#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r63 h ILE 2 N 0.00 1.29 -0.37 0.44 -0.00 -1.89 -3.35 117.51 113.63 1r63 h ILE 2 Ca 0.00 -1.75 0.05 0.00 -0.00 0.00 0.00 64.86 63.16 1r63 h ILE 2 Cb 0.00 2.34 -0.08 0.00 -0.00 0.00 0.00 36.82 39.08 1r63 h ILE 2 CO 0.00 0.40 -0.54 -1.28 -0.00 0.00 0.00 178.15 176.73 1r63 h SER 3 N -0.91 -1.79 -0.77 2.19 0.87 -1.76 -2.08 113.55 109.30 1r63 h SER 3 Ca -0.00 0.24 0.11 0.00 -1.23 0.00 0.00 61.79 60.90 1r63 h SER 3 Cb 0.69 0.73 -0.12 0.00 -0.44 0.00 0.00 62.40 63.26 1r63 h SER 3 CO 0.01 -0.41 -0.45 0.77 -0.53 0.00 0.00 176.83 176.21 1r63 h SER 4 N -0.42 -1.61 0.26 6.23 4.64 -1.85 -0.44 113.55 120.36 1r63 h SER 4 Ca 0.08 0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 1r63 h SER 4 Cb 0.61 0.75 -0.02 0.00 -0.31 0.00 0.00 62.40 63.44 1r63 h SER 4 CO -0.57 -0.30 -0.25 0.03 -0.87 0.00 0.00 176.83 174.87 1r63 h ARG 5 N -0.12 -0.51 -0.51 4.77 3.08 -1.53 -0.25 114.38 119.30 1r63 h ARG 5 Ca 0.22 0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.28 1r63 h ARG 5 Cb 0.54 0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.69 1r63 h ARG 5 CO -0.82 -0.34 0.21 0.28 -1.07 0.00 0.00 179.97 178.23 1r63 h VAL 6 N -0.53 1.21 0.18 2.04 2.07 -0.52 0.17 116.25 120.87 1r63 h VAL 6 Ca -0.01 -0.66 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 1r63 h VAL 6 Cb 0.49 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1r63 h VAL 6 CO -0.05 0.25 -0.22 0.50 0.02 0.00 0.00 177.57 178.07 1r63 h LYS 7 N 0.69 -0.40 -0.50 1.57 3.64 -1.12 -1.31 116.57 119.14 1r63 h LYS 7 Ca 0.17 0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.68 1r63 h LYS 7 Cb 0.19 0.09 -0.09 0.00 -0.41 0.00 0.00 32.23 32.01 1r63 h LYS 7 CO -0.01 -0.27 -0.06 0.77 -2.27 0.00 0.00 179.45 177.61 1r63 h SER 8 N -0.41 -0.34 -0.62 4.20 0.02 -0.54 -1.13 113.55 114.73 1r63 h SER 8 Ca -0.02 0.13 -0.09 0.00 -0.84 0.00 0.00 61.79 60.98 1r63 h SER 8 Cb 0.37 0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.15 1r63 h SER 8 CO -0.05 -0.12 0.05 0.50 -1.14 0.00 0.00 176.83 176.07 1r63 h LYS 9 N 0.05 1.07 -0.29 3.45 1.63 -0.71 0.21 116.57 121.99 1r63 h LYS 9 Ca 0.25 -0.31 0.05 0.00 -0.85 0.00 0.00 60.65 59.79 1r63 h LYS 9 Cb 0.38 -0.11 -0.05 0.00 -0.60 0.00 0.00 32.23 31.85 1r63 h LYS 9 CO -0.47 1.01 -0.03 -0.09 -3.45 0.00 0.00 179.45 176.43 1r63 h ARG 10 N 0.99 0.04 -0.36 1.90 1.12 -0.04 0.11 114.38 118.15 1r63 h ARG 10 Ca 0.19 -0.00 -0.07 0.00 -1.11 0.00 0.00 59.98 58.98 1r63 h ARG 10 Cb 0.50 -0.01 -0.02 0.00 -0.01 0.00 0.00 29.97 30.43 1r63 h ARG 10 CO 0.02 0.03 -0.08 0.82 -3.11 0.00 0.00 179.97 177.65 1r63 h ILE 11 N 0.05 1.23 -0.52 1.20 5.03 -0.93 0.77 117.51 124.35 1r63 h ILE 11 Ca 0.14 -1.01 -0.01 0.00 -0.12 0.00 0.00 64.86 63.86 1r63 h ILE 11 Cb 0.20 1.06 -0.02 0.00 -3.03 0.00 0.00 36.82 35.02 1r63 h ILE 11 CO -0.26 0.34 0.29 -0.61 -0.68 0.00 0.00 178.15 177.23 1r63 h GLN 12 N 0.56 0.71 -0.74 2.37 4.15 0.70 0.10 115.11 122.97 1r63 h GLN 12 Ca 0.10 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.45 1r63 h GLN 12 Cb 0.48 -0.14 -0.04 0.00 0.21 0.00 0.00 27.48 27.99 1r63 h GLN 12 CO 0.03 0.54 0.46 -0.07 -1.93 0.00 0.00 178.83 177.86 1r63 h LEU 13 N 0.69 0.86 0.00 -2.39 4.07 -0.60 -3.46 115.31 114.48 1r63 h LEU 13 Ca 0.18 -0.04 -0.00 0.00 0.08 0.00 0.00 57.88 58.11 1r63 h LEU 13 Cb 0.03 -0.22 -0.00 0.00 1.08 0.00 0.00 40.66 41.55 1r63 h LEU 13 CO -0.03 0.65 -0.00 0.61 -1.08 0.00 0.00 178.44 178.59 1r63 n GLY 14 N -1.36 0.40 3.78 0.83 0.00 0.35 -5.02 105.19 104.17 1r63 n GLY 14 Ca 0.08 -0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 1r63 n GLY 14 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r63 s LEU 15 N -0.00 4.48 0.88 0.99 1.43 -1.15 -4.98 118.68 120.33 1r63 s LEU 15 Ca 0.00 1.69 -0.12 0.00 -1.03 0.00 0.00 54.13 54.68 1r63 s LEU 15 Cb 0.00 -3.61 0.12 0.00 0.03 0.00 0.00 46.19 42.73 1r63 s LEU 15 CO 0.00 0.09 1.11 0.54 0.23 0.00 0.00 176.35 178.32 1r63 s ASN 16 N -1.40 3.78 0.20 2.29 4.22 -1.26 -4.41 114.94 118.36 1r63 s ASN 16 Ca 0.42 1.16 -0.11 0.00 -2.14 0.00 0.00 52.86 52.20 1r63 s ASN 16 Cb -0.21 -1.82 0.17 0.00 1.28 0.00 0.00 41.25 40.68 1r63 s ASN 16 CO 0.25 -2.40 1.82 1.56 -2.04 0.00 0.00 177.10 176.29 1r63 h GLN 17 N -1.39 0.69 -0.64 3.55 4.20 -1.97 0.12 115.11 119.66 1r63 h GLN 17 Ca -0.50 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.17 1r63 h GLN 17 Cb 1.30 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.90 1r63 h GLN 17 CO 0.60 0.46 0.40 0.00 -0.67 0.00 0.00 178.83 179.62 1r63 h ALA 18 N 1.29 0.82 -0.53 3.87 0.00 -1.93 0.17 119.26 122.95 1r63 h ALA 18 Ca 0.26 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1r63 h ALA 18 Cb 0.07 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1r63 h ALA 18 CO -0.13 0.28 0.31 0.93 0.00 0.00 0.00 179.25 180.65 1r63 h GLU 19 N 0.87 0.73 -0.01 0.00 4.39 -1.66 0.23 114.58 119.13 1r63 h GLU 19 Ca 0.23 -0.07 0.03 0.00 0.34 0.00 0.00 59.36 59.89 1r63 h GLU 19 Cb -0.05 -0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 28.41 1r63 h GLU 19 CO -0.05 0.55 -0.19 1.25 -1.16 0.00 0.00 179.01 179.41 1r63 h LEU 20 N 0.72 -0.57 -1.01 1.33 5.85 -0.40 -0.28 115.31 120.95 1r63 h LEU 20 Ca 0.19 0.08 0.15 0.00 0.84 0.00 0.00 57.88 59.14 1r63 h LEU 20 Cb 0.01 0.24 -0.09 0.00 0.37 0.00 0.00 40.66 41.19 1r63 h LEU 20 CO -0.03 -0.26 0.63 0.00 -0.34 0.00 0.00 178.44 178.43 1r63 h ALA 21 N 0.59 1.59 0.00 1.25 0.00 -0.47 -0.12 119.26 122.11 1r63 h ALA 21 Ca 0.06 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1r63 h ALA 21 Cb 0.39 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1r63 h ALA 21 CO -0.19 0.11 -0.00 0.37 0.00 0.00 0.00 179.25 179.54 1r63 h GLN 22 N 0.90 -0.01 -0.19 0.00 4.15 0.47 0.33 115.11 120.76 1r63 h GLN 22 Ca 0.53 0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.99 1r63 h GLN 22 Cb 0.66 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.32 1r63 h GLN 22 CO -0.31 -0.01 -0.05 0.87 -1.93 0.00 0.00 178.83 177.40 1r63 h LYS 23 N -0.01 0.00 -0.10 1.69 6.56 -0.21 -1.22 116.57 123.29 1r63 h LYS 23 Ca 0.00 -0.00 0.03 0.00 -1.06 0.00 0.00 60.65 59.62 1r63 h LYS 23 Cb 0.01 -0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 31.67 1r63 h LYS 23 CO -0.00 0.00 0.09 0.28 -2.06 0.00 0.00 179.45 177.76 1r63 h VAL 24 N 0.00 0.62 -3.93 0.50 2.07 -0.49 -3.46 116.25 111.55 1r63 h VAL 24 Ca 0.09 0.00 -0.29 0.00 0.82 0.00 0.00 66.70 67.32 1r63 h VAL 24 Cb 0.14 0.93 0.07 0.00 -1.52 0.00 0.00 31.29 30.91 1r63 h VAL 24 CO -0.20 0.00 -0.47 0.61 0.02 0.00 0.00 177.57 177.53 1r63 n GLY 25 N -1.42 -0.16 0.00 2.17 0.00 0.99 -4.88 105.19 101.90 1r63 n GLY 25 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1r63 n GLY 25 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1r63 n THR 26 N -4.24 0.00 -3.96 2.61 5.66 -0.19 -5.02 114.28 109.14 1r63 n THR 26 Ca -0.04 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.75 1r63 n THR 26 Cb 0.57 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.31 1r63 n THR 26 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1r63 s THR 27 N -0.45 4.22 0.21 1.09 -4.23 -1.26 -4.08 115.64 111.15 1r63 s THR 27 Ca 0.00 -1.32 -0.15 0.00 -1.18 0.00 0.00 61.69 59.04 1r63 s THR 27 Cb 0.00 -3.38 0.23 0.00 1.34 0.00 0.00 72.50 70.69 1r63 s THR 27 CO 0.00 -0.28 1.41 1.67 -0.54 0.00 0.00 174.62 176.89 1r63 n GLN 28 N -1.30 -0.21 -0.27 3.99 -0.06 -1.26 -1.78 117.38 116.49 1r63 n GLN 28 Ca -0.05 1.40 0.03 0.00 -2.00 0.00 0.00 57.00 56.38 1r63 n GLN 28 Cb 0.58 -2.08 0.17 0.00 -4.06 0.00 0.00 30.24 24.85 1r63 n GLN 28 CO 0.00 0.00 0.00 0.37 -0.20 0.00 0.00 177.06 177.23 1r63 h GLN 29 N 0.00 0.64 -0.18 3.69 -0.00 -1.96 0.20 115.11 117.49 1r63 h GLN 29 Ca 0.32 -0.04 0.00 0.00 -0.00 0.00 0.00 58.65 58.94 1r63 h GLN 29 Cb 0.55 -0.14 -0.01 0.00 0.00 0.00 0.00 27.48 27.88 1r63 h GLN 29 CO -0.91 0.42 0.12 0.77 0.00 0.00 0.00 178.83 179.23 1r63 h SER 30 N 0.66 0.21 0.02 -0.69 0.02 -1.75 0.48 113.55 112.49 1r63 h SER 30 Ca 0.39 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.31 1r63 h SER 30 Cb 0.44 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1r63 h SER 30 CO -0.29 0.18 -0.01 0.40 -1.14 0.00 0.00 176.83 175.97 1r63 h ILE 31 N 0.23 1.13 -0.31 3.27 5.03 -1.03 -2.28 117.51 123.54 1r63 h ILE 31 Ca 0.07 -0.44 0.04 0.00 -0.12 0.00 0.00 64.86 64.41 1r63 h ILE 31 Cb -0.00 1.42 -0.08 0.00 -3.03 0.00 0.00 36.82 35.13 1r63 h ILE 31 CO -0.01 0.11 -0.55 -0.08 -0.68 0.00 0.00 178.15 176.94 1r63 h GLU 32 N -0.21 -0.44 -0.93 2.37 4.81 -0.48 0.79 114.58 120.49 1r63 h GLU 32 Ca -0.00 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 1r63 h GLU 32 Cb 0.20 0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.64 1r63 h GLU 32 CO 0.00 -0.29 0.54 -0.56 -0.73 0.00 0.00 179.01 177.97 1r63 h GLN 33 N -0.46 1.27 -0.04 1.92 3.07 -0.88 0.23 115.11 120.22 1r63 h GLN 33 Ca 0.06 -0.13 0.00 0.00 0.09 0.00 0.00 58.65 58.67 1r63 h GLN 33 Cb 0.62 -0.26 -0.00 0.00 0.08 0.00 0.00 27.48 27.92 1r63 h GLN 33 CO -0.54 0.90 0.02 1.25 0.09 0.00 0.00 178.83 180.55 1r63 h LEU 34 N 1.28 0.03 -1.40 0.06 5.85 -0.81 -0.19 115.31 120.15 1r63 h LEU 34 Ca 0.33 0.00 0.03 0.00 0.84 0.00 0.00 57.88 59.09 1r63 h LEU 34 Cb -0.03 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 1r63 h LEU 34 CO -0.06 0.03 0.44 -0.08 -0.34 0.00 0.00 178.44 178.42 1r63 h GLU 35 N 0.05 0.76 0.00 1.25 4.22 -0.15 0.16 114.58 120.87 1r63 h GLU 35 Ca 0.02 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.41 1r63 h GLU 35 Cb 0.00 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1r63 h GLU 35 CO -0.01 0.51 0.00 0.09 -2.18 0.00 0.00 179.01 177.41 1r63 n ASN 36 N -4.46 0.00 -2.58 1.04 3.02 0.74 -4.35 115.26 108.67 1r63 n ASN 36 Ca 0.08 -0.24 -0.20 0.00 -0.03 0.00 0.00 54.58 54.19 1r63 n ASN 36 Cb 0.13 -0.16 0.02 0.00 -0.61 0.00 0.00 39.78 39.16 1r63 n ASN 36 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r63 n GLY 37 N 0.25 -0.42 0.03 7.41 0.00 0.57 -4.90 105.19 108.14 1r63 n GLY 37 Ca 0.11 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.26 1r63 n GLY 37 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1r63 n LYS 38 N -3.46 0.17 -5.03 1.61 5.02 -0.15 -4.80 118.16 111.52 1r63 n LYS 38 Ca -0.14 0.03 -0.29 0.00 -2.02 0.00 0.00 58.31 55.88 1r63 n LYS 38 Cb 0.63 -1.59 -0.15 0.00 -0.02 0.00 0.00 35.03 33.90 1r63 n LYS 38 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1r63 s THR 39 N -3.10 1.97 -0.16 -0.18 2.01 -1.25 -4.99 115.64 109.93 1r63 s THR 39 Ca 0.08 -1.19 -0.20 0.00 0.31 0.00 0.00 61.69 60.69 1r63 s THR 39 Cb 0.15 -1.67 -0.17 0.00 0.01 0.00 0.00 72.50 70.83 1r63 s THR 39 CO 0.73 0.44 0.34 0.50 -0.69 0.00 0.00 174.62 175.94 1r63 h LYS 40 N 5.17 0.00 -4.19 4.92 3.11 -1.97 -3.44 116.57 120.17 1r63 h LYS 40 Ca -0.44 0.00 -0.65 0.00 -2.81 0.00 0.00 60.65 56.76 1r63 h LYS 40 Cb 1.14 0.00 -0.40 0.00 -1.00 0.00 0.00 32.23 31.96 1r63 h LYS 40 CO 0.45 0.73 -0.70 0.50 -2.81 0.00 0.00 179.45 177.63 1r63 s ARG 41 N -2.18 1.58 0.40 1.90 3.52 -1.26 -4.99 118.95 117.92 1r63 s ARG 41 Ca -0.19 -2.06 -0.25 0.00 -0.13 0.00 0.00 55.73 53.10 1r63 s ARG 41 Cb 0.01 -3.15 -0.09 0.00 -1.56 0.00 0.00 34.95 30.17 1r63 s ARG 41 CO 0.50 -1.00 1.10 -1.25 -0.81 0.00 0.00 175.30 173.84 1r63 s PRO 42 N 0.56 4.11 0.20 5.12 0.04 -1.26 -4.95 135.00 138.82 1r63 s PRO 42 Ca 0.13 1.66 -0.11 0.00 0.04 0.00 0.00 61.00 62.72 1r63 s PRO 42 Cb -0.21 -2.60 0.13 0.00 0.04 0.00 0.00 34.50 31.85 1r63 s PRO 42 CO -0.06 -0.22 1.81 0.00 0.04 0.00 0.00 177.00 178.56 1r63 h ARG 43 N 2.56 0.99 -1.08 4.56 3.08 -2.02 -2.20 114.38 120.27 1r63 h ARG 43 Ca -0.48 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.45 1r63 h ARG 43 Cb 1.22 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.08 1r63 h ARG 43 CO 0.62 0.74 0.00 1.97 -1.07 0.00 0.00 179.97 182.24 1r63 n PHE 44 N -4.48 0.00 0.21 3.04 -1.74 -1.26 -4.40 117.46 108.82 1r63 n PHE 44 Ca 0.06 -0.33 -0.17 0.00 -0.56 0.00 0.00 57.45 56.45 1r63 n PHE 44 Cb 0.09 -0.19 -0.09 0.00 1.52 0.00 0.00 39.48 40.81 1r63 n PHE 44 CO 0.00 0.00 0.00 1.25 -0.56 0.00 0.00 176.76 177.45 1r63 h LEU 45 N 0.92 -1.42 -0.78 5.98 5.85 -1.78 0.14 115.31 124.22 1r63 h LEU 45 Ca 0.00 0.13 0.10 0.00 0.84 0.00 0.00 57.88 58.95 1r63 h LEU 45 Cb 0.75 0.50 -0.07 0.00 0.37 0.00 0.00 40.66 42.20 1r63 h LEU 45 CO 0.00 -0.60 0.42 -0.65 -0.34 0.00 0.00 178.44 177.27 1r63 h PRO 46 N -0.87 0.67 -0.47 5.25 0.11 -1.88 0.64 132.00 135.46 1r63 h PRO 46 Ca -0.03 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.95 1r63 h PRO 46 Cb 0.81 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 1r63 h PRO 46 CO -0.16 0.44 -0.07 0.93 -0.21 0.00 0.00 178.00 178.93 1r63 h GLU 47 N 0.69 0.87 -0.47 1.05 4.39 -1.80 0.89 114.58 120.19 1r63 h GLU 47 Ca 0.39 -0.31 0.03 0.00 0.34 0.00 0.00 59.36 59.80 1r63 h GLU 47 Cb 0.40 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.96 1r63 h GLU 47 CO -0.27 0.95 0.27 1.25 -1.16 0.00 0.00 179.01 180.05 1r63 h LEU 48 N 0.72 0.42 -0.12 1.33 5.85 -0.23 0.34 115.31 123.62 1r63 h LEU 48 Ca 0.12 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.90 1r63 h LEU 48 Cb 0.61 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.51 1r63 h LEU 48 CO 0.04 0.30 -0.20 0.00 -0.34 0.00 0.00 178.44 178.23 1r63 h ALA 49 N 1.22 -0.16 0.16 1.25 0.00 -0.14 0.86 119.26 122.45 1r63 h ALA 49 Ca 0.19 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1r63 h ALA 49 Cb 0.05 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1r63 h ALA 49 CO -0.10 -0.66 -0.15 0.77 0.00 0.00 0.00 179.25 179.11 1r63 h SER 50 N -0.26 -0.39 0.27 0.00 0.02 -0.56 0.21 113.55 112.84 1r63 h SER 50 Ca 0.10 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1r63 h SER 50 Cb 0.40 0.13 -0.00 0.00 0.14 0.00 0.00 62.40 63.07 1r63 h SER 50 CO -0.27 -0.22 -0.16 0.00 -1.14 0.00 0.00 176.83 175.04 1r63 h ALA 51 N 0.49 -0.40 0.00 3.77 0.00 -0.64 -1.30 119.26 121.18 1r63 h ALA 51 Ca 0.00 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1r63 h ALA 51 Cb 0.31 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1r63 h ALA 51 CO -0.03 -0.73 -0.02 -0.07 0.00 0.00 0.00 179.25 178.40 1r63 h LEU 52 N -0.41 0.00 -2.49 0.00 3.38 -0.75 -3.47 115.31 111.57 1r63 h LEU 52 Ca -0.03 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.75 1r63 h LEU 52 Cb 0.33 0.00 0.15 0.00 0.09 0.00 0.00 40.66 41.24 1r63 h LEU 52 CO 0.03 0.02 -0.66 0.61 0.09 0.00 0.00 178.44 178.54 1r63 n GLY 53 N -0.75 -1.01 3.37 0.83 0.00 0.56 -4.97 105.19 103.23 1r63 n GLY 53 Ca -0.02 0.49 -0.11 0.00 0.00 0.00 0.00 46.02 46.39 1r63 n GLY 53 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r63 s VAL 54 N -3.30 0.00 0.43 1.61 -7.23 -0.18 -5.03 120.40 106.70 1r63 s VAL 54 Ca 0.35 -1.74 -0.09 0.00 -1.81 0.00 0.00 61.98 58.70 1r63 s VAL 54 Cb -0.05 -2.36 -0.05 0.00 0.56 0.00 0.00 36.38 34.48 1r63 s VAL 54 CO 0.67 -0.01 0.78 -0.94 -0.31 0.00 0.00 175.10 175.30 1r63 s SER 55 N -3.10 6.43 0.14 4.85 1.04 -1.26 -4.25 113.70 117.56 1r63 s SER 55 Ca 0.32 1.07 -0.26 0.00 0.48 0.00 0.00 55.95 57.56 1r63 s SER 55 Cb 0.04 -2.30 -0.00 0.00 0.10 0.00 0.00 66.02 63.85 1r63 s SER 55 CO 0.11 -0.46 1.60 0.58 0.98 0.00 0.00 173.24 176.04 1r63 h VAL 56 N 0.80 0.24 -0.91 5.02 2.07 -1.93 -0.91 116.25 120.63 1r63 h VAL 56 Ca -0.47 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.10 1r63 h VAL 56 Cb 1.19 0.24 -0.06 0.00 -1.52 0.00 0.00 31.29 31.14 1r63 h VAL 56 CO 0.63 0.00 0.58 -2.24 0.02 0.00 0.00 177.57 176.56 1r63 h ASP 57 N -0.37 0.94 -0.43 0.57 2.03 -1.98 0.11 116.42 117.30 1r63 h ASP 57 Ca 0.12 0.00 0.01 0.00 -0.73 0.00 0.00 57.03 56.43 1r63 h ASP 57 Cb 0.56 -0.20 -0.03 0.00 -0.83 0.00 0.00 39.33 38.84 1r63 h ASP 57 CO -0.43 0.62 0.26 -0.25 -1.03 0.00 0.00 179.24 178.42 1r63 h TRP 58 N 1.09 0.50 -0.01 4.15 7.01 -1.72 0.18 115.95 127.15 1r63 h TRP 58 Ca 0.38 0.01 -0.10 0.00 2.11 0.00 0.00 58.89 61.29 1r63 h TRP 58 Cb 0.09 -0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 26.97 1r63 h TRP 58 CO -0.02 0.30 -0.49 -0.07 -2.79 0.00 0.00 178.44 175.37 1r63 h LEU 59 N 0.54 0.02 0.53 0.65 3.38 -0.49 0.16 115.31 120.09 1r63 h LEU 59 Ca 0.16 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1r63 h LEU 59 Cb -0.02 -0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.73 1r63 h LEU 59 CO -0.06 0.51 -0.25 0.25 0.09 0.00 0.00 178.44 178.97 1r63 h LEU 60 N 0.01 -0.60 0.00 1.67 5.85 -0.35 -3.45 115.31 118.44 1r63 h LEU 60 Ca -0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1r63 h LEU 60 Cb 0.88 0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.06 1r63 h LEU 60 CO 0.06 -0.42 0.00 0.59 -0.34 0.00 0.00 178.44 178.33 1r63 n ASN 61 N -3.95 0.00 0.00 1.25 3.02 0.59 -4.90 115.26 111.28 1r63 n ASN 61 Ca -0.09 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.46 1r63 n ASN 61 Cb 0.28 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 1r63 n ASN 61 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r63 n GLY 62 N 2.90 2.20 0.00 7.41 0.00 0.54 -4.82 105.19 113.43 1r63 n GLY 62 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1r63 n GLY 62 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95