#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r63 n ILE 2 N 0.00 0.00 -0.19 0.44 3.06 -1.26 -4.89 119.36 116.52 1r63 n ILE 2 Ca 0.00 0.00 0.10 0.00 -2.50 0.00 0.00 62.75 60.35 1r63 n ILE 2 Cb 0.00 -0.15 0.39 0.00 0.54 0.00 0.00 39.64 40.42 1r63 n ILE 2 CO 0.00 0.00 0.00 0.77 -2.50 0.00 0.00 176.55 174.82 1r63 h SER 3 N 0.00 0.60 -0.75 9.51 4.64 -1.87 0.40 113.55 126.09 1r63 h SER 3 Ca 0.00 0.02 0.07 0.00 -0.47 0.00 0.00 61.79 61.41 1r63 h SER 3 Cb 0.00 -0.11 -0.09 0.00 -0.31 0.00 0.00 62.40 61.89 1r63 h SER 3 CO 0.00 0.35 -0.43 -1.54 -0.87 0.00 0.00 176.83 174.34 1r63 n SER 4 N -4.50 -0.77 -0.04 4.97 3.41 -1.26 -0.45 113.62 114.97 1r63 n SER 4 Ca 0.13 1.33 -0.15 0.00 -0.26 0.00 0.00 58.87 59.92 1r63 n SER 4 Cb 0.34 -0.18 -0.08 0.00 -0.26 0.00 0.00 64.21 64.03 1r63 n SER 4 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1r63 h ARG 5 N 0.00 0.41 -0.29 4.33 3.08 -1.28 -0.40 114.38 120.23 1r63 h ARG 5 Ca 0.13 -0.29 0.06 0.00 0.07 0.00 0.00 59.98 59.94 1r63 h ARG 5 Cb 0.32 0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.36 1r63 h ARG 5 CO -0.71 0.91 -0.07 0.28 -1.07 0.00 0.00 179.97 179.31 1r63 h VAL 6 N -0.01 0.71 0.26 2.04 2.07 -0.96 0.84 116.25 121.20 1r63 h VAL 6 Ca -0.01 -0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1r63 h VAL 6 Cb 0.93 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 1r63 h VAL 6 CO 0.07 0.00 -0.34 0.50 0.02 0.00 0.00 177.57 177.82 1r63 h LYS 7 N 0.00 -0.59 -0.99 1.57 1.63 -0.80 -2.31 116.57 115.07 1r63 h LYS 7 Ca 0.14 0.04 0.06 0.00 -0.85 0.00 0.00 60.65 60.05 1r63 h LYS 7 Cb 0.21 0.14 -0.07 0.00 -0.60 0.00 0.00 32.23 31.91 1r63 h LYS 7 CO -0.30 -0.40 0.64 0.66 -3.45 0.00 0.00 179.45 176.60 1r63 h SER 8 N -0.62 1.02 -0.27 4.20 4.64 -0.38 0.15 113.55 122.30 1r63 h SER 8 Ca -0.03 0.01 -0.16 0.00 -0.47 0.00 0.00 61.79 61.14 1r63 h SER 8 Cb 0.56 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1r63 h SER 8 CO -0.09 0.65 -0.44 0.50 -0.87 0.00 0.00 176.83 176.59 1r63 h LYS 9 N 1.16 0.78 -0.77 4.77 1.63 -0.90 -0.88 116.57 122.36 1r63 h LYS 9 Ca 0.43 -0.47 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1r63 h LYS 9 Cb 0.16 0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 31.80 1r63 h LYS 9 CO -0.17 1.10 0.48 -0.09 -3.45 0.00 0.00 179.45 177.32 1r63 h ARG 10 N 0.53 1.03 -0.29 1.90 2.43 -0.41 0.13 114.38 119.70 1r63 h ARG 10 Ca 0.02 -0.08 0.05 0.00 -0.81 0.00 0.00 59.98 59.16 1r63 h ARG 10 Cb 1.03 -0.22 -0.04 0.00 -0.42 0.00 0.00 29.97 30.32 1r63 h ARG 10 CO 0.10 0.71 0.03 0.82 -1.51 0.00 0.00 179.97 180.11 1r63 h ILE 11 N 1.04 0.82 -0.69 1.20 5.03 -1.20 -1.22 117.51 122.50 1r63 h ILE 11 Ca 0.28 -0.04 0.07 0.00 -0.12 0.00 0.00 64.86 65.05 1r63 h ILE 11 Cb -0.07 0.69 -0.06 0.00 -3.03 0.00 0.00 36.82 34.35 1r63 h ILE 11 CO -0.06 0.02 0.37 1.56 -0.68 0.00 0.00 178.15 179.37 1r63 h GLN 12 N 0.12 0.65 0.00 2.37 7.50 0.36 0.12 115.11 126.23 1r63 h GLN 12 Ca 0.14 -0.04 0.00 0.00 0.50 0.00 0.00 58.65 59.25 1r63 h GLN 12 Cb 0.16 -0.15 0.00 0.00 0.05 0.00 0.00 27.48 27.55 1r63 h GLN 12 CO -0.21 0.43 0.00 1.28 -1.50 0.00 0.00 178.83 178.83 1r63 n LEU 13 N -4.81 0.51 -0.08 1.46 7.99 0.31 -4.87 117.00 117.52 1r63 n LEU 13 Ca 0.09 0.67 -0.01 0.00 -0.01 0.00 0.00 56.01 56.75 1r63 n LEU 13 Cb 0.20 -0.65 -0.00 0.00 -0.11 0.00 0.00 43.42 42.86 1r63 n LEU 13 CO 0.28 -0.65 -0.01 0.61 -1.51 0.00 0.00 177.39 176.10 1r63 n GLY 14 N -0.56 0.49 3.84 -0.72 0.00 0.40 -5.02 105.19 103.63 1r63 n GLY 14 Ca 0.01 -0.52 -0.37 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 -0.23 4.44 0.45 0.99 1.43 -0.55 -4.99 118.68 120.21 1r63 s LEU 15 Ca 0.00 1.05 -0.01 0.00 -1.03 0.00 0.00 54.13 54.15 1r63 s LEU 15 Cb 0.00 -2.91 -0.01 0.00 0.03 0.00 0.00 46.19 43.30 1r63 s LEU 15 CO 0.00 0.23 0.69 0.54 0.23 0.00 0.00 176.35 178.04 1r63 s ASN 16 N -1.35 5.91 0.14 2.29 6.03 -1.26 -4.10 114.94 122.60 1r63 s ASN 16 Ca 0.30 0.42 -0.23 0.00 -1.03 0.00 0.00 52.86 52.32 1r63 s ASN 16 Cb -0.17 -1.69 -0.00 0.00 -3.03 0.00 0.00 41.25 36.36 1r63 s ASN 16 CO 0.17 -0.67 1.64 -0.61 -2.03 0.00 0.00 177.10 175.60 1r63 h GLN 17 N 0.37 -0.27 -0.61 3.55 4.15 -1.98 -2.06 115.11 118.26 1r63 h GLN 17 Ca -0.47 0.02 0.13 0.00 0.77 0.00 0.00 58.65 59.10 1r63 h GLN 17 Cb 1.24 0.06 -0.10 0.00 0.21 0.00 0.00 27.48 28.89 1r63 h GLN 17 CO 0.59 -0.18 -0.02 0.00 -1.93 0.00 0.00 178.83 177.29 1r63 h ALA 18 N 0.71 0.58 -0.91 3.38 0.00 -1.96 0.33 119.26 121.39 1r63 h ALA 18 Ca 0.11 0.19 0.04 0.00 0.00 0.00 0.00 54.91 55.26 1r63 h ALA 18 Cb 0.44 0.34 -0.06 0.00 0.00 0.00 0.00 17.79 18.52 1r63 h ALA 18 CO -0.32 -0.40 0.59 0.93 0.00 0.00 0.00 179.25 180.05 1r63 h GLU 19 N 0.10 1.08 0.70 0.00 5.08 -1.78 0.91 114.58 120.68 1r63 h GLU 19 Ca 0.32 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.58 1r63 h GLU 19 Cb 0.51 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 29.52 1r63 h GLU 19 CO -0.53 0.72 -0.33 1.25 -1.00 0.00 0.00 179.01 179.11 1r63 h LEU 20 N 1.11 -0.79 -0.77 1.33 5.85 -0.99 -1.71 115.31 119.34 1r63 h LEU 20 Ca 0.37 -0.00 0.13 0.00 0.84 0.00 0.00 57.88 59.22 1r63 h LEU 20 Cb 0.05 0.20 -0.14 0.00 0.37 0.00 0.00 40.66 41.15 1r63 h LEU 20 CO -0.14 -0.49 -0.33 0.00 -0.34 0.00 0.00 178.44 177.14 1r63 h ALA 21 N -0.84 0.13 -0.29 1.25 0.00 0.01 0.12 119.26 119.64 1r63 h ALA 21 Ca -0.10 0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 1r63 h ALA 21 Cb 0.74 0.84 -0.01 0.00 0.00 0.00 0.00 17.79 19.37 1r63 h ALA 21 CO 0.16 -0.61 -0.17 -0.56 0.00 0.00 0.00 179.25 178.07 1r63 h GLN 22 N -0.08 0.63 0.00 0.00 3.07 -0.90 0.13 115.11 117.96 1r63 h GLN 22 Ca 0.30 -0.29 -0.07 0.00 0.09 0.00 0.00 58.65 58.68 1r63 h GLN 22 Cb 0.58 -0.01 -0.01 0.00 0.08 0.00 0.00 27.48 28.11 1r63 h GLN 22 CO -0.82 0.88 -0.35 1.57 0.09 0.00 0.00 178.83 180.19 1r63 h LYS 23 N 0.38 0.00 0.16 0.06 2.10 -0.46 -0.78 116.57 118.03 1r63 h LYS 23 Ca 0.06 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.70 1r63 h LYS 23 Cb 0.70 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.03 1r63 h LYS 23 CO 0.05 0.35 -0.08 0.28 -2.00 0.00 0.00 179.45 178.06 1r63 h VAL 24 N 0.00 0.93 0.00 0.07 2.07 -0.66 -3.48 116.25 115.18 1r63 h VAL 24 Ca -0.00 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1r63 h VAL 24 Cb 0.69 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 1r63 h VAL 24 CO 0.05 0.09 0.00 0.61 0.02 0.00 0.00 177.57 178.33 1r63 n GLY 25 N -0.70 1.71 0.00 2.17 0.00 0.24 -4.92 105.19 103.69 1r63 n GLY 25 Ca -0.09 0.00 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 -0.69 0.00 -4.25 2.61 5.66 0.07 -5.00 114.28 112.68 1r63 n THR 26 Ca 0.00 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.76 1r63 n THR 26 Cb 0.00 -0.33 -0.07 0.00 -1.55 0.00 0.00 70.33 68.38 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 0.84 3.63 0.23 1.09 -4.23 -1.26 -3.92 115.64 112.01 1r63 s THR 27 Ca 0.00 -1.68 -0.10 0.00 -1.18 0.00 0.00 61.69 58.73 1r63 s THR 27 Cb 0.00 -2.90 0.25 0.00 1.34 0.00 0.00 72.50 71.20 1r63 s THR 27 CO 0.00 -0.27 1.63 -0.61 -0.54 0.00 0.00 174.62 174.84 1r63 h GLN 28 N 2.19 0.06 -0.90 3.99 -0.00 -1.90 0.10 115.11 118.64 1r63 h GLN 28 Ca -0.46 -0.00 0.25 0.00 -0.00 0.00 0.00 58.65 58.43 1r63 h GLN 28 Cb 1.23 -0.01 -0.16 0.00 0.00 0.00 0.00 27.48 28.54 1r63 h GLN 28 CO 0.59 0.04 0.13 0.37 0.00 0.00 0.00 178.83 179.96 1r63 h GLN 29 N 0.06 0.10 0.54 1.69 -0.00 -1.99 0.56 115.11 116.07 1r63 h GLN 29 Ca 0.35 -0.01 -0.03 0.00 -0.00 0.00 0.00 58.65 58.97 1r63 h GLN 29 Cb 0.58 -0.02 0.01 0.00 0.00 0.00 0.00 27.48 28.04 1r63 h GLN 29 CO -0.65 0.07 -0.26 1.03 0.00 0.00 0.00 178.83 179.02 1r63 h SER 30 N 0.10 -0.62 -0.73 -0.69 0.87 -1.21 -2.65 113.55 108.63 1r63 h SER 30 Ca 0.56 -0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 61.07 1r63 h SER 30 Cb 1.14 0.16 -0.04 0.00 -0.44 0.00 0.00 62.40 63.23 1r63 h SER 30 CO -0.76 -0.34 0.38 0.40 -0.53 0.00 0.00 176.83 175.97 1r63 h ILE 31 N -0.87 1.23 -0.45 2.23 1.08 -0.70 -0.59 117.51 119.43 1r63 h ILE 31 Ca -0.07 -0.60 -0.02 0.00 -0.39 0.00 0.00 64.86 63.77 1r63 h ILE 31 Cb 0.61 0.25 -0.02 0.00 -3.07 0.00 0.00 36.82 34.59 1r63 h ILE 31 CO 0.12 0.26 0.20 -0.08 -0.69 0.00 0.00 178.15 177.97 1r63 h GLU 32 N 1.04 0.65 -0.70 2.37 4.81 -0.95 0.10 114.58 121.90 1r63 h GLU 32 Ca 0.26 -0.11 0.03 0.00 -0.13 0.00 0.00 59.36 59.41 1r63 h GLU 32 Cb 0.06 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.29 1r63 h GLU 32 CO -0.04 0.57 0.44 0.37 -0.73 0.00 0.00 179.01 179.63 1r63 h GLN 33 N 0.58 0.84 0.09 1.92 4.15 -1.06 0.14 115.11 121.77 1r63 h GLN 33 Ca 0.15 -0.05 0.02 0.00 0.77 0.00 0.00 58.65 59.54 1r63 h GLN 33 Cb 0.15 -0.19 -0.04 0.00 0.21 0.00 0.00 27.48 27.61 1r63 h GLN 33 CO -0.02 0.55 -0.32 1.25 -1.93 0.00 0.00 178.83 178.36 1r63 h LEU 34 N 0.86 -0.95 -1.65 -2.39 5.85 -0.15 -1.51 115.31 115.38 1r63 h LEU 34 Ca 0.28 0.11 0.13 0.00 0.84 0.00 0.00 57.88 59.24 1r63 h LEU 34 Cb 0.02 0.36 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 1r63 h LEU 34 CO -0.11 -0.41 0.45 -0.33 -0.34 0.00 0.00 178.44 177.71 1r63 h GLU 35 N -0.53 0.35 -0.28 1.25 3.07 -0.50 0.25 114.58 118.19 1r63 h GLU 35 Ca 0.04 -0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 58.82 1r63 h GLU 35 Cb 0.58 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.39 1r63 h GLU 35 CO -0.21 0.23 -0.06 -0.91 -1.40 0.00 0.00 179.01 176.66 1r63 h ASN 36 N 0.36 0.41 -3.16 1.42 2.35 0.23 -3.45 115.58 113.74 1r63 h ASN 36 Ca 0.32 -0.08 -0.04 0.00 -0.55 0.00 0.00 56.30 55.94 1r63 h ASN 36 Cb 0.76 -0.11 0.03 0.00 0.05 0.00 0.00 38.32 39.05 1r63 h ASN 36 CO -0.09 0.53 -0.13 0.61 -1.65 0.00 0.00 177.43 176.69 1r63 n GLY 37 N -0.83 0.51 0.03 2.83 0.00 0.87 -5.00 105.19 103.59 1r63 n GLY 37 Ca 0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 46.02 45.78 1r63 n GLY 37 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1r63 n LYS 38 N -1.70 0.81 -2.85 1.61 4.81 -1.26 -5.01 118.16 114.57 1r63 n LYS 38 Ca -0.02 0.03 -0.32 0.00 -0.87 0.00 0.00 58.31 57.13 1r63 n LYS 38 Cb 0.52 -1.12 -0.05 0.00 0.02 0.00 0.00 35.03 34.40 1r63 n LYS 38 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1r63 s THR 39 N -2.12 4.62 -0.04 3.15 2.01 -1.26 -5.00 115.64 117.00 1r63 s THR 39 Ca -0.07 1.01 -0.22 0.00 0.31 0.00 0.00 61.69 62.72 1r63 s THR 39 Cb 0.02 -3.66 -0.17 0.00 0.01 0.00 0.00 72.50 68.70 1r63 s THR 39 CO 0.15 -0.40 0.96 0.07 -0.69 0.00 0.00 174.62 174.71 1r63 h LYS 40 N 1.65 -0.20 -1.46 4.92 2.10 -2.02 -3.45 116.57 118.11 1r63 h LYS 40 Ca -0.48 0.01 -0.22 0.00 -2.00 0.00 0.00 60.65 57.97 1r63 h LYS 40 Cb 1.18 0.05 -0.25 0.00 -0.90 0.00 0.00 32.23 32.31 1r63 h LYS 40 CO 0.63 0.23 -0.57 0.50 -2.00 0.00 0.00 179.45 178.24 1r63 s ARG 41 N -3.64 0.75 0.35 0.07 3.52 -1.26 -5.14 118.95 113.60 1r63 s ARG 41 Ca -0.13 -0.61 -0.27 0.00 -0.13 0.00 0.00 55.73 54.59 1r63 s ARG 41 Cb 0.01 -0.32 -0.12 0.00 -1.56 0.00 0.00 34.95 32.96 1r63 s ARG 41 CO 0.51 -1.20 1.16 -2.30 -0.81 0.00 0.00 175.30 172.66 1r63 n PRO 42 N 4.25 1.75 0.02 5.12 -0.02 -1.26 -4.90 135.00 139.96 1r63 n PRO 42 Ca 0.12 0.62 -0.03 0.00 -2.02 0.00 0.00 63.50 62.18 1r63 n PRO 42 Cb 0.51 -2.15 0.20 0.00 -0.02 0.00 0.00 33.50 32.05 1r63 n PRO 42 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1r63 h ARG 43 N 2.15 0.48 -0.25 -0.52 9.65 -2.04 -2.85 114.38 121.00 1r63 h ARG 43 Ca -0.44 -0.18 0.00 0.00 -1.10 0.00 0.00 59.98 58.26 1r63 h ARG 43 Cb 1.31 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.86 1r63 h ARG 43 CO 0.61 0.69 0.00 1.97 2.80 0.00 0.00 179.97 186.04 1r63 n PHE 44 N -4.12 0.30 -0.37 2.20 -1.74 -1.26 -4.33 117.46 108.13 1r63 n PHE 44 Ca -0.00 -0.14 -0.07 0.00 -0.56 0.00 0.00 57.45 56.68 1r63 n PHE 44 Cb 0.40 -0.01 -0.04 0.00 1.52 0.00 0.00 39.48 41.35 1r63 n PHE 44 CO 0.00 0.00 0.00 1.28 -0.56 0.00 0.00 176.76 177.48 1r63 n LEU 45 N 0.11 -0.84 -0.18 5.98 4.77 -1.08 -0.95 117.00 124.81 1r63 n LEU 45 Ca 0.07 1.63 -0.03 0.00 -0.03 0.00 0.00 56.01 57.65 1r63 n LEU 45 Cb 0.20 -0.27 0.04 0.00 -2.33 0.00 0.00 43.42 41.05 1r63 n LEU 45 CO 0.05 -1.37 0.72 1.55 -1.33 0.00 0.00 177.39 177.01 1r63 h PRO 46 N 0.00 -0.05 -0.32 3.23 0.13 -1.87 0.69 132.00 133.81 1r63 h PRO 46 Ca 0.21 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.31 1r63 h PRO 46 Cb 0.44 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.57 1r63 h PRO 46 CO -0.88 -0.04 0.08 0.93 -0.23 0.00 0.00 178.00 177.86 1r63 h GLU 47 N -0.05 0.52 -0.15 0.86 4.39 -1.51 0.38 114.58 119.02 1r63 h GLU 47 Ca 0.26 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.84 1r63 h GLU 47 Cb 0.45 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 1r63 h GLU 47 CO -0.59 0.58 0.09 1.25 -1.16 0.00 0.00 179.01 179.18 1r63 h LEU 48 N 0.37 0.17 -0.22 1.33 6.46 -0.60 0.23 115.31 123.04 1r63 h LEU 48 Ca 0.10 -0.02 0.06 0.00 -0.12 0.00 0.00 57.88 57.90 1r63 h LEU 48 Cb 0.29 -0.04 -0.07 0.00 -0.73 0.00 0.00 40.66 40.11 1r63 h LEU 48 CO 0.00 0.14 -0.22 0.00 -0.62 0.00 0.00 178.44 177.74 1r63 h ALA 49 N 1.04 -0.11 -0.21 1.25 0.00 -0.70 -0.16 119.26 120.38 1r63 h ALA 49 Ca 0.05 0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.87 1r63 h ALA 49 Cb -0.01 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1r63 h ALA 49 CO -0.01 -0.65 -0.54 0.66 0.00 0.00 0.00 179.25 178.71 1r63 h SER 50 N -0.23 0.69 -0.27 0.00 4.64 -0.64 0.31 113.55 118.04 1r63 h SER 50 Ca 0.13 -0.37 -0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1r63 h SER 50 Cb 0.43 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1r63 h SER 50 CO -0.36 1.10 0.16 0.00 -0.87 0.00 0.00 176.83 176.85 1r63 h ALA 51 N 0.92 0.35 0.00 5.18 0.00 -0.18 -2.65 119.26 122.88 1r63 h ALA 51 Ca 0.01 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1r63 h ALA 51 Cb 1.10 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1r63 h ALA 51 CO 0.11 -0.14 -0.39 1.25 0.00 0.00 0.00 179.25 180.07 1r63 h LEU 52 N 0.33 0.00 -2.32 0.00 5.85 -1.04 -3.49 115.31 114.64 1r63 h LEU 52 Ca 0.10 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 1r63 h LEU 52 Cb 0.04 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.08 1r63 h LEU 52 CO -0.02 0.33 -0.04 0.61 -0.34 0.00 0.00 178.44 178.98 1r63 n GLY 53 N 1.19 0.53 3.13 3.75 0.00 0.90 -4.99 105.19 109.71 1r63 n GLY 53 Ca 0.02 -0.37 -0.08 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.02 0.17 0.63 1.61 -7.23 -0.12 -5.02 120.40 107.41 1r63 s VAL 54 Ca 0.01 -1.80 -0.13 0.00 -1.81 0.00 0.00 61.98 58.24 1r63 s VAL 54 Cb -0.00 -1.73 -0.02 0.00 0.56 0.00 0.00 36.38 35.19 1r63 s VAL 54 CO 0.04 -0.75 1.05 -0.94 -0.31 0.00 0.00 175.10 174.19 1r63 s SER 55 N -2.97 5.74 0.23 4.85 1.04 -1.26 -4.13 113.70 117.20 1r63 s SER 55 Ca 0.14 1.67 -0.07 0.00 0.48 0.00 0.00 55.95 58.16 1r63 s SER 55 Cb 0.07 -2.51 0.28 0.00 0.10 0.00 0.00 66.02 63.97 1r63 s SER 55 CO -0.05 -1.20 1.83 0.58 0.98 0.00 0.00 173.24 175.38 1r63 h VAL 56 N -0.08 1.02 -0.24 5.02 2.07 -1.91 -0.58 116.25 121.54 1r63 h VAL 56 Ca -0.45 -0.29 0.04 0.00 0.82 0.00 0.00 66.70 66.82 1r63 h VAL 56 Cb 1.21 0.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 1r63 h VAL 56 CO 0.58 0.15 -0.02 -0.78 0.02 0.00 0.00 177.57 177.52 1r63 h ASP 57 N 0.84 -0.14 -0.97 0.57 1.82 -1.98 -0.26 116.42 116.30 1r63 h ASP 57 Ca 0.34 0.06 0.03 0.00 -0.39 0.00 0.00 57.03 57.07 1r63 h ASP 57 Cb 0.17 0.12 -0.06 0.00 0.68 0.00 0.00 39.33 40.24 1r63 h ASP 57 CO -0.17 -0.04 0.63 -0.25 -1.61 0.00 0.00 179.24 177.80 1r63 h TRP 58 N 0.05 1.19 0.52 0.28 7.01 -1.75 0.45 115.95 123.70 1r63 h TRP 58 Ca 0.12 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.13 1r63 h TRP 58 Cb 0.16 -0.40 -0.02 0.00 -2.10 0.00 0.00 29.16 26.80 1r63 h TRP 58 CO -0.21 0.70 -0.48 -0.07 -2.79 0.00 0.00 178.44 175.59 1r63 h LEU 59 N 1.24 -1.29 0.03 0.65 3.38 -0.50 -2.10 115.31 116.72 1r63 h LEU 59 Ca 0.38 0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.45 1r63 h LEU 59 Cb -0.03 0.42 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1r63 h LEU 59 CO -0.11 -0.65 -0.01 0.25 0.09 0.00 0.00 178.44 178.00 1r63 h LEU 60 N -0.99 -0.03 0.10 1.67 6.46 -0.09 -3.38 115.31 119.04 1r63 h LEU 60 Ca -0.06 0.00 -0.22 0.00 -0.12 0.00 0.00 57.88 57.48 1r63 h LEU 60 Cb 0.86 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.80 1r63 h LEU 60 CO -0.04 -0.02 -1.11 0.78 -0.62 0.00 0.00 178.44 177.44 1r63 h ASN 61 N -0.05 0.35 -4.66 1.25 4.21 -0.31 -3.44 115.58 112.91 1r63 h ASN 61 Ca -0.00 -0.87 0.00 0.00 1.21 0.00 0.00 56.30 56.64 1r63 h ASN 61 Cb 0.03 -0.11 0.00 0.00 -1.12 0.00 0.00 38.32 37.12 1r63 h ASN 61 CO 0.01 1.49 -0.25 0.61 -1.29 0.00 0.00 177.43 178.00 1r63 n GLY 62 N 1.68 -1.09 0.00 2.83 0.00 -0.67 -4.98 105.19 102.96 1r63 n GLY 62 Ca -0.21 0.70 0.00 0.00 0.00 0.00 0.00 46.02 46.51 1r63 n GLY 62 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02