#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pra h ILE 2 N 0.00 1.24 0.07 2.46 5.03 -1.90 -2.99 117.51 121.42 1pra h ILE 2 Ca 0.00 -0.86 0.02 0.00 -0.12 0.00 0.00 64.86 63.90 1pra h ILE 2 Cb 0.00 0.85 -0.04 0.00 -3.03 0.00 0.00 36.82 34.60 1pra h ILE 2 CO 0.00 0.31 -0.30 0.77 -0.68 0.00 0.00 178.15 178.25 1pra h SER 3 N 0.69 -0.88 -0.27 1.72 4.64 -1.86 0.06 113.55 117.64 1pra h SER 3 Ca 0.15 0.11 0.04 0.00 -0.47 0.00 0.00 61.79 61.62 1pra h SER 3 Cb 0.34 0.34 -0.04 0.00 -0.31 0.00 0.00 62.40 62.74 1pra h SER 3 CO 0.00 -0.38 0.03 0.77 -0.87 0.00 0.00 176.83 176.38 1pra h SER 4 N -0.50 -0.05 0.23 4.97 4.64 -1.92 0.23 113.55 121.15 1pra h SER 4 Ca 0.04 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1pra h SER 4 Cb 0.55 0.08 -0.04 0.00 -0.31 0.00 0.00 62.40 62.68 1pra h SER 4 CO -0.21 0.01 -0.51 0.03 -0.87 0.00 0.00 176.83 175.29 1pra h ARG 5 N 0.12 -0.77 -0.61 4.77 3.08 -1.34 0.36 114.38 119.99 1pra h ARG 5 Ca 0.13 0.05 0.09 0.00 0.07 0.00 0.00 59.98 60.32 1pra h ARG 5 Cb 0.15 0.18 -0.07 0.00 0.08 0.00 0.00 29.97 30.30 1pra h ARG 5 CO -0.19 -0.51 0.24 0.28 -1.07 0.00 0.00 179.97 178.71 1pra h VAL 6 N -0.80 0.78 -0.13 2.04 2.07 -0.42 -0.90 116.25 118.89 1pra h VAL 6 Ca -0.02 -0.15 -0.04 0.00 0.82 0.00 0.00 66.70 67.31 1pra h VAL 6 Cb 0.77 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1pra h VAL 6 CO -0.21 0.08 -0.07 0.50 0.02 0.00 0.00 177.57 177.88 1pra h LYS 7 N 0.42 0.28 -0.51 1.57 3.11 -0.33 0.13 116.57 121.24 1pra h LYS 7 Ca 0.31 -0.13 0.04 0.00 -2.81 0.00 0.00 60.65 58.06 1pra h LYS 7 Cb 0.37 -0.01 -0.04 0.00 -1.00 0.00 0.00 32.23 31.55 1pra h LYS 7 CO -0.30 0.62 0.27 0.66 -2.81 0.00 0.00 179.45 177.89 1pra h SER 8 N -0.07 0.40 -0.66 4.20 4.64 -0.66 0.16 113.55 121.55 1pra h SER 8 Ca 0.03 0.02 0.02 0.00 -0.47 0.00 0.00 61.79 61.39 1pra h SER 8 Cb 0.54 -0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 62.54 1pra h SER 8 CO 0.02 0.28 0.42 0.50 -0.87 0.00 0.00 176.83 177.18 1pra h LYS 9 N 0.52 0.82 -0.52 4.77 1.63 -1.04 -0.41 116.57 122.34 1pra h LYS 9 Ca 0.22 -0.05 0.09 0.00 -0.85 0.00 0.00 60.65 60.07 1pra h LYS 9 Cb 0.11 -0.18 -0.08 0.00 -0.60 0.00 0.00 32.23 31.48 1pra h LYS 9 CO -0.14 0.54 0.08 -0.09 -3.45 0.00 0.00 179.45 176.39 1pra h ARG 10 N 0.84 0.20 0.30 1.90 9.65 0.41 0.39 114.38 128.07 1pra h ARG 10 Ca 0.26 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.13 1pra h ARG 10 Cb -0.03 -0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 28.48 1pra h ARG 10 CO -0.09 0.13 -0.38 0.82 2.80 0.00 0.00 179.97 183.26 1pra h ILE 11 N 0.21 0.23 -0.56 1.20 5.03 -0.39 0.24 117.51 123.47 1pra h ILE 11 Ca 0.26 0.00 0.02 0.00 -0.12 0.00 0.00 64.86 65.02 1pra h ILE 11 Cb 0.38 0.23 -0.03 0.00 -3.03 0.00 0.00 36.82 34.36 1pra h ILE 11 CO -0.37 0.00 0.37 0.06 -0.68 0.00 0.00 178.15 177.54 1pra h GLN 12 N -0.73 0.68 -0.06 2.37 3.07 -0.40 0.22 115.11 120.26 1pra h GLN 12 Ca -0.01 -0.04 -0.10 0.00 0.09 0.00 0.00 58.65 58.59 1pra h GLN 12 Cb 0.68 -0.15 -0.01 0.00 0.08 0.00 0.00 27.48 28.07 1pra h GLN 12 CO -0.11 0.45 -0.41 -0.07 0.09 0.00 0.00 178.83 178.78 1pra h LEU 13 N 0.70 0.13 0.43 0.06 -0.00 -0.73 -3.48 115.31 112.43 1pra h LEU 13 Ca 0.22 -0.05 -0.08 0.00 -0.00 0.00 0.00 57.88 57.96 1pra h LEU 13 Cb 0.01 -0.04 -0.00 0.00 -0.00 0.00 0.00 40.66 40.63 1pra h LEU 13 CO -0.05 0.53 -0.11 0.61 -0.00 0.00 0.00 178.44 179.42 1pra n GLY 14 N -0.27 0.25 3.78 0.83 0.00 0.81 -5.05 105.19 105.54 1pra n GLY 14 Ca -0.02 -0.70 -0.29 0.00 0.00 0.00 0.00 46.02 45.02 1pra n GLY 14 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pra s LEU 15 N -1.27 2.67 0.46 0.99 1.43 -0.92 -5.03 118.68 117.01 1pra s LEU 15 Ca 0.01 -1.37 0.06 0.00 -1.03 0.00 0.00 54.13 51.81 1pra s LEU 15 Cb -0.00 -1.06 -0.02 0.00 0.03 0.00 0.00 46.19 45.14 1pra s LEU 15 CO 0.01 -0.80 0.25 0.54 0.23 0.00 0.00 176.35 176.58 1pra s ASN 16 N -3.98 4.54 0.40 2.29 2.20 -1.26 -4.54 114.94 114.59 1pra s ASN 16 Ca 0.25 -1.13 0.11 0.00 -0.94 0.00 0.00 52.86 51.15 1pra s ASN 16 Cb 0.02 -0.16 0.91 0.00 -2.00 0.00 0.00 41.25 40.02 1pra s ASN 16 CO 0.14 -0.74 1.97 1.56 -2.94 0.00 0.00 177.10 177.10 1pra h GLN 17 N 1.18 0.53 0.42 3.55 4.20 -1.98 -1.38 115.11 121.64 1pra h GLN 17 Ca -0.41 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.25 1pra h GLN 17 Cb 1.27 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.94 1pra h GLN 17 CO 0.65 0.35 -0.20 0.00 -0.67 0.00 0.00 178.83 178.96 1pra h ALA 18 N 1.66 -0.56 -0.56 3.87 0.00 -1.96 0.35 119.26 122.06 1pra h ALA 18 Ca 0.30 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 55.13 1pra h ALA 18 Cb 0.44 0.22 -0.09 0.00 0.00 0.00 0.00 17.79 18.36 1pra h ALA 18 CO -0.09 -0.68 0.05 0.93 0.00 0.00 0.00 179.25 179.45 1pra h GLU 19 N -0.83 0.16 -0.45 0.00 5.08 -1.96 -0.85 114.58 115.73 1pra h GLU 19 Ca -0.06 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.19 1pra h GLU 19 Cb 0.55 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 1pra h GLU 19 CO 0.09 0.11 -0.13 1.25 -1.00 0.00 0.00 179.01 179.33 1pra h LEU 20 N 0.17 0.82 -0.19 1.33 6.46 -1.05 0.16 115.31 123.01 1pra h LEU 20 Ca 0.29 -0.26 0.05 0.00 -0.12 0.00 0.00 57.88 57.84 1pra h LEU 20 Cb 0.44 -0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 40.10 1pra h LEU 20 CO -0.43 0.96 -0.13 0.00 -0.62 0.00 0.00 178.44 178.22 1pra h ALA 21 N 1.11 0.01 -0.52 1.25 0.00 0.42 0.93 119.26 122.46 1pra h ALA 21 Ca 0.12 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1pra h ALA 21 Cb 0.63 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1pra h ALA 21 CO 0.04 -0.56 0.08 -0.56 0.00 0.00 0.00 179.25 178.26 1pra h GLN 22 N -0.13 0.82 -0.57 0.00 3.07 -0.82 0.28 115.11 117.76 1pra h GLN 22 Ca 0.11 -0.19 -0.03 0.00 0.09 0.00 0.00 58.65 58.64 1pra h GLN 22 Cb 0.30 -0.11 -0.03 0.00 0.08 0.00 0.00 27.48 27.71 1pra h GLN 22 CO -0.27 0.77 0.24 0.87 0.09 0.00 0.00 178.83 180.52 1pra h LYS 23 N 0.78 0.82 -0.24 0.06 1.79 -0.05 -1.36 116.57 118.36 1pra h LYS 23 Ca 0.16 -0.12 -0.17 0.00 -2.18 0.00 0.00 60.65 58.34 1pra h LYS 23 Cb 0.35 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 1pra h LYS 23 CO 0.01 0.66 -0.52 0.28 -1.08 0.00 0.00 179.45 178.80 1pra h VAL 24 N 0.81 1.29 -0.22 0.50 2.07 -0.52 -3.46 116.25 116.72 1pra h VAL 24 Ca 0.19 -1.73 0.00 0.00 0.82 0.00 0.00 66.70 65.99 1pra h VAL 24 Cb 0.15 1.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 1pra h VAL 24 CO -0.02 0.55 0.00 0.61 0.02 0.00 0.00 177.57 178.73 1pra n GLY 25 N 0.44 0.85 1.45 2.17 0.00 0.76 -4.97 105.19 105.89 1pra n GLY 25 Ca -0.05 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 1pra n GLY 25 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1pra n THR 26 N -0.35 0.00 -3.87 2.61 5.66 0.06 -5.00 114.28 113.39 1pra n THR 26 Ca 0.00 -1.10 -0.33 0.00 -3.05 0.00 0.00 64.05 59.57 1pra n THR 26 Cb 0.09 0.54 -0.05 0.00 -1.55 0.00 0.00 70.33 69.36 1pra n THR 26 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1pra s THR 27 N -2.60 5.38 0.41 1.09 -4.23 -1.26 -3.49 115.64 110.95 1pra s THR 27 Ca 0.18 -0.15 0.22 0.00 -1.18 0.00 0.00 61.69 60.76 1pra s THR 27 Cb 0.01 -3.57 0.42 0.00 1.34 0.00 0.00 72.50 70.70 1pra s THR 27 CO 0.13 0.26 1.73 -0.61 -0.54 0.00 0.00 174.62 175.59 1pra h GLN 28 N 3.58 0.28 -0.76 3.99 4.15 -1.88 0.96 115.11 125.43 1pra h GLN 28 Ca -0.48 -0.02 0.17 0.00 0.77 0.00 0.00 58.65 59.10 1pra h GLN 28 Cb 1.18 -0.06 -0.12 0.00 0.21 0.00 0.00 27.48 28.69 1pra h GLN 28 CO 0.71 0.19 0.12 -0.56 -1.93 0.00 0.00 178.83 177.36 1pra h GLN 29 N 0.29 0.19 -0.25 1.69 3.07 -1.96 0.19 115.11 118.34 1pra h GLN 29 Ca 0.65 -0.01 -0.14 0.00 0.09 0.00 0.00 58.65 59.24 1pra h GLN 29 Cb 1.82 -0.04 -0.01 0.00 0.08 0.00 0.00 27.48 29.33 1pra h GLN 29 CO -0.32 0.13 -0.42 0.77 0.09 0.00 0.00 178.83 179.08 1pra h SER 30 N 0.20 0.65 -0.13 0.06 0.02 -1.21 0.63 113.55 113.77 1pra h SER 30 Ca 0.43 -0.30 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1pra h SER 30 Cb 0.77 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 1pra h SER 30 CO -0.58 0.99 0.04 0.40 -1.14 0.00 0.00 176.83 176.53 1pra h ILE 31 N 0.50 1.19 0.12 3.27 1.08 -1.15 -1.78 117.51 120.74 1pra h ILE 31 Ca 0.04 -0.59 0.02 0.00 -0.39 0.00 0.00 64.86 63.94 1pra h ILE 31 Cb 0.94 1.34 -0.04 0.00 -3.07 0.00 0.00 36.82 35.98 1pra h ILE 31 CO 0.08 0.17 -0.38 -0.08 -0.69 0.00 0.00 178.15 177.26 1pra h GLU 32 N 0.02 -0.59 -0.88 2.37 4.22 -0.40 -0.17 114.58 119.15 1pra h GLU 32 Ca 0.04 0.04 0.17 0.00 0.08 0.00 0.00 59.36 59.69 1pra h GLU 32 Cb 0.24 0.13 -0.07 0.00 0.50 0.00 0.00 28.75 29.56 1pra h GLU 32 CO -0.00 -0.39 0.57 -0.56 -2.18 0.00 0.00 179.01 176.45 1pra h GLN 33 N -0.61 0.52 -0.11 1.92 3.07 -0.83 0.14 115.11 119.21 1pra h GLN 33 Ca 0.03 -0.03 -0.04 0.00 0.09 0.00 0.00 58.65 58.70 1pra h GLN 33 Cb 0.64 -0.12 -0.00 0.00 0.08 0.00 0.00 27.48 28.08 1pra h GLN 33 CO -0.22 0.35 -0.08 1.25 0.09 0.00 0.00 178.83 180.22 1pra h LEU 34 N 0.54 0.26 -1.56 0.06 7.12 -0.33 -1.27 115.31 120.13 1pra h LEU 34 Ca 0.45 -0.44 0.16 0.00 0.13 0.00 0.00 57.88 58.17 1pra h LEU 34 Cb 0.93 -0.07 -0.05 0.00 -0.53 0.00 0.00 40.66 40.93 1pra h LEU 34 CO -0.19 0.65 0.52 -0.33 -0.13 0.00 0.00 178.44 178.96 1pra h GLU 35 N -0.13 0.41 0.00 1.25 5.08 0.53 0.27 114.58 122.01 1pra h GLU 35 Ca 0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1pra h GLU 35 Cb 0.56 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1pra h GLU 35 CO 0.02 0.27 0.00 0.09 -1.00 0.00 0.00 179.01 178.40 1pra n ASN 36 N -4.48 0.00 -3.74 1.42 3.02 0.34 -4.36 115.26 107.46 1pra n ASN 36 Ca 0.15 -0.53 -0.26 0.00 -0.03 0.00 0.00 54.58 53.91 1pra n ASN 36 Cb 0.55 -0.04 0.05 0.00 -0.61 0.00 0.00 39.78 39.73 1pra n ASN 36 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pra n GLY 37 N 0.24 -0.47 0.14 7.41 0.00 0.96 -4.89 105.19 108.59 1pra n GLY 37 Ca 0.14 0.19 0.04 0.00 0.00 0.00 0.00 46.02 46.39 1pra n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pra h LYS 38 N -2.23 0.00 -6.18 1.61 1.57 -1.78 -3.45 116.57 106.11 1pra h LYS 38 Ca -0.58 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 57.63 1pra h LYS 38 Cb 1.37 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 33.58 1pra h LYS 38 CO 0.60 0.37 -0.64 -0.08 -0.57 0.00 0.00 179.45 179.14 1pra s THR 39 N -3.01 3.29 -0.06 -0.16 -1.32 -1.26 -5.06 115.64 108.06 1pra s THR 39 Ca 0.03 -1.94 -0.17 0.00 -1.21 0.00 0.00 61.69 58.40 1pra s THR 39 Cb 0.07 -2.81 -0.30 0.00 -1.51 0.00 0.00 72.50 67.95 1pra s THR 39 CO 0.75 -0.35 0.73 0.11 -2.21 0.00 0.00 174.62 173.65 1pra h LYS 40 N 1.88 0.32 -2.30 7.08 6.56 -2.02 -3.45 116.57 124.64 1pra h LYS 40 Ca -0.44 -0.54 -0.25 0.00 -1.06 0.00 0.00 60.65 58.36 1pra h LYS 40 Cb 1.25 0.20 -0.33 0.00 -0.57 0.00 0.00 32.23 32.78 1pra h LYS 40 CO 0.61 1.26 -0.56 0.50 -2.06 0.00 0.00 179.45 179.20 1pra s ARG 41 N -2.49 0.25 0.77 3.15 3.00 -1.26 -5.11 118.95 117.26 1pra s ARG 41 Ca -0.16 0.36 -0.12 0.00 -1.00 0.00 0.00 55.73 54.82 1pra s ARG 41 Cb 0.03 -0.86 0.05 0.00 0.00 0.00 0.00 34.95 34.17 1pra s ARG 41 CO 0.82 -0.63 1.10 -1.25 0.00 0.00 0.00 175.30 175.34 1pra s PRO 42 N 2.42 2.34 0.13 5.12 0.04 -1.26 -5.00 135.00 138.79 1pra s PRO 42 Ca 0.09 0.52 -0.07 0.00 0.04 0.00 0.00 61.00 61.58 1pra s PRO 42 Cb -0.15 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 32.36 1pra s PRO 42 CO -0.13 -1.41 1.35 -0.09 0.04 0.00 0.00 177.00 176.75 1pra h ARG 43 N -0.93 0.56 -0.76 4.56 9.65 -2.04 -3.20 114.38 122.23 1pra h ARG 43 Ca -0.46 -0.50 -0.02 0.00 -1.10 0.00 0.00 59.98 57.90 1pra h ARG 43 Cb 1.27 0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 29.95 1pra h ARG 43 CO 0.62 1.12 0.03 1.97 2.80 0.00 0.00 179.97 186.51 1pra n PHE 44 N -3.86 1.33 -0.02 2.20 -1.74 -1.26 -4.42 117.46 109.69 1pra n PHE 44 Ca -0.06 -0.51 -0.09 0.00 -0.56 0.00 0.00 57.45 56.23 1pra n PHE 44 Cb 0.76 -0.38 -0.02 0.00 1.52 0.00 0.00 39.48 41.36 1pra n PHE 44 CO 0.00 0.00 0.00 1.25 -0.56 0.00 0.00 176.76 177.45 1pra h LEU 45 N 2.36 -0.50 -0.50 5.98 5.85 -1.95 0.86 115.31 127.41 1pra h LEU 45 Ca 0.03 0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 1pra h LEU 45 Cb 1.47 0.24 -0.02 0.00 0.37 0.00 0.00 40.66 42.72 1pra h LEU 45 CO 0.33 -0.20 0.17 1.55 -0.34 0.00 0.00 178.44 179.95 1pra h PRO 46 N -0.18 0.77 -0.54 5.25 0.13 -1.88 -0.39 132.00 135.17 1pra h PRO 46 Ca 0.11 -0.16 0.01 0.00 -0.87 0.00 0.00 66.00 65.09 1pra h PRO 46 Cb 0.34 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 31.32 1pra h PRO 46 CO -0.28 0.71 0.34 0.93 -0.23 0.00 0.00 178.00 179.48 1pra h GLU 47 N 0.67 0.67 0.52 0.86 5.08 -1.79 0.19 114.58 120.78 1pra h GLU 47 Ca 0.16 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 1pra h GLU 47 Cb 0.26 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1pra h GLU 47 CO -0.01 0.44 -0.37 1.25 -1.00 0.00 0.00 179.01 179.33 1pra h LEU 48 N 0.69 -0.95 -0.55 1.33 7.12 -0.68 0.12 115.31 122.39 1pra h LEU 48 Ca 0.21 0.06 0.11 0.00 0.13 0.00 0.00 57.88 58.39 1pra h LEU 48 Cb -0.04 0.29 -0.10 0.00 -0.53 0.00 0.00 40.66 40.28 1pra h LEU 48 CO -0.06 -0.55 -0.06 0.00 -0.13 0.00 0.00 178.44 177.64 1pra h ALA 49 N -0.50 0.47 -0.17 1.25 0.00 -0.34 -0.50 119.26 119.48 1pra h ALA 49 Ca -0.06 0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1pra h ALA 49 Cb 0.72 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1pra h ALA 49 CO 0.03 -0.41 -0.21 0.66 0.00 0.00 0.00 179.25 179.31 1pra h SER 50 N 0.07 0.48 -0.91 0.00 4.64 -0.59 0.26 113.55 117.49 1pra h SER 50 Ca 0.28 -0.51 0.12 0.00 -0.47 0.00 0.00 61.79 61.21 1pra h SER 50 Cb 0.43 -0.13 -0.07 0.00 -0.31 0.00 0.00 62.40 62.32 1pra h SER 50 CO -0.51 0.89 0.58 0.00 -0.87 0.00 0.00 176.83 176.92 1pra h ALA 51 N 0.60 1.70 -0.01 5.18 0.00 -0.12 -1.58 119.26 125.03 1pra h ALA 51 Ca 0.02 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1pra h ALA 51 Cb 0.77 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.40 1pra h ALA 51 CO 0.05 0.08 -0.54 -0.07 0.00 0.00 0.00 179.25 178.77 1pra h LEU 52 N 0.82 0.50 0.00 0.00 3.38 -1.03 -3.50 115.31 115.48 1pra h LEU 52 Ca 0.44 -0.74 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1pra h LEU 52 Cb 0.56 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1pra h LEU 52 CO -0.21 1.18 0.00 0.61 0.09 0.00 0.00 178.44 180.11 1pra n GLY 53 N 1.01 0.68 3.52 0.83 0.00 0.66 -4.97 105.19 106.92 1pra n GLY 53 Ca -0.10 -0.32 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 1pra n GLY 53 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1pra s VAL 54 N -1.02 0.00 0.26 1.61 -7.23 0.24 -5.00 120.40 109.25 1pra s VAL 54 Ca 0.00 -1.53 0.03 0.00 -1.81 0.00 0.00 61.98 58.68 1pra s VAL 54 Cb 0.00 -2.56 -0.03 0.00 0.56 0.00 0.00 36.38 34.35 1pra s VAL 54 CO 0.00 0.00 0.40 -0.94 -0.31 0.00 0.00 175.10 174.25 1pra s SER 55 N -3.17 6.32 0.07 4.85 1.04 -1.26 -3.64 113.70 117.90 1pra s SER 55 Ca 0.28 0.19 -0.20 0.00 0.48 0.00 0.00 55.95 56.71 1pra s SER 55 Cb -0.00 -1.92 -0.11 0.00 0.10 0.00 0.00 66.02 64.09 1pra s SER 55 CO 0.17 -0.11 1.47 0.58 0.98 0.00 0.00 173.24 176.32 1pra h VAL 56 N 1.13 1.28 -0.84 5.02 2.07 -1.92 -0.49 116.25 122.49 1pra h VAL 56 Ca -0.51 -1.00 0.22 0.00 0.82 0.00 0.00 66.70 66.23 1pra h VAL 56 Cb 1.22 1.53 -0.14 0.00 -1.52 0.00 0.00 31.29 32.38 1pra h VAL 56 CO 0.62 0.30 0.15 -2.24 0.02 0.00 0.00 177.57 176.43 1pra h ASP 57 N 0.11 -0.13 -0.25 0.57 2.03 -1.99 0.29 116.42 117.05 1pra h ASP 57 Ca 0.05 0.20 -0.05 0.00 -0.73 0.00 0.00 57.03 56.50 1pra h ASP 57 Cb 0.47 0.30 -0.01 0.00 -0.83 0.00 0.00 39.33 39.27 1pra h ASP 57 CO 0.02 -0.17 -0.04 -0.25 -1.03 0.00 0.00 179.24 177.77 1pra h TRP 58 N 0.17 0.51 -0.66 4.15 7.01 -1.72 0.11 115.95 125.52 1pra h TRP 58 Ca 0.51 -0.10 0.14 0.00 2.11 0.00 0.00 58.89 61.55 1pra h TRP 58 Cb 0.99 -0.13 -0.11 0.00 -2.10 0.00 0.00 29.16 27.81 1pra h TRP 58 CO -0.33 0.67 -0.00 -0.07 -2.79 0.00 0.00 178.44 175.92 1pra h LEU 59 N 0.21 -0.30 0.69 0.65 3.38 -0.24 0.78 115.31 120.50 1pra h LEU 59 Ca 0.07 0.17 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 1pra h LEU 59 Cb 0.49 0.29 0.01 0.00 0.09 0.00 0.00 40.66 41.54 1pra h LEU 59 CO 0.02 -0.13 -0.33 -0.07 0.09 0.00 0.00 178.44 178.01 1pra h LEU 60 N 0.11 -0.79 -5.08 1.67 3.38 -0.64 -3.44 115.31 110.52 1pra h LEU 60 Ca 0.35 0.03 -0.27 0.00 0.09 0.00 0.00 57.88 58.08 1pra h LEU 60 Cb 0.58 0.20 -0.20 0.00 0.09 0.00 0.00 40.66 41.33 1pra h LEU 60 CO -0.57 -0.46 -0.56 -0.46 0.09 0.00 0.00 178.44 176.48 1pra n ASN 61 N -5.09 -1.38 -0.12 -0.43 2.04 0.35 -4.89 115.26 105.73 1pra n ASN 61 Ca -0.12 -2.91 -0.18 0.00 -0.44 0.00 0.00 54.58 50.93 1pra n ASN 61 Cb 0.37 0.96 -0.10 0.00 -2.53 0.00 0.00 39.78 38.48 1pra n ASN 61 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1pra n GLY 62 N -0.17 -0.33 2.56 4.83 0.00 0.23 -4.85 105.19 107.47 1pra n GLY 62 Ca 0.04 -0.14 -0.04 0.00 0.00 0.00 0.00 46.02 45.88 1pra n GLY 62 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pra n THR 63 N -3.36-12.09 -3.15 2.61 -2.24 -1.26 -5.01 114.28 89.78 1pra n THR 63 Ca -0.42 2.35 0.05 0.00 -2.27 0.00 0.00 64.05 63.76 1pra n THR 63 Cb 0.91 -6.52 -0.00 0.00 -2.10 0.00 0.00 70.33 62.62 1pra n THR 63 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1pra s SER 64 N -0.93 -0.90 -0.53 3.42 0.15 -1.26 -5.10 113.70 108.55 1pra s SER 64 Ca -0.19 0.23 -0.22 0.00 0.70 0.00 0.00 55.95 56.47 1pra s SER 64 Cb 0.01 1.62 0.05 0.00 -1.71 0.00 0.00 66.02 65.99 1pra s SER 64 CO 0.75 -0.16 0.80 -1.81 1.20 0.00 0.00 173.24 174.01 1pra s ASP 65 N 2.91 6.29 -1.15 5.45 1.11 -1.26 -4.56 116.67 125.46 1pra s ASP 65 Ca 0.16 -0.59 -0.29 0.00 0.18 0.00 0.00 52.55 52.01 1pra s ASP 65 Cb -0.07 -2.37 0.04 0.00 1.07 0.00 0.00 42.92 41.58 1pra s ASP 65 CO -0.21 -1.07 0.68 -1.54 1.18 0.00 0.00 175.17 174.20 1pra n SER 66 N 6.88 -4.34 -3.32 0.27 3.41 -1.26 -4.98 113.62 110.28 1pra n SER 66 Ca -0.02 -1.23 -0.07 0.00 -0.26 0.00 0.00 58.87 57.28 1pra n SER 66 Cb 0.47 -1.79 -0.07 0.00 -0.26 0.00 0.00 64.21 62.56 1pra n SER 66 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1pra s ASN 67 N -3.44 0.02 -0.12 4.04 3.04 -1.26 -5.14 114.94 112.08 1pra s ASN 67 Ca 0.42 0.27 -0.18 0.00 0.04 0.00 0.00 52.86 53.42 1pra s ASN 67 Cb -0.23 1.27 -0.04 0.00 -1.54 0.00 0.00 41.25 40.71 1pra s ASN 67 CO 0.96 -0.30 0.46 -0.69 -3.04 0.00 0.00 177.10 174.49 1pra s VAL 68 N 2.59 5.19 0.00 -5.21 1.01 -1.26 -4.95 120.40 117.76 1pra s VAL 68 Ca 0.14 0.93 0.00 0.00 0.00 0.00 0.00 61.98 63.04 1pra s VAL 68 Cb -0.15 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.43 1pra s VAL 68 CO -0.18 0.34 0.00 -1.14 0.00 0.00 0.00 175.10 174.12