#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 0.98 -0.26 -1.33 -0.00 -1.83 -3.09 117.51 111.97 1r63 h ILE 2 Ca 0.00 -0.09 0.06 0.00 -0.00 0.00 0.00 64.86 64.82 1r63 h ILE 2 Cb 0.00 1.04 -0.08 0.00 -0.00 0.00 0.00 36.82 37.78 1r63 h ILE 2 CO 0.00 0.02 -0.42 0.77 -0.00 0.00 0.00 178.15 178.52 1r63 h SER 3 N -0.11 -1.36 -0.45 2.19 4.64 -1.81 -1.38 113.55 115.28 1r63 h SER 3 Ca -0.01 0.19 0.09 0.00 -0.47 0.00 0.00 61.79 61.60 1r63 h SER 3 Cb 0.09 0.57 -0.09 0.00 -0.31 0.00 0.00 62.40 62.67 1r63 h SER 3 CO 0.01 -0.40 -0.11 -1.28 -0.87 0.00 0.00 176.83 174.18 1r63 h SER 4 N -0.41 -0.42 0.40 4.97 0.87 -1.88 0.26 113.55 117.33 1r63 h SER 4 Ca 0.10 0.14 -0.01 0.00 -1.23 0.00 0.00 61.79 60.79 1r63 h SER 4 Cb 0.60 0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.84 1r63 h SER 4 CO -0.48 -0.15 -0.27 0.03 -0.53 0.00 0.00 176.83 175.43 1r63 h ARG 5 N 0.00 -0.63 -0.48 2.24 3.08 -1.38 0.13 114.38 117.35 1r63 h ARG 5 Ca 0.22 0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.36 1r63 h ARG 5 Cb 0.33 0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.50 1r63 h ARG 5 CO -0.47 -0.42 0.32 0.28 -1.07 0.00 0.00 179.97 178.61 1r63 h VAL 6 N -0.65 0.99 0.30 2.04 2.07 -0.29 0.15 116.25 120.86 1r63 h VAL 6 Ca -0.04 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 1r63 h VAL 6 Cb 0.55 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1r63 h VAL 6 CO 0.02 0.08 -0.15 0.50 0.02 0.00 0.00 177.57 178.05 1r63 h LYS 7 N 0.43 -0.39 -0.54 1.57 1.63 -0.32 -3.29 116.57 115.66 1r63 h LYS 7 Ca 0.20 0.03 0.09 0.00 -0.85 0.00 0.00 60.65 60.12 1r63 h LYS 7 Cb 0.26 0.09 -0.07 0.00 -0.60 0.00 0.00 32.23 31.91 1r63 h LYS 7 CO -0.05 -0.26 0.16 1.03 -3.45 0.00 0.00 179.45 176.87 1r63 h SER 8 N -0.79 0.10 -1.00 4.20 0.87 -0.40 -0.06 113.55 116.47 1r63 h SER 8 Ca -0.04 0.08 0.07 0.00 -1.23 0.00 0.00 61.79 60.67 1r63 h SER 8 Cb 0.31 0.09 -0.07 0.00 -0.44 0.00 0.00 62.40 62.30 1r63 h SER 8 CO 0.07 0.07 0.64 0.11 -0.53 0.00 0.00 176.83 177.20 1r63 h LYS 9 N 0.31 1.12 -0.14 2.24 1.79 -0.89 0.14 116.57 121.13 1r63 h LYS 9 Ca 0.27 -0.07 -0.01 0.00 -2.18 0.00 0.00 60.65 58.66 1r63 h LYS 9 Cb 0.35 -0.25 -0.01 0.00 -1.58 0.00 0.00 32.23 30.75 1r63 h LYS 9 CO -0.32 0.74 0.03 -0.09 -1.08 0.00 0.00 179.45 178.74 1r63 h ARG 10 N 1.15 0.23 -0.22 3.15 2.43 -1.07 -1.89 114.38 118.15 1r63 h ARG 10 Ca 0.44 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.51 1r63 h ARG 10 Cb 0.20 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1r63 h ARG 10 CO -0.18 0.38 -0.02 0.82 -1.51 0.00 0.00 179.97 179.46 1r63 h ILE 11 N 0.03 1.27 -0.71 1.20 2.04 -1.29 0.93 117.51 120.99 1r63 h ILE 11 Ca 0.04 -0.95 0.13 0.00 1.00 0.00 0.00 64.86 65.09 1r63 h ILE 11 Cb 0.26 1.45 -0.09 0.00 -0.74 0.00 0.00 36.82 37.69 1r63 h ILE 11 CO 0.00 0.29 0.23 1.56 0.00 0.00 0.00 178.15 180.24 1r63 h GLN 12 N 0.16 0.36 0.56 2.37 1.08 -0.53 -0.20 115.11 118.90 1r63 h GLN 12 Ca 0.06 -0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.21 1r63 h GLN 12 Cb 0.45 -0.08 0.01 0.00 -0.05 0.00 0.00 27.48 27.80 1r63 h GLN 12 CO 0.02 0.24 -0.27 -0.07 -0.95 0.00 0.00 178.83 177.79 1r63 h LEU 13 N 0.37 -0.64 0.00 1.46 3.38 -1.29 -3.49 115.31 115.11 1r63 h LEU 13 Ca 0.38 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1r63 h LEU 13 Cb 0.59 0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1r63 h LEU 13 CO -0.41 -0.26 0.00 0.61 0.09 0.00 0.00 178.44 178.47 1r63 n GLY 14 N -0.46 1.26 3.60 0.83 0.00 0.07 -5.11 105.19 105.37 1r63 n GLY 14 Ca -0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 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 3.14 0.00 0.99 1.43 0.10 -4.99 118.68 119.35 1r63 s LEU 15 Ca 0.00 -0.27 0.02 0.00 -1.03 0.00 0.00 54.13 52.84 1r63 s LEU 15 Cb 0.00 -1.88 0.03 0.00 0.03 0.00 0.00 46.19 44.37 1r63 s LEU 15 CO 0.00 0.21 0.23 -0.46 0.23 0.00 0.00 176.35 176.57 1r63 n ASN 16 N 0.98 0.50 -0.14 2.29 0.23 -1.26 -3.50 115.26 114.36 1r63 n ASN 16 Ca -0.14 -1.38 -0.10 0.00 -0.53 0.00 0.00 54.58 52.44 1r63 n ASN 16 Cb 0.52 -0.13 -0.01 0.00 -2.08 0.00 0.00 39.78 38.08 1r63 n ASN 16 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 1r63 h GLN 17 N 0.00 0.69 0.15 -3.83 4.20 -1.97 0.47 115.11 114.82 1r63 h GLN 17 Ca -0.08 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.44 1r63 h GLN 17 Cb 0.33 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.03 1r63 h GLN 17 CO 0.10 0.74 -0.09 0.00 -0.67 0.00 0.00 178.83 178.91 1r63 h ALA 18 N 0.93 -0.22 -0.26 3.87 0.00 -1.94 0.54 119.26 122.17 1r63 h ALA 18 Ca 0.12 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1r63 h ALA 18 Cb 0.39 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1r63 h ALA 18 CO 0.01 -0.63 0.10 0.93 0.00 0.00 0.00 179.25 179.66 1r63 h GLU 19 N -0.23 0.22 0.10 0.00 5.08 -1.93 0.92 114.58 118.74 1r63 h GLU 19 Ca -0.01 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1r63 h GLU 19 Cb 0.20 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 1r63 h GLU 19 CO 0.01 0.15 -0.48 1.25 -1.00 0.00 0.00 179.01 178.94 1r63 h LEU 20 N 0.23 -1.44 -0.56 1.33 5.85 -0.78 -1.63 115.31 118.31 1r63 h LEU 20 Ca 0.11 0.16 0.10 0.00 0.84 0.00 0.00 57.88 59.10 1r63 h LEU 20 Cb 0.07 0.54 -0.08 0.00 0.37 0.00 0.00 40.66 41.55 1r63 h LEU 20 CO -0.10 -0.52 0.09 0.00 -0.34 0.00 0.00 178.44 177.56 1r63 h ALA 21 N -0.34 0.63 -0.35 1.25 0.00 -0.31 0.22 119.26 120.36 1r63 h ALA 21 Ca 0.01 0.13 0.07 0.00 0.00 0.00 0.00 54.91 55.12 1r63 h ALA 21 Cb 0.72 0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.64 1r63 h ALA 21 CO -0.28 -0.33 -0.08 0.37 0.00 0.00 0.00 179.25 178.93 1r63 h GLN 22 N 0.22 0.01 -0.16 0.00 5.75 -0.65 0.20 115.11 120.48 1r63 h GLN 22 Ca 0.29 -0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.68 1r63 h GLN 22 Cb 0.43 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.96 1r63 h GLN 22 CO -0.40 0.01 -0.39 0.87 -2.65 0.00 0.00 178.83 176.27 1r63 h LYS 23 N 0.01 0.35 -0.36 1.69 1.57 0.01 -1.76 116.57 118.08 1r63 h LYS 23 Ca 0.17 -0.16 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1r63 h LYS 23 Cb 0.26 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 1r63 h LYS 23 CO -0.35 0.69 0.14 0.28 -0.57 0.00 0.00 179.45 179.64 1r63 h VAL 24 N 0.29 1.19 -1.36 0.50 2.07 -0.20 -3.44 116.25 115.31 1r63 h VAL 24 Ca 0.03 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 66.96 1r63 h VAL 24 Cb 0.82 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1r63 h VAL 24 CO 0.07 0.21 0.00 0.61 0.02 0.00 0.00 177.57 178.48 1r63 n GLY 25 N -0.75 0.72 0.00 2.17 0.00 0.51 -4.81 105.19 103.03 1r63 n GLY 25 Ca -0.01 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.68 0.00 -4.01 2.61 5.66 -0.05 -5.02 114.28 112.79 1r63 n THR 26 Ca 0.00 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.74 1r63 n THR 26 Cb 0.26 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.00 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 -1.58 4.92 0.22 1.09 -4.23 -1.26 -4.01 115.64 110.78 1r63 s THR 27 Ca 0.00 -0.91 -0.10 0.00 -1.18 0.00 0.00 61.69 59.51 1r63 s THR 27 Cb 0.00 -3.54 0.23 0.00 1.34 0.00 0.00 72.50 70.53 1r63 s THR 27 CO 0.00 -0.12 1.65 -0.61 -0.54 0.00 0.00 174.62 175.00 1r63 h GLN 28 N 2.18 0.10 -0.14 3.99 -0.00 -1.85 -1.26 115.11 118.12 1r63 h GLN 28 Ca -0.48 -0.01 0.03 0.00 -0.00 0.00 0.00 58.65 58.19 1r63 h GLN 28 Cb 1.20 -0.02 -0.03 0.00 0.00 0.00 0.00 27.48 28.63 1r63 h GLN 28 CO 0.65 0.07 -0.06 0.37 0.00 0.00 0.00 178.83 179.86 1r63 h GLN 29 N 0.10 -0.03 -0.86 1.69 5.75 -1.95 0.11 115.11 119.92 1r63 h GLN 29 Ca 0.35 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.84 1r63 h GLN 29 Cb 0.58 0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.10 1r63 h GLN 29 CO -0.59 -0.02 0.51 1.03 -2.65 0.00 0.00 178.83 177.11 1r63 h SER 30 N -0.04 1.04 -0.38 -0.69 0.87 -1.70 0.16 113.55 112.81 1r63 h SER 30 Ca 0.07 -0.08 0.07 0.00 -1.23 0.00 0.00 61.79 60.62 1r63 h SER 30 Cb 0.15 -0.26 -0.06 0.00 -0.44 0.00 0.00 62.40 61.78 1r63 h SER 30 CO -0.16 0.82 0.03 0.40 -0.53 0.00 0.00 176.83 177.38 1r63 h ILE 31 N 1.19 0.75 -0.82 2.23 5.03 -0.79 -2.34 117.51 122.75 1r63 h ILE 31 Ca 0.31 -0.05 -0.01 0.00 -0.12 0.00 0.00 64.86 64.99 1r63 h ILE 31 Cb -0.03 0.60 -0.04 0.00 -3.03 0.00 0.00 36.82 34.32 1r63 h ILE 31 CO -0.06 0.02 0.46 -0.08 -0.68 0.00 0.00 178.15 177.82 1r63 h GLU 32 N 0.14 1.13 -0.11 2.37 4.81 0.73 -0.32 114.58 123.33 1r63 h GLU 32 Ca 0.19 -0.12 0.03 0.00 -0.13 0.00 0.00 59.36 59.33 1r63 h GLU 32 Cb 0.25 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 1r63 h GLU 32 CO -0.29 0.82 0.08 1.96 -0.73 0.00 0.00 179.01 180.85 1r63 h GLN 33 N 1.14 0.00 0.04 1.92 1.08 -0.24 0.28 115.11 119.33 1r63 h GLN 33 Ca 0.29 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.49 1r63 h GLN 33 Cb 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 1r63 h GLN 33 CO -0.05 0.00 -0.02 1.25 -0.95 0.00 0.00 178.83 179.06 1r63 h LEU 34 N 0.00 -0.05 -1.50 1.46 5.85 -0.69 -3.25 115.31 117.13 1r63 h LEU 34 Ca 0.05 -0.58 0.07 0.00 0.84 0.00 0.00 57.88 58.26 1r63 h LEU 34 Cb 0.21 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 1r63 h LEU 34 CO -0.00 0.59 0.42 -0.08 -0.34 0.00 0.00 178.44 179.03 1r63 h GLU 35 N -0.72 0.58 -0.31 1.25 4.81 -0.54 0.21 114.58 119.87 1r63 h GLU 35 Ca -0.01 -0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.28 1r63 h GLU 35 Cb 0.63 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 1r63 h GLU 35 CO 0.01 0.39 0.33 -0.91 -0.73 0.00 0.00 179.01 178.10 1r63 h ASN 36 N 0.60 0.00 -0.16 1.04 2.35 -0.54 -3.42 115.58 115.46 1r63 h ASN 36 Ca 0.28 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.96 1r63 h ASN 36 Cb 0.33 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.67 1r63 h ASN 36 CO -0.09 0.00 -0.06 0.61 -1.65 0.00 0.00 177.43 176.24 1r63 n GLY 37 N -1.46 0.62 0.18 2.83 0.00 0.75 -4.88 105.19 103.24 1r63 n GLY 37 Ca 0.05 -0.40 -0.11 0.00 0.00 0.00 0.00 46.02 45.55 1r63 n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r63 h LYS 38 N 0.34 0.47 -6.76 1.61 1.57 -1.76 -3.44 116.57 108.60 1r63 h LYS 38 Ca -0.07 -0.39 -0.49 0.00 -1.87 0.00 0.00 60.65 57.83 1r63 h LYS 38 Cb 0.36 0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 1r63 h LYS 38 CO 0.10 1.03 0.20 0.99 -0.57 0.00 0.00 179.45 181.19 1r63 s THR 39 N -3.62 4.49 -0.05 -0.16 2.01 -1.23 -4.99 115.64 112.09 1r63 s THR 39 Ca -0.06 1.35 -0.01 0.00 0.31 0.00 0.00 61.69 63.27 1r63 s THR 39 Cb 0.10 -3.78 -0.02 0.00 0.01 0.00 0.00 72.50 68.80 1r63 s THR 39 CO 0.85 0.00 -0.06 0.29 -0.69 0.00 0.00 174.62 175.02 1r63 n LYS 40 N 0.17 0.11 -3.63 4.92 5.02 -1.26 -4.92 118.16 118.56 1r63 n LYS 40 Ca 0.02 0.04 -0.29 0.00 -2.02 0.00 0.00 58.31 56.05 1r63 n LYS 40 Cb 0.52 -0.83 -0.14 0.00 -0.02 0.00 0.00 35.03 34.56 1r63 n LYS 40 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1r63 s ARG 41 N -2.09 0.62 0.00 1.97 3.52 -1.26 -5.00 118.95 116.70 1r63 s ARG 41 Ca -0.07 -1.09 0.00 0.00 -0.13 0.00 0.00 55.73 54.45 1r63 s ARG 41 Cb 0.02 -1.69 0.00 0.00 -1.56 0.00 0.00 34.95 31.72 1r63 s ARG 41 CO 0.09 -1.05 0.00 -0.35 -0.81 0.00 0.00 175.30 173.18 1r63 n PRO 42 N 4.66 -0.64 -0.13 5.12 -0.04 -1.26 -5.02 135.00 137.69 1r63 n PRO 42 Ca 0.00 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.26 1r63 n PRO 42 Cb 0.40 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.74 1r63 n PRO 42 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1r63 n ARG 43 N -1.12 0.64 0.00 0.54 3.00 -1.26 -4.58 116.66 113.88 1r63 n ARG 43 Ca 0.00 0.18 0.00 0.00 -0.00 0.00 0.00 57.85 58.03 1r63 n ARG 43 Cb 0.00 -1.52 0.00 0.00 0.00 0.00 0.00 32.46 30.94 1r63 n ARG 43 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.63 179.60 1r63 n PHE 44 N -3.45 0.00 -0.01 -0.14 1.16 -1.26 -4.48 117.46 109.28 1r63 n PHE 44 Ca -0.47 -0.30 -0.13 0.00 -1.87 0.00 0.00 57.45 54.68 1r63 n PHE 44 Cb 0.97 -0.19 -0.07 0.00 -1.61 0.00 0.00 39.48 38.59 1r63 n PHE 44 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 1r63 h LEU 45 N 1.15 -1.39 -1.13 5.98 -0.00 -1.99 0.98 115.31 118.92 1r63 h LEU 45 Ca 0.00 0.18 -0.05 0.00 -0.00 0.00 0.00 57.88 58.01 1r63 h LEU 45 Cb 0.65 0.57 -0.02 0.00 -0.00 0.00 0.00 40.66 41.86 1r63 h LEU 45 CO 0.00 -0.43 0.02 1.55 -0.00 0.00 0.00 178.44 179.58 1r63 h PRO 46 N -0.50 0.64 -0.22 1.13 0.13 -1.98 0.12 132.00 131.32 1r63 h PRO 46 Ca 0.07 -0.14 -0.06 0.00 -0.87 0.00 0.00 66.00 65.00 1r63 h PRO 46 Cb 0.63 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.67 1r63 h PRO 46 CO -0.42 0.64 -0.09 0.93 -0.23 0.00 0.00 178.00 178.83 1r63 h GLU 47 N 0.61 0.45 -0.34 0.86 4.39 -1.78 0.91 114.58 119.68 1r63 h GLU 47 Ca 0.13 -0.19 -0.05 0.00 0.34 0.00 0.00 59.36 59.59 1r63 h GLU 47 Cb 0.35 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 1r63 h GLU 47 CO 0.01 0.71 0.02 1.25 -1.16 0.00 0.00 179.01 179.84 1r63 h LEU 48 N 0.17 0.58 0.02 1.33 6.46 -0.51 0.68 115.31 124.03 1r63 h LEU 48 Ca 0.05 -0.29 0.03 0.00 -0.12 0.00 0.00 57.88 57.55 1r63 h LEU 48 Cb 0.57 -0.15 -0.05 0.00 -0.73 0.00 0.00 40.66 40.29 1r63 h LEU 48 CO 0.03 0.73 -0.41 0.00 -0.62 0.00 0.00 178.44 178.17 1r63 h ALA 49 N 0.87 -0.65 -0.53 1.25 0.00 -0.75 0.00 119.26 119.45 1r63 h ALA 49 Ca 0.10 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1r63 h ALA 49 Cb 0.42 0.71 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1r63 h ALA 49 CO 0.01 -0.94 -0.04 0.66 0.00 0.00 0.00 179.25 178.94 1r63 h SER 50 N -0.57 0.91 0.18 0.00 4.64 -0.62 0.49 113.55 118.57 1r63 h SER 50 Ca 0.05 -0.26 -0.01 0.00 -0.47 0.00 0.00 61.79 61.10 1r63 h SER 50 Cb 0.64 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 1r63 h SER 50 CO -0.30 0.99 -0.08 0.00 -0.87 0.00 0.00 176.83 176.56 1r63 h ALA 51 N 1.10 -0.24 0.00 5.18 0.00 -0.68 -2.64 119.26 121.98 1r63 h ALA 51 Ca 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1r63 h ALA 51 Cb 0.55 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1r63 h ALA 51 CO 0.03 -0.61 0.00 -0.11 0.00 0.00 0.00 179.25 178.56 1r63 n LEU 52 N -5.17 0.51 -2.30 0.00 7.94 -0.03 -4.93 117.00 113.02 1r63 n LEU 52 Ca -0.09 0.59 -0.11 0.00 -1.11 0.00 0.00 56.01 55.29 1r63 n LEU 52 Cb 0.14 -0.48 0.05 0.00 0.53 0.00 0.00 43.42 43.66 1r63 n LEU 52 CO 0.34 -0.32 0.09 0.61 -1.11 0.00 0.00 177.39 177.00 1r63 n GLY 53 N 0.59 0.04 1.37 -3.96 0.00 0.15 -4.95 105.19 98.44 1r63 n GLY 53 Ca 0.04 -0.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.81 1r63 n GLY 53 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1r63 n VAL 54 N -3.19 0.00 -4.12 1.61 0.24 -0.20 -5.02 118.33 107.65 1r63 n VAL 54 Ca -0.10 -1.00 -0.23 0.00 -2.04 0.00 0.00 64.34 60.98 1r63 n VAL 54 Cb 0.57 0.41 -0.05 0.00 -1.47 0.00 0.00 33.84 33.30 1r63 n VAL 54 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1r63 s SER 55 N -2.01 5.44 0.20 -1.34 1.04 -1.26 -3.90 113.70 111.86 1r63 s SER 55 Ca 0.12 -0.26 -0.19 0.00 0.48 0.00 0.00 55.95 56.10 1r63 s SER 55 Cb 0.01 -1.36 0.16 0.00 0.10 0.00 0.00 66.02 64.92 1r63 s SER 55 CO 0.08 -0.02 1.59 0.58 0.98 0.00 0.00 173.24 176.46 1r63 h VAL 56 N 1.62 0.21 -0.09 5.02 2.07 -1.92 0.09 116.25 123.26 1r63 h VAL 56 Ca -0.48 0.00 -0.24 0.00 0.82 0.00 0.00 66.70 66.80 1r63 h VAL 56 Cb 1.23 0.21 0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1r63 h VAL 56 CO 0.61 0.00 -0.86 -2.24 0.02 0.00 0.00 177.57 175.10 1r63 h ASP 57 N -0.12 0.91 -0.74 0.57 2.03 -1.96 -2.43 116.42 114.68 1r63 h ASP 57 Ca 0.26 -0.68 -0.03 0.00 -0.73 0.00 0.00 57.03 55.85 1r63 h ASP 57 Cb 0.54 -0.27 -0.04 0.00 -0.83 0.00 0.00 39.33 38.73 1r63 h ASP 57 CO -0.68 1.45 0.37 -0.25 -1.03 0.00 0.00 179.24 179.10 1r63 h TRP 58 N 0.44 1.06 -0.09 4.15 7.01 -1.91 0.26 115.95 126.88 1r63 h TRP 58 Ca -0.08 -0.04 0.04 0.00 2.11 0.00 0.00 58.89 60.92 1r63 h TRP 58 Cb 1.51 -0.33 -0.05 0.00 -2.10 0.00 0.00 29.16 28.18 1r63 h TRP 58 CO 0.10 0.77 -0.22 -0.07 -2.79 0.00 0.00 178.44 176.22 1r63 h LEU 59 N 1.07 -0.67 0.40 0.65 3.38 -0.88 0.34 115.31 119.58 1r63 h LEU 59 Ca 0.26 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.32 1r63 h LEU 59 Cb 0.09 0.30 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1r63 h LEU 59 CO -0.03 -0.28 -0.19 0.25 0.09 0.00 0.00 178.44 178.28 1r63 h LEU 60 N -0.30 -0.45 0.00 1.67 6.46 -0.68 -3.38 115.31 118.63 1r63 h LEU 60 Ca 0.09 0.02 -0.09 0.00 -0.12 0.00 0.00 57.88 57.78 1r63 h LEU 60 Cb 0.43 0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 1r63 h LEU 60 CO -0.27 -0.30 -0.48 0.78 -0.62 0.00 0.00 178.44 177.55 1r63 h ASN 61 N -0.58 0.00 -3.91 1.25 2.35 -0.63 -3.43 115.58 110.63 1r63 h ASN 61 Ca -0.05 -0.76 -0.11 0.00 -0.55 0.00 0.00 56.30 54.83 1r63 h ASN 61 Cb 0.41 0.00 0.08 0.00 0.05 0.00 0.00 38.32 38.86 1r63 h ASN 61 CO 0.09 1.16 -0.35 0.61 -1.65 0.00 0.00 177.43 177.29 1r63 n GLY 62 N 1.55 0.07 0.48 2.83 0.00 0.12 -4.94 105.19 105.30 1r63 n GLY 62 Ca -0.18 0.02 0.06 0.00 0.00 0.00 0.00 46.02 45.92 1r63 n GLY 62 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95