#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 0.20 -1.00 0.44 2.10 -1.83 0.71 117.51 118.13 1r63 h ILE 2 Ca 0.00 -0.06 0.35 0.00 1.08 0.00 0.00 64.86 66.22 1r63 h ILE 2 Cb 0.00 0.01 -0.16 0.00 -1.09 0.00 0.00 36.82 35.58 1r63 h ILE 2 CO 0.00 0.03 0.56 0.77 -1.08 0.00 0.00 178.15 178.43 1r63 h SER 3 N 0.18 0.47 0.19 2.19 4.64 -1.66 0.10 113.55 119.65 1r63 h SER 3 Ca 0.69 0.21 -0.01 0.00 -0.47 0.00 0.00 61.79 62.21 1r63 h SER 3 Cb 1.59 0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.85 1r63 h SER 3 CO -0.70 -0.21 -0.09 0.28 -0.87 0.00 0.00 176.83 175.24 1r63 h SER 4 N 0.24 -0.22 -0.37 4.97 0.02 -1.15 -3.27 113.55 113.78 1r63 h SER 4 Ca 0.76 -0.09 0.06 0.00 -0.84 0.00 0.00 61.79 61.68 1r63 h SER 4 Cb 1.82 0.06 -0.09 0.00 0.14 0.00 0.00 62.40 64.33 1r63 h SER 4 CO -0.65 0.29 -0.45 0.03 -1.14 0.00 0.00 176.83 174.91 1r63 h ARG 5 N -1.04 -0.35 0.46 3.45 -0.00 -0.83 0.09 114.38 116.15 1r63 h ARG 5 Ca -0.03 0.02 -0.02 0.00 -0.50 0.00 0.00 59.98 59.46 1r63 h ARG 5 Cb 0.29 0.08 -0.00 0.00 0.00 0.00 0.00 29.97 30.34 1r63 h ARG 5 CO 0.04 -0.24 -0.26 0.28 0.00 0.00 0.00 179.97 179.80 1r63 h VAL 6 N -0.37 0.47 -0.19 2.04 2.07 -1.11 -0.05 116.25 119.11 1r63 h VAL 6 Ca 0.12 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.67 1r63 h VAL 6 Cb 0.60 0.47 -0.07 0.00 -1.52 0.00 0.00 31.29 30.77 1r63 h VAL 6 CO -0.55 0.00 -0.53 0.50 0.02 0.00 0.00 177.57 177.01 1r63 h LYS 7 N -0.67 -0.51 -0.38 1.57 3.64 -1.53 0.11 116.57 118.80 1r63 h LYS 7 Ca -0.06 0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 1r63 h LYS 7 Cb 0.53 0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.45 1r63 h LYS 7 CO 0.07 -0.34 0.12 0.66 -2.27 0.00 0.00 179.45 177.69 1r63 h SER 8 N -0.53 0.49 -0.46 4.20 4.64 -0.81 0.65 113.55 121.74 1r63 h SER 8 Ca 0.05 -0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1r63 h SER 8 Cb 0.66 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.60 1r63 h SER 8 CO -0.47 0.48 0.14 0.11 -0.87 0.00 0.00 176.83 176.22 1r63 h LYS 9 N 0.54 0.72 -0.55 4.77 1.79 -0.40 -0.60 116.57 122.84 1r63 h LYS 9 Ca 0.13 -0.16 -0.02 0.00 -2.18 0.00 0.00 60.65 58.43 1r63 h LYS 9 Cb 0.16 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 30.68 1r63 h LYS 9 CO -0.01 0.69 0.28 -0.09 -1.08 0.00 0.00 179.45 179.24 1r63 h ARG 10 N 0.61 0.79 -0.20 3.15 2.43 0.14 0.12 114.38 121.41 1r63 h ARG 10 Ca 0.15 -0.11 0.03 0.00 -0.81 0.00 0.00 59.98 59.24 1r63 h ARG 10 Cb 0.27 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 1r63 h ARG 10 CO -0.00 0.63 0.02 0.82 -1.51 0.00 0.00 179.97 179.93 1r63 h ILE 11 N 0.75 0.89 -0.21 1.20 5.03 -1.10 0.21 117.51 124.28 1r63 h ILE 11 Ca 0.19 -0.03 0.05 0.00 -0.12 0.00 0.00 64.86 64.95 1r63 h ILE 11 Cb 0.10 0.79 -0.05 0.00 -3.03 0.00 0.00 36.82 34.63 1r63 h ILE 11 CO -0.03 0.02 -0.11 -0.61 -0.68 0.00 0.00 178.15 176.74 1r63 h GLN 12 N 0.09 -0.09 -0.00 2.37 -0.00 0.29 -0.14 115.11 117.63 1r63 h GLN 12 Ca 0.09 0.01 -0.04 0.00 -0.00 0.00 0.00 58.65 58.70 1r63 h GLN 12 Cb 0.10 0.02 -0.01 0.00 0.00 0.00 0.00 27.48 27.59 1r63 h GLN 12 CO -0.14 -0.06 -0.20 -0.07 0.00 0.00 0.00 178.83 178.37 1r63 h LEU 13 N -0.09 0.00 -0.96 -2.39 4.07 -0.54 -3.46 115.31 111.94 1r63 h LEU 13 Ca 0.11 -0.00 -0.07 0.00 0.08 0.00 0.00 57.88 58.01 1r63 h LEU 13 Cb 0.26 -0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.02 1r63 h LEU 13 CO -0.26 0.20 -0.12 0.61 -1.08 0.00 0.00 178.44 177.79 1r63 n GLY 14 N -0.97 0.70 3.47 0.83 0.00 0.63 -5.06 105.19 104.79 1r63 n GLY 14 Ca -0.02 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.06 3.08 0.87 0.99 1.43 -0.53 -5.02 118.68 117.43 1r63 s LEU 15 Ca 0.10 -0.18 -0.11 0.00 -1.03 0.00 0.00 54.13 52.92 1r63 s LEU 15 Cb -0.04 -1.72 0.16 0.00 0.03 0.00 0.00 46.19 44.62 1r63 s LEU 15 CO 0.12 0.19 1.20 0.54 0.23 0.00 0.00 176.35 178.63 1r63 s ASN 16 N 0.24 3.67 0.16 2.29 2.20 -1.26 -4.04 114.94 118.20 1r63 s ASN 16 Ca -0.05 0.12 -0.16 0.00 -0.94 0.00 0.00 52.86 51.84 1r63 s ASN 16 Cb -0.14 -0.33 0.09 0.00 -2.00 0.00 0.00 41.25 38.87 1r63 s ASN 16 CO 0.04 -2.36 1.73 1.56 -2.94 0.00 0.00 177.10 175.13 1r63 h GLN 17 N -1.21 0.20 -0.32 3.55 4.20 -1.99 -0.79 115.11 118.74 1r63 h GLN 17 Ca -0.42 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.27 1r63 h GLN 17 Cb 1.25 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.98 1r63 h GLN 17 CO 0.42 0.13 0.16 0.00 -0.67 0.00 0.00 178.83 178.86 1r63 h ALA 18 N 1.28 0.42 -0.02 3.87 0.00 -1.94 0.13 119.26 123.00 1r63 h ALA 18 Ca 0.18 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1r63 h ALA 18 Cb 0.21 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1r63 h ALA 18 CO -0.24 -0.03 -0.13 0.93 0.00 0.00 0.00 179.25 179.79 1r63 h GLU 19 N 0.39 -0.20 0.46 0.00 5.08 -1.87 -0.06 114.58 118.38 1r63 h GLU 19 Ca 0.11 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 1r63 h GLU 19 Cb 0.12 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1r63 h GLU 19 CO -0.01 -0.13 -0.45 1.25 -1.00 0.00 0.00 179.01 178.67 1r63 h LEU 20 N -0.20 -1.22 -0.99 1.33 6.46 -0.97 -1.80 115.31 117.92 1r63 h LEU 20 Ca 0.05 0.10 0.12 0.00 -0.12 0.00 0.00 57.88 58.03 1r63 h LEU 20 Cb 0.27 0.40 -0.14 0.00 -0.73 0.00 0.00 40.66 40.46 1r63 h LEU 20 CO -0.14 -0.60 -0.48 0.00 -0.62 0.00 0.00 178.44 176.60 1r63 h ALA 21 N -1.03 -0.16 -0.56 1.25 0.00 -0.58 0.14 119.26 118.32 1r63 h ALA 21 Ca -0.06 0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 1r63 h ALA 21 Cb 0.78 1.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.72 1r63 h ALA 21 CO -0.05 -0.78 -0.01 -0.56 0.00 0.00 0.00 179.25 177.86 1r63 h GLN 22 N -0.01 1.00 -0.41 0.00 3.07 -0.87 0.31 115.11 118.20 1r63 h GLN 22 Ca 0.26 -0.32 -0.05 0.00 0.09 0.00 0.00 58.65 58.63 1r63 h GLN 22 Cb 0.52 -0.09 -0.02 0.00 0.08 0.00 0.00 27.48 27.97 1r63 h GLN 22 CO -0.96 1.00 0.05 0.87 0.09 0.00 0.00 178.83 179.88 1r63 h LYS 23 N 0.88 0.63 0.00 0.06 1.57 -0.37 0.34 116.57 119.67 1r63 h LYS 23 Ca 0.16 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1r63 h LYS 23 Cb 0.55 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1r63 h LYS 23 CO 0.03 0.61 0.00 0.28 -0.57 0.00 0.00 179.45 179.80 1r63 h VAL 24 N 0.60 0.00 -4.56 0.50 2.07 -0.12 -3.47 116.25 111.28 1r63 h VAL 24 Ca 0.13 -0.43 -0.41 0.00 0.82 0.00 0.00 66.70 66.82 1r63 h VAL 24 Cb 0.31 1.31 0.05 0.00 -1.52 0.00 0.00 31.29 31.43 1r63 h VAL 24 CO 0.01 0.00 -0.60 0.61 0.02 0.00 0.00 177.57 177.60 1r63 n GLY 25 N 0.37 -0.52 0.00 2.17 0.00 0.86 -4.98 105.19 103.09 1r63 n GLY 25 Ca 0.03 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -4.47 0.00 -4.17 2.61 5.66 0.03 -4.99 114.28 108.95 1r63 n THR 26 Ca -0.11 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.55 1r63 n THR 26 Cb 0.62 -0.12 -0.08 0.00 -1.55 0.00 0.00 70.33 69.20 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 -0.66 4.65 0.26 1.09 -4.23 -1.26 -3.89 115.64 111.60 1r63 s THR 27 Ca 0.00 -0.31 -0.01 0.00 -1.18 0.00 0.00 61.69 60.19 1r63 s THR 27 Cb 0.00 -3.06 0.24 0.00 1.34 0.00 0.00 72.50 71.02 1r63 s THR 27 CO 0.00 0.46 1.76 -0.61 -0.54 0.00 0.00 174.62 175.69 1r63 h GLN 28 N 4.52 0.61 -0.35 3.99 4.15 -1.92 0.12 115.11 126.24 1r63 h GLN 28 Ca -0.50 -0.04 0.05 0.00 0.77 0.00 0.00 58.65 58.93 1r63 h GLN 28 Cb 1.19 -0.14 -0.04 0.00 0.21 0.00 0.00 27.48 28.70 1r63 h GLN 28 CO 0.59 0.40 0.09 0.37 -1.93 0.00 0.00 178.83 178.35 1r63 h GLN 29 N 0.63 0.21 -0.17 1.69 4.15 -1.97 0.71 115.11 120.35 1r63 h GLN 29 Ca 0.46 -0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.89 1r63 h GLN 29 Cb 0.63 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.25 1r63 h GLN 29 CO -0.36 0.14 -0.00 0.77 -1.93 0.00 0.00 178.83 177.45 1r63 h SER 30 N 0.21 -0.08 -0.16 -0.69 0.02 -1.59 -0.51 113.55 110.76 1r63 h SER 30 Ca 0.16 0.04 0.05 0.00 -0.84 0.00 0.00 61.79 61.21 1r63 h SER 30 Cb 0.17 0.07 -0.07 0.00 0.14 0.00 0.00 62.40 62.72 1r63 h SER 30 CO -0.20 -0.01 -0.31 0.40 -1.14 0.00 0.00 176.83 175.56 1r63 h ILE 31 N 0.05 0.30 -0.04 3.27 1.08 -0.31 0.28 117.51 122.13 1r63 h ILE 31 Ca 0.08 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.58 1r63 h ILE 31 Cb 0.10 0.30 -0.04 0.00 -3.07 0.00 0.00 36.82 34.11 1r63 h ILE 31 CO -0.14 0.00 -0.16 -0.08 -0.69 0.00 0.00 178.15 177.08 1r63 h GLU 32 N -0.37 -0.23 0.00 2.37 4.57 -0.61 0.12 114.58 120.43 1r63 h GLU 32 Ca 0.11 0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.29 1r63 h GLU 32 Cb 0.53 0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 29.17 1r63 h GLU 32 CO -0.37 -0.16 -0.05 1.96 -1.18 0.00 0.00 179.01 179.22 1r63 h GLN 33 N -0.24 0.00 0.19 1.92 4.20 -0.71 -0.26 115.11 120.22 1r63 h GLN 33 Ca 0.07 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 1r63 h GLN 33 Cb 0.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.11 1r63 h GLN 33 CO -0.18 0.05 -0.09 1.25 -0.67 0.00 0.00 178.83 179.18 1r63 h LEU 34 N 0.00 -0.22 -0.14 1.46 5.85 0.95 -1.04 115.31 122.17 1r63 h LEU 34 Ca -0.00 -0.25 0.02 0.00 0.84 0.00 0.00 57.88 58.49 1r63 h LEU 34 Cb 0.16 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 1r63 h LEU 34 CO 0.01 0.33 -0.33 -0.33 -0.34 0.00 0.00 178.44 177.77 1r63 h GLU 35 N -0.96 -0.30 0.00 1.25 3.07 -0.36 -0.83 114.58 116.45 1r63 h GLU 35 Ca -0.03 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1r63 h GLU 35 Cb 0.45 0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1r63 h GLU 35 CO 0.04 -0.20 0.00 0.27 -1.40 0.00 0.00 179.01 177.73 1r63 n ASN 36 N -4.30 0.00 0.00 1.42 0.23 -0.15 -1.84 115.26 110.62 1r63 n ASN 36 Ca -0.03 0.34 0.00 0.00 -0.53 0.00 0.00 54.58 54.36 1r63 n ASN 36 Cb 0.22 -0.34 0.00 0.00 -2.08 0.00 0.00 39.78 37.58 1r63 n ASN 36 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1r63 n GLY 37 N -1.34 0.44 0.16 4.83 0.00 -0.32 -4.91 105.19 104.05 1r63 n GLY 37 Ca 0.00 -0.96 0.02 0.00 0.00 0.00 0.00 46.02 45.08 1r63 n GLY 37 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1r63 h LYS 38 N 0.00 0.00 -7.51 1.61 3.64 -1.41 -3.46 116.57 109.45 1r63 h LYS 38 Ca 0.00 0.00 -0.46 0.00 -1.27 0.00 0.00 60.65 58.92 1r63 h LYS 38 Cb 0.31 0.00 0.12 0.00 -0.41 0.00 0.00 32.23 32.24 1r63 h LYS 38 CO 0.00 0.51 0.30 0.99 -2.27 0.00 0.00 179.45 178.99 1r63 s THR 39 N -3.40 2.10 0.00 1.00 2.01 -0.71 -5.02 115.64 111.62 1r63 s THR 39 Ca 0.01 -0.19 0.00 0.00 0.31 0.00 0.00 61.69 61.81 1r63 s THR 39 Cb 0.11 -2.91 0.00 0.00 0.01 0.00 0.00 72.50 69.70 1r63 s THR 39 CO 0.73 0.00 0.00 0.29 -0.69 0.00 0.00 174.62 174.95 1r63 n LYS 40 N -3.28 0.00 -3.23 4.92 4.76 -1.26 -5.01 118.16 115.05 1r63 n LYS 40 Ca 0.12 0.00 -0.19 0.00 -2.87 0.00 0.00 58.31 55.38 1r63 n LYS 40 Cb 0.60 -0.11 -0.07 0.00 -1.84 0.00 0.00 35.03 33.61 1r63 n LYS 40 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1r63 s ARG 41 N -0.70 0.86 0.72 1.97 3.00 -1.26 -5.14 118.95 118.40 1r63 s ARG 41 Ca 0.00 -1.47 -0.11 0.00 -1.00 0.00 0.00 55.73 53.14 1r63 s ARG 41 Cb 0.00 -0.88 0.02 0.00 0.00 0.00 0.00 34.95 34.09 1r63 s ARG 41 CO 0.00 -1.31 1.08 -1.25 0.00 0.00 0.00 175.30 173.82 1r63 s PRO 42 N 0.69 2.76 -0.39 5.12 0.04 -1.26 -4.93 135.00 137.03 1r63 s PRO 42 Ca 0.27 0.61 -0.06 0.00 0.04 0.00 0.00 61.00 61.86 1r63 s PRO 42 Cb -0.04 -2.00 -0.16 0.00 0.04 0.00 0.00 34.50 32.35 1r63 s PRO 42 CO -0.10 -1.14 3.30 0.54 0.04 0.00 0.00 177.00 179.64 1r63 n ARG 43 N -3.10 2.45 -0.14 4.56 1.74 -1.26 -3.22 116.66 117.69 1r63 n ARG 43 Ca 0.07 -1.56 0.00 0.00 -0.77 0.00 0.00 57.85 55.59 1r63 n ARG 43 Cb 0.56 -2.17 0.00 0.00 -1.02 0.00 0.00 32.46 29.83 1r63 n ARG 43 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 1r63 n PHE 44 N 2.29 0.00 -0.17 -1.55 -1.74 -1.26 -5.01 117.46 110.01 1r63 n PHE 44 Ca 0.50 0.00 -0.04 0.00 -0.56 0.00 0.00 57.45 57.35 1r63 n PHE 44 Cb 0.72 0.17 0.02 0.00 1.52 0.00 0.00 39.48 41.91 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 0.00 -0.89 -1.18 5.98 6.46 -1.94 0.13 115.31 123.87 1r63 h LEU 45 Ca 0.00 0.20 -0.01 0.00 -0.12 0.00 0.00 57.88 57.95 1r63 h LEU 45 Cb 0.96 0.47 -0.03 0.00 -0.73 0.00 0.00 40.66 41.32 1r63 h LEU 45 CO 0.00 -0.27 0.38 1.55 -0.62 0.00 0.00 178.44 179.48 1r63 h PRO 46 N -0.13 0.95 -0.56 5.25 0.13 -1.96 -0.88 132.00 134.81 1r63 h PRO 46 Ca 0.24 -0.10 -0.03 0.00 -0.87 0.00 0.00 66.00 65.25 1r63 h PRO 46 Cb 0.51 -0.19 -0.03 0.00 0.13 0.00 0.00 31.00 31.42 1r63 h PRO 46 CO -0.61 0.69 0.25 0.93 -0.23 0.00 0.00 178.00 179.02 1r63 h GLU 47 N 0.96 0.82 0.08 0.86 4.39 -1.24 0.19 114.58 120.63 1r63 h GLU 47 Ca 0.24 -0.13 0.02 0.00 0.34 0.00 0.00 59.36 59.83 1r63 h GLU 47 Cb 0.01 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.49 1r63 h GLU 47 CO -0.04 0.69 -0.21 1.25 -1.16 0.00 0.00 179.01 179.54 1r63 h LEU 48 N 0.76 -0.59 -0.60 1.33 6.46 -0.65 0.87 115.31 122.89 1r63 h LEU 48 Ca 0.19 0.07 0.12 0.00 -0.12 0.00 0.00 57.88 58.14 1r63 h LEU 48 Cb 0.16 0.23 -0.09 0.00 -0.73 0.00 0.00 40.66 40.23 1r63 h LEU 48 CO -0.02 -0.29 0.09 0.00 -0.62 0.00 0.00 178.44 177.61 1r63 h ALA 49 N 0.45 0.68 -0.29 1.25 0.00 -0.54 -0.41 119.26 120.40 1r63 h ALA 49 Ca 0.04 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1r63 h ALA 49 Cb 0.41 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1r63 h ALA 49 CO -0.14 -0.34 0.15 0.77 0.00 0.00 0.00 179.25 179.70 1r63 h SER 50 N 0.21 0.37 -0.97 0.00 0.02 -0.30 0.40 113.55 113.28 1r63 h SER 50 Ca 0.32 -0.10 0.11 0.00 -0.84 0.00 0.00 61.79 61.27 1r63 h SER 50 Cb 0.48 -0.09 -0.08 0.00 0.14 0.00 0.00 62.40 62.86 1r63 h SER 50 CO -0.44 0.36 0.62 0.00 -1.14 0.00 0.00 176.83 176.23 1r63 h ALA 51 N 1.02 1.55 0.00 3.77 0.00 0.73 -0.17 119.26 126.16 1r63 h ALA 51 Ca 0.10 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1r63 h ALA 51 Cb 0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1r63 h ALA 51 CO -0.02 0.23 -0.40 -0.07 0.00 0.00 0.00 179.25 179.00 1r63 h LEU 52 N 0.98 0.00 -1.41 0.00 3.38 -0.83 -3.48 115.31 113.94 1r63 h LEU 52 Ca 0.46 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 58.21 1r63 h LEU 52 Cb 0.43 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.27 1r63 h LEU 52 CO -0.22 0.25 -0.44 0.61 0.09 0.00 0.00 178.44 178.73 1r63 n GLY 53 N 1.18 -0.00 3.49 0.83 0.00 0.12 -4.99 105.19 105.82 1r63 n GLY 53 Ca 0.02 -0.12 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.21 0.92 0.25 1.61 -7.23 -0.06 -5.00 120.40 107.68 1r63 s VAL 54 Ca 0.15 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.26 1r63 s VAL 54 Cb -0.07 -2.56 -0.06 0.00 0.56 0.00 0.00 36.38 34.25 1r63 s VAL 54 CO 0.44 0.00 0.52 -0.94 -0.31 0.00 0.00 175.10 174.81 1r63 s SER 55 N -3.56 6.51 0.28 4.85 1.04 -1.26 -4.11 113.70 117.45 1r63 s SER 55 Ca 0.29 0.76 -0.03 0.00 0.48 0.00 0.00 55.95 57.45 1r63 s SER 55 Cb 0.06 -2.16 0.40 0.00 0.10 0.00 0.00 66.02 64.42 1r63 s SER 55 CO 0.14 -0.12 1.91 0.58 0.98 0.00 0.00 173.24 176.74 1r63 h VAL 56 N 1.66 1.22 -0.65 5.02 2.07 -1.94 0.31 116.25 123.95 1r63 h VAL 56 Ca -0.47 -0.54 -0.05 0.00 0.82 0.00 0.00 66.70 66.46 1r63 h VAL 56 Cb 1.18 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 1r63 h VAL 56 CO 0.68 0.24 0.22 0.44 0.02 0.00 0.00 177.57 179.18 1r63 h ASP 57 N 1.05 0.93 -0.67 0.57 3.32 -1.98 0.68 116.42 120.32 1r63 h ASP 57 Ca 0.27 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1r63 h ASP 57 Cb 0.01 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.29 1r63 h ASP 57 CO -0.04 0.88 0.33 -0.25 -1.72 0.00 0.00 179.24 178.43 1r63 h TRP 58 N 0.93 0.95 0.46 4.55 7.01 -1.75 0.17 115.95 128.28 1r63 h TRP 58 Ca 0.21 -0.04 -0.02 0.00 2.11 0.00 0.00 58.89 61.15 1r63 h TRP 58 Cb 0.27 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 27.01 1r63 h TRP 58 CO 0.02 0.71 -0.40 -0.07 -2.79 0.00 0.00 178.44 175.91 1r63 h LEU 59 N 0.92 -1.07 0.51 0.65 3.38 -0.59 -1.85 115.31 117.26 1r63 h LEU 59 Ca 0.23 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.26 1r63 h LEU 59 Cb 0.11 0.34 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1r63 h LEU 59 CO -0.03 -0.55 -0.26 0.25 0.09 0.00 0.00 178.44 177.94 1r63 h LEU 60 N -0.84 -0.63 0.00 1.67 5.85 -0.66 -3.40 115.31 117.30 1r63 h LEU 60 Ca -0.06 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1r63 h LEU 60 Cb 0.71 0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.91 1r63 h LEU 60 CO -0.02 -0.43 -0.58 0.59 -0.34 0.00 0.00 178.44 177.66 1r63 n ASN 61 N -5.40 1.33 0.00 1.25 4.13 0.55 -4.82 115.26 112.30 1r63 n ASN 61 Ca -0.12 0.22 0.00 0.00 1.68 0.00 0.00 54.58 56.36 1r63 n ASN 61 Cb 0.30 -0.58 0.00 0.00 -1.54 0.00 0.00 39.78 37.96 1r63 n ASN 61 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1r63 n GLY 62 N 1.96 0.25 3.10 7.41 0.00 -0.69 -4.98 105.19 112.23 1r63 n GLY 62 Ca -0.08 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1r63 n GLY 62 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95