#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 1.24 -0.21 -1.33 6.09 -1.92 -2.88 117.51 118.50 1r63 h ILE 2 Ca 0.00 -0.60 0.05 0.00 -1.37 0.00 0.00 64.86 62.95 1r63 h ILE 2 Cb 0.00 0.15 -0.06 0.00 0.47 0.00 0.00 36.82 37.38 1r63 h ILE 2 CO 0.00 0.27 -0.15 0.77 -3.07 0.00 0.00 178.15 175.97 1r63 h SER 3 N 1.13 -0.49 -0.52 2.19 4.64 -1.83 -3.05 113.55 115.61 1r63 h SER 3 Ca 0.29 0.10 0.10 0.00 -0.47 0.00 0.00 61.79 61.81 1r63 h SER 3 Cb 0.03 0.25 -0.11 0.00 -0.31 0.00 0.00 62.40 62.26 1r63 h SER 3 CO -0.05 -0.19 -0.32 0.28 -0.87 0.00 0.00 176.83 175.68 1r63 h SER 4 N -0.15 -1.10 -0.07 4.97 0.02 -1.81 0.81 113.55 116.22 1r63 h SER 4 Ca 0.12 0.21 -0.03 0.00 -0.84 0.00 0.00 61.79 61.25 1r63 h SER 4 Cb 0.33 0.54 -0.00 0.00 0.14 0.00 0.00 62.40 63.41 1r63 h SER 4 CO -0.30 -0.30 -0.09 0.03 -1.14 0.00 0.00 176.83 175.02 1r63 h ARG 5 N -0.18 0.19 -0.46 3.45 -0.00 -1.67 -1.04 114.38 114.66 1r63 h ARG 5 Ca 0.21 -0.11 0.09 0.00 -0.50 0.00 0.00 59.98 59.68 1r63 h ARG 5 Cb 0.54 0.01 -0.08 0.00 0.00 0.00 0.00 29.97 30.44 1r63 h ARG 5 CO -0.63 0.65 -0.02 0.28 0.00 0.00 0.00 179.97 180.25 1r63 h VAL 6 N -0.27 0.62 0.54 2.04 2.07 -1.23 0.47 116.25 120.49 1r63 h VAL 6 Ca 0.01 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 1r63 h VAL 6 Cb 0.63 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 1r63 h VAL 6 CO 0.02 0.02 -0.50 0.50 0.02 0.00 0.00 177.57 177.62 1r63 h LYS 7 N 0.09 -0.99 -0.51 1.57 3.64 -0.80 -2.53 116.57 117.03 1r63 h LYS 7 Ca 0.23 0.07 0.08 0.00 -1.27 0.00 0.00 60.65 59.76 1r63 h LYS 7 Cb 0.34 0.23 -0.10 0.00 -0.41 0.00 0.00 32.23 32.29 1r63 h LYS 7 CO -0.40 -0.66 -0.45 1.03 -2.27 0.00 0.00 179.45 176.70 1r63 h SER 8 N -1.03 -1.53 -0.54 4.20 0.87 -0.54 -0.47 113.55 114.51 1r63 h SER 8 Ca -0.07 0.24 -0.01 0.00 -1.23 0.00 0.00 61.79 60.72 1r63 h SER 8 Cb 0.88 0.68 -0.03 0.00 -0.44 0.00 0.00 62.40 63.49 1r63 h SER 8 CO -0.04 -0.35 0.32 0.11 -0.53 0.00 0.00 176.83 176.33 1r63 h LYS 9 N -0.27 0.77 -0.64 2.24 1.79 -0.91 1.00 116.57 120.54 1r63 h LYS 9 Ca 0.15 -0.07 -0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1r63 h LYS 9 Cb 0.57 -0.16 -0.03 0.00 -1.58 0.00 0.00 32.23 31.03 1r63 h LYS 9 CO -0.65 0.56 0.38 -0.09 -1.08 0.00 0.00 179.45 178.57 1r63 h ARG 10 N 0.78 0.87 -0.21 3.15 2.43 -0.64 0.79 114.38 121.54 1r63 h ARG 10 Ca 0.20 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 1r63 h ARG 10 Cb 0.00 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.37 1r63 h ARG 10 CO -0.03 0.62 0.05 0.82 -1.51 0.00 0.00 179.97 179.92 1r63 h ILE 11 N 0.86 1.21 -0.76 1.20 5.03 -0.68 0.21 117.51 124.58 1r63 h ILE 11 Ca 0.23 -0.68 0.10 0.00 -0.12 0.00 0.00 64.86 64.39 1r63 h ILE 11 Cb -0.02 1.25 -0.08 0.00 -3.03 0.00 0.00 36.82 34.95 1r63 h ILE 11 CO -0.04 0.21 0.39 1.56 -0.68 0.00 0.00 178.15 179.59 1r63 h GLN 12 N 0.16 0.63 0.00 2.37 4.20 -0.41 0.26 115.11 122.32 1r63 h GLN 12 Ca 0.07 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 1r63 h GLN 12 Cb 0.28 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.91 1r63 h GLN 12 CO 0.00 0.42 -0.15 -0.07 -0.67 0.00 0.00 178.83 178.36 1r63 h LEU 13 N 0.65 0.00 0.00 1.46 3.38 -0.72 -3.46 115.31 116.62 1r63 h LEU 13 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 1r63 h LEU 13 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1r63 h LEU 13 CO -0.28 0.15 0.00 0.61 0.09 0.00 0.00 178.44 179.01 1r63 n GLY 14 N -0.42 0.57 2.35 0.83 0.00 0.92 -5.04 105.19 104.40 1r63 n GLY 14 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 1r63 n GLY 14 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1r63 n LEU 15 N 0.00 0.00 -3.71 0.99 4.77 -0.03 -4.97 117.00 114.05 1r63 n LEU 15 Ca 0.00 -0.89 -0.10 0.00 -0.03 0.00 0.00 56.01 54.99 1r63 n LEU 15 Cb 0.00 -0.62 -0.05 0.00 -2.33 0.00 0.00 43.42 40.42 1r63 n LEU 15 CO 0.00 -1.09 0.10 0.54 -1.33 0.00 0.00 177.39 175.61 1r63 s ASN 16 N -3.96 -0.14 0.08 -1.43 4.22 -1.26 -4.30 114.94 108.14 1r63 s ASN 16 Ca 0.46 -0.43 -0.28 0.00 -2.14 0.00 0.00 52.86 50.47 1r63 s ASN 16 Cb -0.01 0.45 -0.12 0.00 1.28 0.00 0.00 41.25 42.84 1r63 s ASN 16 CO 0.32 -0.84 1.44 1.56 -2.04 0.00 0.00 177.10 177.54 1r63 h GLN 17 N 2.45 -0.65 -0.50 3.55 4.20 -1.99 0.17 115.11 122.33 1r63 h GLN 17 Ca -0.33 0.04 0.08 0.00 0.06 0.00 0.00 58.65 58.50 1r63 h GLN 17 Cb 1.24 0.15 -0.06 0.00 0.30 0.00 0.00 27.48 29.11 1r63 h GLN 17 CO 0.48 -0.44 0.13 0.00 -0.67 0.00 0.00 178.83 178.34 1r63 h ALA 18 N -0.89 0.59 -0.09 3.87 0.00 -1.98 0.26 119.26 121.02 1r63 h ALA 18 Ca -0.02 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.02 1r63 h ALA 18 Cb 0.64 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.47 1r63 h ALA 18 CO -0.16 -0.27 -0.38 0.93 0.00 0.00 0.00 179.25 179.37 1r63 h GLU 19 N 0.29 -0.46 0.27 0.00 4.39 -1.88 0.18 114.58 117.36 1r63 h GLU 19 Ca 0.25 0.03 0.01 0.00 0.34 0.00 0.00 59.36 59.98 1r63 h GLU 19 Cb 0.31 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.03 1r63 h GLU 19 CO -0.29 -0.31 -0.46 1.25 -1.16 0.00 0.00 179.01 178.04 1r63 h LEU 20 N -0.48 -1.32 -0.59 1.33 5.85 -0.39 -0.26 115.31 119.45 1r63 h LEU 20 Ca 0.08 0.13 0.12 0.00 0.84 0.00 0.00 57.88 59.04 1r63 h LEU 20 Cb 0.60 0.47 -0.11 0.00 0.37 0.00 0.00 40.66 42.00 1r63 h LEU 20 CO -0.35 -0.56 -0.11 0.00 -0.34 0.00 0.00 178.44 177.07 1r63 h ALA 21 N -0.47 0.43 0.10 1.25 0.00 -0.56 0.16 119.26 120.18 1r63 h ALA 21 Ca -0.01 0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1r63 h ALA 21 Cb 0.76 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1r63 h ALA 21 CO -0.18 -0.42 -0.06 1.96 0.00 0.00 0.00 179.25 180.55 1r63 h GLN 22 N 0.02 -0.15 -0.01 0.00 7.50 -0.26 0.15 115.11 122.36 1r63 h GLN 22 Ca 0.29 0.01 -0.14 0.00 0.50 0.00 0.00 58.65 59.31 1r63 h GLN 22 Cb 0.45 0.03 -0.02 0.00 0.05 0.00 0.00 27.48 28.00 1r63 h GLN 22 CO -0.58 -0.10 -0.67 1.57 -1.50 0.00 0.00 178.83 177.54 1r63 h LYS 23 N -0.16 0.05 -0.62 1.46 2.10 -0.19 -0.63 116.57 118.57 1r63 h LYS 23 Ca -0.01 -0.04 0.12 0.00 -2.00 0.00 0.00 60.65 58.72 1r63 h LYS 23 Cb 0.14 0.01 -0.09 0.00 -0.90 0.00 0.00 32.23 31.38 1r63 h LYS 23 CO 0.01 0.70 0.14 0.28 -2.00 0.00 0.00 179.45 178.58 1r63 h VAL 24 N 0.03 0.63 -0.02 0.07 2.07 -0.58 -3.47 116.25 114.98 1r63 h VAL 24 Ca -0.01 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1r63 h VAL 24 Cb 1.19 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 1r63 h VAL 24 CO 0.09 0.05 0.00 0.61 0.02 0.00 0.00 177.57 178.34 1r63 n GLY 25 N -1.32 1.58 0.00 2.17 0.00 -0.13 -4.88 105.19 102.61 1r63 n GLY 25 Ca 0.10 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.55 0.00 -3.62 2.61 5.66 -0.22 -5.02 114.28 112.14 1r63 n THR 26 Ca 0.00 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.67 1r63 n THR 26 Cb 0.11 -0.08 -0.05 0.00 -1.55 0.00 0.00 70.33 68.76 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 -0.73 5.13 0.19 1.09 -4.23 -1.26 -3.94 115.64 111.89 1r63 s THR 27 Ca 0.00 0.22 -0.17 0.00 -1.18 0.00 0.00 61.69 60.56 1r63 s THR 27 Cb 0.00 -3.63 0.16 0.00 1.34 0.00 0.00 72.50 70.38 1r63 s THR 27 CO 0.00 0.13 1.32 1.67 -0.54 0.00 0.00 174.62 177.20 1r63 n GLN 28 N 0.40 -0.23 -0.33 3.99 -0.06 -1.26 -0.84 117.38 119.06 1r63 n GLN 28 Ca -0.05 1.31 0.16 0.00 -2.00 0.00 0.00 57.00 56.43 1r63 n GLN 28 Cb 0.52 -1.94 0.39 0.00 -4.06 0.00 0.00 30.24 25.15 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 0.60 0.05 3.69 -0.00 -1.98 0.28 115.11 117.75 1r63 h GLN 29 Ca 0.27 -0.04 0.00 0.00 -0.00 0.00 0.00 58.65 58.89 1r63 h GLN 29 Cb 0.48 -0.14 -0.01 0.00 0.00 0.00 0.00 27.48 27.82 1r63 h GLN 29 CO -0.84 0.40 -0.05 0.77 0.00 0.00 0.00 178.83 179.11 1r63 h SER 30 N 0.62 -0.12 0.02 -0.69 0.02 -1.38 -0.04 113.55 111.96 1r63 h SER 30 Ca 0.57 0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 61.43 1r63 h SER 30 Cb 1.10 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.67 1r63 h SER 30 CO -0.35 -0.08 -0.33 0.40 -1.14 0.00 0.00 176.83 175.34 1r63 h ILE 31 N -0.11 1.28 0.69 3.27 5.03 -0.73 -1.55 117.51 125.39 1r63 h ILE 31 Ca 0.00 -1.41 -0.03 0.00 -0.12 0.00 0.00 64.86 63.31 1r63 h ILE 31 Cb 0.11 1.48 -0.01 0.00 -3.03 0.00 0.00 36.82 35.37 1r63 h ILE 31 CO -0.02 0.44 -0.48 -0.08 -0.68 0.00 0.00 178.15 177.33 1r63 h GLU 32 N 0.38 -1.08 -0.95 2.37 4.22 -0.33 0.78 114.58 119.98 1r63 h GLU 32 Ca 0.05 0.07 0.13 0.00 0.08 0.00 0.00 59.36 59.69 1r63 h GLU 32 Cb 0.77 0.25 -0.08 0.00 0.50 0.00 0.00 28.75 30.18 1r63 h GLU 32 CO 0.06 -0.72 0.60 0.37 -2.18 0.00 0.00 179.01 177.15 1r63 h GLN 33 N -1.12 0.84 0.33 1.92 4.15 -0.90 0.27 115.11 120.60 1r63 h GLN 33 Ca -0.09 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 59.26 1r63 h GLN 33 Cb 0.92 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.42 1r63 h GLN 33 CO 0.05 0.55 -0.16 1.25 -1.93 0.00 0.00 178.83 178.59 1r63 h LEU 34 N 0.86 -0.38 -0.88 -2.39 5.85 -0.96 -1.61 115.31 115.80 1r63 h LEU 34 Ca 0.47 -0.04 0.19 0.00 0.84 0.00 0.00 57.88 59.34 1r63 h LEU 34 Cb 0.58 0.10 -0.11 0.00 0.37 0.00 0.00 40.66 41.60 1r63 h LEU 34 CO -0.24 -0.20 0.42 -0.33 -0.34 0.00 0.00 178.44 177.75 1r63 h GLU 35 N -0.53 0.49 0.00 1.25 4.39 0.12 0.34 114.58 120.64 1r63 h GLU 35 Ca -0.05 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.62 1r63 h GLU 35 Cb 0.40 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 1r63 h GLU 35 CO 0.08 0.32 0.00 -0.97 -1.16 0.00 0.00 179.01 177.28 1r63 h ASN 36 N 0.50 0.00 0.00 1.42 -0.73 0.12 -3.43 115.58 113.47 1r63 h ASN 36 Ca 0.52 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.69 1r63 h ASN 36 Cb 0.89 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.48 1r63 h ASN 36 CO -0.46 0.00 0.00 0.61 -0.37 0.00 0.00 177.43 177.21 1r63 n GLY 37 N -0.44 0.76 0.02 1.57 0.00 0.11 -4.94 105.19 102.27 1r63 n GLY 37 Ca -0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.12 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 -2.42 0.25 -2.96 1.61 5.02 -1.07 -4.76 118.16 113.83 1r63 n LYS 38 Ca 0.00 -0.02 -0.38 0.00 -2.02 0.00 0.00 58.31 55.88 1r63 n LYS 38 Cb 0.00 -1.56 -0.06 0.00 -0.02 0.00 0.00 35.03 33.39 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 -3.18 4.36 0.00 -0.18 2.01 -1.24 -5.00 115.64 112.42 1r63 s THR 39 Ca 0.04 1.66 0.00 0.00 0.31 0.00 0.00 61.69 63.70 1r63 s THR 39 Cb 0.15 -4.08 0.00 0.00 0.01 0.00 0.00 72.50 68.58 1r63 s THR 39 CO 0.82 0.40 0.00 0.29 -0.69 0.00 0.00 174.62 175.44 1r63 n LYS 40 N 1.24 0.00 -3.70 4.92 5.02 -1.26 -4.95 118.16 119.44 1r63 n LYS 40 Ca -0.04 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 55.98 1r63 n LYS 40 Cb 0.49 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.39 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 0.00 1.81 0.84 1.97 3.52 -1.26 -5.04 118.95 120.79 1r63 s ARG 41 Ca 0.00 -2.81 -0.11 0.00 -0.13 0.00 0.00 55.73 52.67 1r63 s ARG 41 Cb 0.00 -2.60 0.09 0.00 -1.56 0.00 0.00 34.95 30.88 1r63 s ARG 41 CO 0.00 -1.32 1.09 -1.25 -0.81 0.00 0.00 175.30 173.01 1r63 s PRO 42 N -0.79 1.75 0.14 5.12 0.04 -1.26 -4.96 135.00 135.03 1r63 s PRO 42 Ca 0.28 0.82 -0.21 0.00 0.04 0.00 0.00 61.00 61.93 1r63 s PRO 42 Cb -0.02 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.65 1r63 s PRO 42 CO -0.17 -1.90 1.67 -0.09 0.04 0.00 0.00 177.00 176.55 1r63 h ARG 43 N -1.30 -0.12 -1.03 4.56 9.65 -2.06 -3.18 114.38 120.90 1r63 h ARG 43 Ca -0.48 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.41 1r63 h ARG 43 Cb 1.27 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.87 1r63 h ARG 43 CO 0.56 -0.08 0.00 1.97 2.80 0.00 0.00 179.97 185.22 1r63 n PHE 44 N -5.28 0.00 0.06 2.20 -1.74 -1.26 -4.38 117.46 107.06 1r63 n PHE 44 Ca -0.02 -0.35 -0.12 0.00 -0.56 0.00 0.00 57.45 56.40 1r63 n PHE 44 Cb 0.20 -0.20 -0.05 0.00 1.52 0.00 0.00 39.48 40.94 1r63 n PHE 44 CO 0.00 0.00 0.00 -0.07 -0.56 0.00 0.00 176.76 176.13 1r63 h LEU 45 N 0.82 -1.00 -0.72 5.98 3.38 -1.95 0.11 115.31 121.92 1r63 h LEU 45 Ca 0.00 0.13 0.09 0.00 0.09 0.00 0.00 57.88 58.19 1r63 h LEU 45 Cb 0.82 0.40 -0.07 0.00 0.09 0.00 0.00 40.66 41.90 1r63 h LEU 45 CO 0.00 -0.40 0.37 1.55 0.09 0.00 0.00 178.44 180.05 1r63 h PRO 46 N -0.49 0.62 -0.05 1.13 0.13 -1.91 0.14 132.00 131.56 1r63 h PRO 46 Ca 0.06 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1r63 h PRO 46 Cb 0.58 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 31.57 1r63 h PRO 46 CO -0.27 0.41 0.03 0.93 -0.23 0.00 0.00 178.00 178.86 1r63 h GLU 47 N 0.63 0.07 0.08 0.86 3.07 -1.83 -0.57 114.58 116.89 1r63 h GLU 47 Ca 0.35 -0.01 0.02 0.00 -0.50 0.00 0.00 59.36 59.22 1r63 h GLU 47 Cb 0.34 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.20 1r63 h GLU 47 CO -0.26 0.13 -0.26 1.25 -1.40 0.00 0.00 179.01 178.48 1r63 h LEU 48 N -0.02 -0.74 -0.44 1.33 7.12 -0.10 0.14 115.31 122.60 1r63 h LEU 48 Ca 0.02 0.09 0.07 0.00 0.13 0.00 0.00 57.88 58.19 1r63 h LEU 48 Cb 0.08 0.29 -0.09 0.00 -0.53 0.00 0.00 40.66 40.41 1r63 h LEU 48 CO -0.00 -0.34 -0.42 0.00 -0.13 0.00 0.00 178.44 177.55 1r63 h ALA 49 N 0.32 -0.38 -0.09 1.25 0.00 -0.71 0.69 119.26 120.35 1r63 h ALA 49 Ca 0.04 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1r63 h ALA 49 Cb 0.49 0.88 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 1r63 h ALA 49 CO -0.17 -0.84 -0.02 0.77 0.00 0.00 0.00 179.25 178.99 1r63 h SER 50 N -0.30 0.16 0.06 0.00 0.02 -0.47 0.43 113.55 113.46 1r63 h SER 50 Ca 0.15 -0.36 0.01 0.00 -0.84 0.00 0.00 61.79 60.75 1r63 h SER 50 Cb 0.58 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 1r63 h SER 50 CO -0.59 0.48 -0.09 0.00 -1.14 0.00 0.00 176.83 175.49 1r63 h ALA 51 N 0.69 -0.16 0.00 3.77 0.00 -0.59 -0.71 119.26 122.26 1r63 h ALA 51 Ca 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1r63 h ALA 51 Cb 0.41 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1r63 h ALA 51 CO 0.01 -0.61 -0.13 1.25 0.00 0.00 0.00 179.25 179.77 1r63 h LEU 52 N -0.19 0.00 -1.76 0.00 7.12 -0.83 -3.47 115.31 116.17 1r63 h LEU 52 Ca 0.01 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 58.01 1r63 h LEU 52 Cb 0.20 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.34 1r63 h LEU 52 CO -0.05 0.13 -0.02 0.61 -0.13 0.00 0.00 178.44 178.99 1r63 n GLY 53 N -1.10 0.53 3.34 3.75 0.00 0.13 -4.99 105.19 106.86 1r63 n GLY 53 Ca -0.03 -0.51 -0.09 0.00 0.00 0.00 0.00 46.02 45.39 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 -3.01 0.07 0.54 1.61 -7.23 -0.24 -5.02 120.40 107.13 1r63 s VAL 54 Ca 0.00 -1.30 -0.16 0.00 -1.81 0.00 0.00 61.98 58.72 1r63 s VAL 54 Cb -0.00 -1.76 -0.06 0.00 0.56 0.00 0.00 36.38 35.12 1r63 s VAL 54 CO 0.02 -0.32 1.01 -0.94 -0.31 0.00 0.00 175.10 174.56 1r63 s SER 55 N -2.95 6.35 0.21 4.85 1.04 -1.26 -4.09 113.70 117.85 1r63 s SER 55 Ca 0.15 1.64 -0.09 0.00 0.48 0.00 0.00 55.95 58.12 1r63 s SER 55 Cb 0.03 -2.51 0.26 0.00 0.10 0.00 0.00 66.02 63.90 1r63 s SER 55 CO -0.02 -0.78 1.77 0.58 0.98 0.00 0.00 173.24 175.77 1r63 h VAL 56 N 0.71 0.84 -0.48 5.02 2.07 -1.91 -1.53 116.25 120.97 1r63 h VAL 56 Ca -0.47 -0.17 0.08 0.00 0.82 0.00 0.00 66.70 66.96 1r63 h VAL 56 Cb 1.20 0.30 -0.07 0.00 -1.52 0.00 0.00 31.29 31.19 1r63 h VAL 56 CO 0.60 0.09 0.08 0.44 0.02 0.00 0.00 177.57 178.80 1r63 h ASP 57 N 0.50 -0.03 -0.55 0.57 3.32 -1.99 0.14 116.42 118.38 1r63 h ASP 57 Ca 0.30 0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.42 1r63 h ASP 57 Cb 0.31 0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.97 1r63 h ASP 57 CO -0.26 0.01 0.26 -0.25 -1.72 0.00 0.00 179.24 177.28 1r63 h TRP 58 N 0.21 0.83 0.58 4.55 7.01 -1.73 -0.09 115.95 127.30 1r63 h TRP 58 Ca 0.24 -0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.18 1r63 h TRP 58 Cb 0.33 -0.26 -0.00 0.00 -2.10 0.00 0.00 29.16 27.12 1r63 h TRP 58 CO -0.24 0.63 -0.35 -0.07 -2.79 0.00 0.00 178.44 175.62 1r63 h LEU 59 N 0.83 -0.88 -0.39 0.65 3.38 -0.24 0.02 115.31 118.69 1r63 h LEU 59 Ca 0.20 0.05 0.08 0.00 0.09 0.00 0.00 57.88 58.30 1r63 h LEU 59 Cb 0.12 0.26 -0.09 0.00 0.09 0.00 0.00 40.66 41.04 1r63 h LEU 59 CO -0.02 -0.55 -0.35 0.25 0.09 0.00 0.00 178.44 177.86 1r63 h LEU 60 N -0.88 -1.14 0.00 1.67 5.85 -0.03 -3.37 115.31 117.41 1r63 h LEU 60 Ca -0.07 0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1r63 h LEU 60 Cb 0.71 0.53 0.00 0.00 0.37 0.00 0.00 40.66 42.27 1r63 h LEU 60 CO 0.07 -0.33 0.00 -0.46 -0.34 0.00 0.00 178.44 177.38 1r63 n ASN 61 N -5.42 0.00 0.00 1.25 0.23 -0.12 -5.03 115.26 106.17 1r63 n ASN 61 Ca 0.01 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.06 1r63 n ASN 61 Cb 0.34 -0.35 0.00 0.00 -2.08 0.00 0.00 39.78 37.69 1r63 n ASN 61 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1r63 n GLY 62 N 1.81 1.89 1.55 4.83 0.00 -0.01 -4.96 105.19 110.30 1r63 n GLY 62 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1r63 n GLY 62 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95