55 116.04 2g31 h SER 30 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2g31 h SER 30 Cb 1.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 2g31 h SER 30 CO 0.05 0.33 0.13 -0.33 -0.87 0.00 0.00 176.83 176.14 2g31 h GLU 31 N 0.00 0.33 0.00 4.77 4.39 -1.61 -0.51 114.58 121.96 2g31 h GLU 31 Ca -0.00 -0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.59 2g31 h GLU 31 Cb 0.70 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 2g31 h GLU 31 CO 0.04 0.25 -0.57 0.93 -1.16 0.00 0.00 179.01 178.51 2g31 h GLU 32 N 0.34 0.00 -0.51 2.33 5.08 -1.59 -3.30 114.58 116.93 2g31 h GLU 32 Ca 0.09 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.49 2g31 h GLU 32 Cb 0.02 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 2g31 h GLU 32 CO -0.01 0.30 0.26 -0.07 -1.00 0.00 0.00 179.01 178.48 2g31 h LEU 33 N 0.00 0.37 -2.19 1.33 -0.00 -0.88 0.50 115.31 114.43 2g31 h LEU 33 Ca -0.03 0.03 -0.01 0.00 -0.00 0.00 0.00 57.88 57.88 2g31 h LEU 33 Cb 1.29 -0.04 -0.00 0.00 -0.00 0.00 0.00 40.66 41.90 2g31 h LEU 33 CO 0.04 0.25 -0.02 1.62 -0.00 0.00 0.00 178.44 180.33 2g31 h VAL 34 N 0.50 0.75 0.00 1.22 3.04 -1.60 0.17 116.25 120.33 2g31 h VAL 34 Ca 0.22 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.82 2g31 h VAL 34 Cb 0.13 1.06 0.00 0.00 -2.01 0.00 0.00 31.29 30.47 2g31 h VAL 34 CO -0.16 0.02 -0.61 -0.61 -1.01 0.00 0.00 177.57 175.21 2g31 h GLN 35 N 0.00 0.00 0.00 4.17 4.15 -0.82 -3.24 115.11 119.37 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 0.00 -0.34 -0.22 -1.93 0.00 0.00 178.83 176.34 2g31 h LYS 36 N 0.00 0.00 -0.81 1.69 3.64 0.28 -3.22 116.57 118.15 2g31 h LYS 36 Ca 0.00 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.48 2g31 h LYS 36 Cb 0.96 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.70 2g31 h LYS 36 CO 0.00 0.34 0.45 0.10 -2.27 0.00 0.00 179.45 178.07 2g31 h TYR 37 N 0.00 0.81 -0.85 1.91 -0.00 -1.39 2.28 116.97 119.74 2g31 h TYR 37 Ca -0.00 0.03 0.09 0.00 -0.00 0.00 0.00 58.73 58.85 2g31 h TYR 37 Cb 1.14 -0.24 -0.07 0.00 -0.00 0.00 0.00 36.73 37.56 2g31 h TYR 37 CO 0.00 0.31 0.50 0.77 -0.00 0.00 0.00 178.16 179.74 2g31 h SER 38 N 0.74 0.73 0.00 0.10 0.02 -1.75 0.35 113.55 113.74 2g31 h SER 38 Ca 0.40 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 61.36 2g31 h SER 38 Cb 0.40 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.83 2g31 h SER 38 CO -0.26 0.43 -0.23 -1.13 -1.14 0.00 0.00 176.83 174.49 2g31 h ASN 39 N 0.85 0.00 -1.25 3.07 -1.24 -1.26 -3.31 115.58 112.44 2g31 h ASN 39 Ca 0.40 -0.34 0.36 0.00 0.71 0.00 0.00 56.30 57.44 2g31 h ASN 39 Cb 0.34 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 39.34 2g31 h ASN 39 CO -0.23 0.80 1.01 0.28 -1.29 0.00 0.00 177.43 177.99 2g31 h SER 40 N -1.00 0.00 0.00 1.15 0.02 0.39 -3.03 113.55 111.08 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 0.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 2g31 h SER 40 CO -0.02 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.67 2g31 n ALA 41 N -2.65 0.00 -3.84 3.77 0.00 0.12 -3.68 120.51 114.23 2g31 n ALA 41 Ca 0.27 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.46 2g31 n ALA 41 Cb 1.41 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.87 2g31 n ALA 41 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2g31 n LEU 42 N 0.00 -0.19 0.00 0.00 4.77 -1.15 -2.52 117.00 117.91 2g31 n LEU 42 Ca 0.00 -0.72 0.00 0.00 -0.03 0.00 0.00 56.01 55.26 2g31 n LEU 42 Cb 0.00 -0.90 0.00 0.00 -2.33 0.00 0.00 43.42 40.19 2g31 n LEU 42 CO 0.00 0.44 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 2g31 n GLY 43 N -1.54 2.11 3.07 -0.72 0.00 -1.26 -4.90 105.19 101.95 2g31 n GLY 43 Ca -0.08 -0.73 0.04 0.00 0.00 0.00 0.00 46.02 45.25 2g31 n GLY 43 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2g31 s HIS 44 N 0.00 -0.98 0.00 1.61 5.65 -1.05 -5.01 115.29 115.52 2g31 s HIS 44 Ca 0.00 0.41 0.00 0.00 0.25 0.00 0.00 55.06 55.72 2g31 s HIS 44 Cb 0.00 0.17 0.00 0.00 -1.18 0.00 0.00 32.58 31.57 2g31 s HIS 44 CO 0.00 -0.60 0.00 0.28 -0.65 0.00 0.00 174.74 173.77 2g31 n VAL 45 N 4.74 0.00 0.34 0.89 0.31 -1.25 -4.86 118.33 118.50 2g31 n VAL 45 Ca 0.08 0.00 0.16 0.00 -0.01 0.00 0.00 64.34 64.57 2g31 n VAL 45 Cb 0.58 0.00 0.85 0.00 -0.91 0.00 0.00 33.84 34.36 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 0.63 4.52 7.08 -1.75 1.52 115.58 127.59 2g31 h ASN 46 Ca 0.00 0.00 -0.27 0.00 -3.08 0.00 0.00 56.30 52.95 2g31 h ASN 46 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.24 2g31 h ASN 46 CO 0.00 0.00 -1.26 0.00 -2.08 0.00 0.00 177.43 174.09 2g31 h THR 48 N 0.07 1.23 -0.57 0.00 2.02 0.10 -2.85 112.91 112.92 2g31 h THR 48 Ca -0.14 -2.98 -0.09 0.00 0.77 0.00 0.00 66.41 63.97 2g31 h THR 48 Cb 1.97 2.65 -0.02 0.00 -1.74 0.00 0.00 68.15 71.01 2g31 h THR 48 CO 0.19 0.75 -0.01 0.16 0.37 0.00 0.00 175.52 176.98 2g31 h ILE 49 N 0.02 1.27 -0.25 3.11 -0.00 0.15 -2.69 117.51 119.10 2g31 h ILE 49 Ca -0.18 -1.15 -0.16 0.00 -0.00 0.00 0.00 64.86 63.38 2g31 h ILE 49 Cb 1.93 0.87 -0.01 0.00 -0.00 0.00 0.00 36.82 39.61 2g31 h ILE 49 CO 0.12 0.41 -0.48 0.11 -0.00 0.00 0.00 178.15 178.31 2g31 h LYS 50 N 0.90 0.67 -0.00 0.16 1.57 -1.56 -0.40 116.57 117.91 2g31 h LYS 50 Ca 0.16 -0.39 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 2g31 h LYS 50 Cb 0.56 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.90 2g31 h LYS 50 CO 0.03 1.00 0.07 1.49 -0.57 0.00 0.00 179.45 181.47 2g31 h GLU 51 N 0.54 0.00 0.00 3.15 4.81 -1.23 1.62 114.58 123.47 2g31 h GLU 51 Ca 0.03 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.10 2g31 h GLU 51 Cb 1.03 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.38 2g31 h GLU 51 CO 0.10 0.00 -1.32 -0.11 -0.73 0.00 0.00 179.01 176.94 2g31 n LEU 52 N -3.09 1.90 0.02 1.64 -0.00 -0.95 -3.31 117.00 113.22 2g31 n LEU 52 Ca -0.03 0.42 -0.01 0.00 -0.00 0.00 0.00 56.01 56.40 2g31 n LEU 52 Cb 0.14 -0.83 -0.00 0.00 -0.00 0.00 0.00 43.42 42.72 2g31 n LEU 52 CO 0.19 -0.01 0.50 -0.09 -0.00 0.00 0.00 177.39 177.99 2g31 h ARG 53 N -1.00 -0.05 0.00 1.96 1.12 -0.77 -3.38 114.38 112.26 2g31 h ARG 53 Ca -0.24 0.00 -0.02 0.00 -1.11 0.00 0.00 59.98 58.61 2g31 h ARG 53 Cb 1.09 0.01 -0.00 0.00 -0.01 0.00 0.00 29.97 31.06 2g31 h ARG 53 CO -0.15 -0.04 -0.15 -0.09 -3.11 0.00 0.00 179.97 176.43 2g31 h ARG 54 N -0.05 0.00 0.00 0.20 1.12 -0.55 -3.49 114.38 111.60 2g31 h ARG 54 Ca -0.01 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.86 2g31 h ARG 54 Cb 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.00 2g31 h ARG 54 CO 0.01 0.48 0.00 -0.11 -3.11 0.00 0.00 179.97 177.24 2g31 n LEU 55 N -4.67 -0.13 0.00 3.80 7.94 0.51 -4.82 117.00 119.63 2g31 n LEU 55 Ca -0.07 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.83 2g31 n LEU 55 Cb 0.27 -0.29 0.00 0.00 0.53 0.00 0.00 43.42 43.93 2g31 n LEU 55 CO 0.16 0.00 0.00 0.49 -1.11 0.00 0.00 177.39 176.93 2g31 n PHE 56 N -2.63 -0.52 -0.36 1.96 3.72 -1.26 -4.88 117.46 113.48 2g31 n PHE 56 Ca 0.00 0.00 0.37 0.00 -0.05 0.00 0.00 57.45 57.77 2g31 n PHE 56 Cb 0.07 0.13 0.74 0.00 -0.94 0.00 0.00 39.48 39.48 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 0.00 -3.34 4.37 7.12 -1.88 -3.44 115.31 118.14 2g31 h LEU 57 Ca 0.00 0.00 -0.36 0.00 0.13 0.00 0.00 57.88 57.65 2g31 h LEU 57 Cb 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.13 2g31 h LEU 57 CO 0.00 0.00 -0.75 0.55 -0.13 0.00 0.00 178.44 178.11 2g31 n VAL 58 N -4.00 -2.11 -2.18 1.05 3.14 -1.26 -3.79 118.33 109.17 2g31 n VAL 58 Ca 0.28 -0.09 -0.01 0.00 -2.96 0.00 0.00 64.34 61.56 2g31 n VAL 58 Cb 1.39 -1.87 -0.01 0.00 -1.06 0.00 0.00 33.84 32.30 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 -1.56 -6.74 0.00 6.55 -0.08 -1.21 -4.85 116.55 108.67 2g31 n ASP 59 Ca -0.20 1.47 0.00 0.00 -1.51 0.00 0.00 54.79 54.55 2g31 n ASP 59 Cb 0.46 -4.52 0.00 0.00 2.34 0.00 0.00 41.12 39.40 2g31 n ASP 59 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65