#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 0.48 -0.73 0.44 6.09 -1.93 0.18 117.51 122.04 1pra h ILE 2 Ca 0.00 0.00 0.09 0.00 -1.37 0.00 0.00 64.86 63.58 1pra h ILE 2 Cb 0.00 0.48 -0.11 0.00 0.47 0.00 0.00 36.82 37.66 1pra h ILE 2 CO 0.00 0.00 -0.52 -1.28 -3.07 0.00 0.00 178.15 173.28 1pra h SER 3 N -0.45 -1.83 -0.68 2.19 0.87 -1.82 0.79 113.55 112.61 1pra h SER 3 Ca 0.02 0.28 -0.01 0.00 -1.23 0.00 0.00 61.79 60.85 1pra h SER 3 Cb 0.46 0.81 -0.03 0.00 -0.44 0.00 0.00 62.40 63.20 1pra h SER 3 CO -0.11 -0.31 0.38 0.77 -0.53 0.00 0.00 176.83 177.03 1pra h SER 4 N -0.17 0.87 0.93 6.23 4.64 -1.84 0.62 113.55 124.83 1pra h SER 4 Ca 0.16 -0.07 -0.05 0.00 -0.47 0.00 0.00 61.79 61.37 1pra h SER 4 Cb 0.52 -0.22 0.01 0.00 -0.31 0.00 0.00 62.40 62.40 1pra h SER 4 CO -0.79 0.70 -0.45 0.03 -0.87 0.00 0.00 176.83 175.46 1pra h ARG 5 N 0.98 -1.20 -0.16 4.77 3.08 0.11 0.25 114.38 122.20 1pra h ARG 5 Ca 0.25 0.08 0.05 0.00 0.07 0.00 0.00 59.98 60.43 1pra h ARG 5 Cb 0.03 0.27 -0.06 0.00 0.08 0.00 0.00 29.97 30.30 1pra h ARG 5 CO -0.04 -0.80 -0.23 0.28 -1.07 0.00 0.00 179.97 178.11 1pra h VAL 6 N -1.30 0.43 0.32 2.04 2.07 -0.68 0.12 116.25 119.24 1pra h VAL 6 Ca -0.13 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 1pra h VAL 6 Cb 0.96 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1pra h VAL 6 CO 0.21 0.00 -0.15 0.50 0.02 0.00 0.00 177.57 178.15 1pra h LYS 7 N -0.28 -0.41 -0.51 1.57 3.64 -0.89 -0.54 116.57 119.15 1pra h LYS 7 Ca 0.11 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.57 1pra h LYS 7 Cb 0.44 0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.31 1pra h LYS 7 CO -0.32 -0.20 0.25 0.77 -2.27 0.00 0.00 179.45 177.69 1pra h SER 8 N -0.55 0.35 -0.38 4.20 0.02 -0.29 0.71 113.55 117.61 1pra h SER 8 Ca -0.04 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 60.96 1pra h SER 8 Cb 0.40 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.88 1pra h SER 8 CO 0.07 0.24 0.21 0.50 -1.14 0.00 0.00 176.83 176.71 1pra h LYS 9 N 0.49 0.41 -0.58 3.45 1.63 -0.70 0.05 116.57 121.32 1pra h LYS 9 Ca 0.23 -0.02 0.11 0.00 -0.85 0.00 0.00 60.65 60.11 1pra h LYS 9 Cb 0.15 -0.09 -0.08 0.00 -0.60 0.00 0.00 32.23 31.60 1pra h LYS 9 CO -0.17 0.27 0.12 -0.09 -3.45 0.00 0.00 179.45 176.14 1pra h ARG 10 N 0.42 0.25 0.27 1.90 2.43 -0.10 0.11 114.38 119.67 1pra h ARG 10 Ca 0.16 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1pra h ARG 10 Cb 0.03 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 1pra h ARG 10 CO -0.09 0.16 -0.30 0.82 -1.51 0.00 0.00 179.97 179.05 1pra h ILE 11 N 0.25 0.36 -0.74 1.20 5.03 -0.20 0.29 117.51 123.71 1pra h ILE 11 Ca 0.30 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 65.03 1pra h ILE 11 Cb 0.43 0.36 -0.04 0.00 -3.03 0.00 0.00 36.82 34.55 1pra h ILE 11 CO -0.38 0.00 0.41 -0.61 -0.68 0.00 0.00 178.15 176.89 1pra h GLN 12 N -0.62 1.02 -0.56 2.37 4.15 -0.16 0.61 115.11 121.93 1pra h GLN 12 Ca -0.01 -0.11 -0.03 0.00 0.77 0.00 0.00 58.65 59.28 1pra h GLN 12 Cb 0.58 -0.21 -0.03 0.00 0.21 0.00 0.00 27.48 28.03 1pra h GLN 12 CO -0.08 0.74 0.22 -0.07 -1.93 0.00 0.00 178.83 177.71 1pra h LEU 13 N 1.03 0.73 -0.91 -2.39 3.38 -0.63 -3.48 115.31 113.04 1pra h LEU 13 Ca 0.26 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1pra h LEU 13 Cb 0.02 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1pra h LEU 13 CO -0.04 0.66 0.00 0.61 0.09 0.00 0.00 178.44 179.76 1pra n GLY 14 N -1.06 0.77 3.12 0.83 0.00 0.93 -5.08 105.19 104.71 1pra n GLY 14 Ca 0.05 -0.39 -0.14 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.91 2.30 0.52 0.99 1.43 -0.60 -5.03 118.68 117.38 1pra s LEU 15 Ca 0.00 -0.64 -0.01 0.00 -1.03 0.00 0.00 54.13 52.45 1pra s LEU 15 Cb 0.00 -0.27 0.01 0.00 0.03 0.00 0.00 46.19 45.97 1pra s LEU 15 CO 0.00 -0.20 0.76 0.54 0.23 0.00 0.00 176.35 177.68 1pra s ASN 16 N -1.87 5.58 0.42 2.29 4.22 -1.26 -4.32 114.94 120.00 1pra s ASN 16 Ca -0.04 0.30 0.20 0.00 -2.14 0.00 0.00 52.86 51.18 1pra s ASN 16 Cb -0.08 -1.37 1.14 0.00 1.28 0.00 0.00 41.25 42.22 1pra s ASN 16 CO 0.00 -0.94 1.81 1.56 -2.04 0.00 0.00 177.10 177.49 1pra h GLN 17 N 0.14 0.35 0.13 3.55 4.20 -1.98 0.63 115.11 122.13 1pra h GLN 17 Ca -0.45 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.23 1pra h GLN 17 Cb 1.27 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1pra h GLN 17 CO 0.57 0.23 -0.06 0.00 -0.67 0.00 0.00 178.83 178.90 1pra h ALA 18 N 1.60 -0.17 -0.46 3.87 0.00 -1.96 0.18 119.26 122.32 1pra h ALA 18 Ca 0.55 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.28 1pra h ALA 18 Cb 1.45 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.29 1pra h ALA 18 CO -0.22 -0.44 0.25 0.93 0.00 0.00 0.00 179.25 179.76 1pra h GLU 19 N -0.48 0.64 -0.42 0.00 5.08 -1.75 0.24 114.58 117.89 1pra h GLU 19 Ca -0.02 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1pra h GLU 19 Cb 0.39 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1pra h GLU 19 CO 0.03 0.51 0.28 1.25 -1.00 0.00 0.00 179.01 180.08 1pra h LEU 20 N 0.60 0.47 -0.25 1.33 5.85 -0.87 0.17 115.31 122.61 1pra h LEU 20 Ca 0.16 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.93 1pra h LEU 20 Cb 0.06 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 40.91 1pra h LEU 20 CO -0.02 0.34 -0.23 0.00 -0.34 0.00 0.00 178.44 178.19 1pra h ALA 21 N 1.16 -0.09 -0.45 1.25 0.00 -0.23 0.35 119.26 121.24 1pra h ALA 21 Ca 0.16 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1pra h ALA 21 Cb -0.06 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1pra h ALA 21 CO -0.04 -0.65 0.20 1.96 0.00 0.00 0.00 179.25 180.73 1pra h GLN 22 N -0.23 0.66 -0.41 0.00 4.20 -0.48 0.23 115.11 119.08 1pra h GLN 22 Ca 0.14 -0.11 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 1pra h GLN 22 Cb 0.44 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 1pra h GLN 22 CO -0.38 0.58 0.19 -0.22 -0.67 0.00 0.00 178.83 178.33 1pra h LYS 23 N 0.58 0.58 0.00 1.46 3.64 -0.29 -0.02 116.57 122.52 1pra h LYS 23 Ca 0.15 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.37 1pra h LYS 23 Cb 0.15 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1pra h LYS 23 CO -0.02 0.46 -0.45 0.28 -2.27 0.00 0.00 179.45 177.45 1pra h VAL 24 N 0.58 1.05 -0.48 2.00 2.07 0.30 -3.47 116.25 118.29 1pra h VAL 24 Ca 0.15 -1.72 0.00 0.00 0.82 0.00 0.00 66.70 65.94 1pra h VAL 24 Cb 0.08 2.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1pra h VAL 24 CO -0.02 0.44 0.00 0.61 0.02 0.00 0.00 177.57 178.62 1pra n GLY 25 N 0.27 0.86 0.00 2.17 0.00 0.57 -4.83 105.19 104.24 1pra n GLY 25 Ca -0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.53 0.00 -4.31 2.61 5.66 0.19 -5.01 114.28 110.88 1pra n THR 26 Ca 0.00 0.00 -0.19 0.00 -3.05 0.00 0.00 64.05 60.81 1pra n THR 26 Cb 0.40 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.07 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 0.32 1.64 0.34 1.09 -4.23 -1.26 -3.82 115.64 109.72 1pra s THR 27 Ca 0.00 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 58.66 1pra s THR 27 Cb 0.00 -1.85 0.34 0.00 1.34 0.00 0.00 72.50 72.33 1pra s THR 27 CO 0.00 -0.47 1.70 -0.61 -0.54 0.00 0.00 174.62 174.69 1pra h GLN 28 N 3.01 0.40 -0.91 3.99 4.15 -1.88 0.32 115.11 124.19 1pra h GLN 28 Ca -0.40 -0.02 0.24 0.00 0.77 0.00 0.00 58.65 59.24 1pra h GLN 28 Cb 1.21 -0.09 -0.13 0.00 0.21 0.00 0.00 27.48 28.68 1pra h GLN 28 CO 0.56 0.26 0.40 0.37 -1.93 0.00 0.00 178.83 178.49 1pra h GLN 29 N 0.41 0.36 -0.15 1.69 5.75 -1.96 0.27 115.11 121.47 1pra h GLN 29 Ca 0.69 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 59.16 1pra h GLN 29 Cb 1.55 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 30.01 1pra h GLN 29 CO -0.52 0.24 0.07 0.77 -2.65 0.00 0.00 178.83 176.73 1pra h SER 30 N 0.37 0.21 0.69 -0.69 0.02 -1.34 0.18 113.55 112.98 1pra h SER 30 Ca 0.59 -0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 61.35 1pra h SER 30 Cb 1.16 -0.05 0.01 0.00 0.14 0.00 0.00 62.40 63.66 1pra h SER 30 CO -0.56 0.30 -0.33 0.40 -1.14 0.00 0.00 176.83 175.50 1pra h ILE 31 N 0.10 0.27 -0.81 3.27 5.03 -1.08 -1.36 117.51 122.93 1pra h ILE 31 Ca 0.05 -0.13 0.20 0.00 -0.12 0.00 0.00 64.86 64.86 1pra h ILE 31 Cb 0.15 0.31 -0.13 0.00 -3.03 0.00 0.00 36.82 34.13 1pra h ILE 31 CO -0.00 0.02 0.21 -0.08 -0.68 0.00 0.00 178.15 177.61 1pra h GLU 32 N -1.02 0.24 -0.01 2.37 4.57 -0.56 0.30 114.58 120.47 1pra h GLU 32 Ca -0.09 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.10 1pra h GLU 32 Cb 0.73 -0.05 -0.06 0.00 -0.16 0.00 0.00 28.75 29.21 1pra h GLU 32 CO 0.15 0.16 -0.49 0.37 -1.18 0.00 0.00 179.01 178.03 1pra h GLN 33 N 0.25 -0.60 -0.59 1.92 4.15 -0.42 0.56 115.11 120.38 1pra h GLN 33 Ca 0.48 0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.87 1pra h GLN 33 Cb 0.90 0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.71 1pra h GLN 33 CO -0.59 -0.40 0.08 1.25 -1.93 0.00 0.00 178.83 177.24 1pra h LEU 34 N -0.63 0.92 -0.63 -2.39 5.85 0.20 -2.46 115.31 116.18 1pra h LEU 34 Ca 0.03 -0.21 0.09 0.00 0.84 0.00 0.00 57.88 58.63 1pra h LEU 34 Cb 0.69 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.41 1pra h LEU 34 CO -0.35 0.94 0.28 -0.33 -0.34 0.00 0.00 178.44 178.63 1pra h GLU 35 N 0.91 0.47 0.00 1.25 3.07 -0.17 0.16 114.58 120.27 1pra h GLU 35 Ca 0.18 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.01 1pra h GLU 35 Cb 0.42 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 1pra h GLU 35 CO 0.01 0.31 0.00 0.27 -1.40 0.00 0.00 179.01 178.21 1pra n ASN 36 N -4.94 0.10 -2.12 1.42 0.23 0.16 -4.53 115.26 105.58 1pra n ASN 36 Ca 0.09 0.52 -0.12 0.00 -0.53 0.00 0.00 54.58 54.54 1pra n ASN 36 Cb 0.26 -0.54 0.04 0.00 -2.08 0.00 0.00 39.78 37.46 1pra n ASN 36 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1pra n GLY 37 N 0.56 0.17 0.08 4.83 0.00 0.55 -4.95 105.19 106.43 1pra n GLY 37 Ca 0.05 -0.19 0.12 0.00 0.00 0.00 0.00 46.02 46.00 1pra n GLY 37 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1pra h LYS 38 N -1.39 0.00 -4.97 1.61 2.10 -1.79 -3.46 116.57 108.68 1pra h LYS 38 Ca -0.30 0.00 -0.49 0.00 -2.00 0.00 0.00 60.65 57.86 1pra h LYS 38 Cb 1.19 0.00 -0.31 0.00 -0.90 0.00 0.00 32.23 32.21 1pra h LYS 38 CO 0.29 0.00 -0.81 0.99 -2.00 0.00 0.00 179.45 177.92 1pra s THR 39 N -3.16 1.08 -0.01 0.07 2.01 -1.26 -5.05 115.64 109.33 1pra s THR 39 Ca 0.07 -0.53 -0.23 0.00 0.31 0.00 0.00 61.69 61.31 1pra s THR 39 Cb 0.13 -0.94 -0.19 0.00 0.01 0.00 0.00 72.50 71.51 1pra s THR 39 CO 0.69 0.32 1.20 0.07 -0.69 0.00 0.00 174.62 176.21 1pra h LYS 40 N 6.25 0.23 -2.64 4.92 -0.00 -2.00 -3.44 116.57 119.89 1pra h LYS 40 Ca -0.33 -0.16 -0.41 0.00 -0.00 0.00 0.00 60.65 59.75 1pra h LYS 40 Cb 1.17 0.03 -0.38 0.00 -0.00 0.00 0.00 32.23 33.05 1pra h LYS 40 CO 0.48 0.77 -0.70 0.50 -0.00 0.00 0.00 179.45 180.51 1pra s ARG 41 N -3.82 0.19 1.03 0.07 3.52 -1.26 -4.94 118.95 113.74 1pra s ARG 41 Ca -0.15 -0.13 -0.15 0.00 -0.13 0.00 0.00 55.73 55.17 1pra s ARG 41 Cb 0.03 -1.23 0.21 0.00 -1.56 0.00 0.00 34.95 32.40 1pra s ARG 41 CO 0.74 -0.83 1.16 -1.25 -0.81 0.00 0.00 175.30 174.30 1pra s PRO 42 N 2.23 0.14 0.15 5.12 0.04 -1.26 -4.99 135.00 136.43 1pra s PRO 42 Ca 0.07 0.07 -0.07 0.00 0.04 0.00 0.00 61.00 61.11 1pra s PRO 42 Cb -0.15 -1.74 -0.02 0.00 0.04 0.00 0.00 34.50 32.62 1pra s PRO 42 CO -0.22 -2.83 1.40 0.00 0.04 0.00 0.00 177.00 175.39 1pra h ARG 43 N -1.95 0.64 -0.71 4.56 3.08 -2.02 -3.18 114.38 114.80 1pra h ARG 43 Ca -0.48 -0.48 0.00 0.00 0.07 0.00 0.00 59.98 59.09 1pra h ARG 43 Cb 1.30 0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.44 1pra h ARG 43 CO 0.48 1.10 0.00 1.97 -1.07 0.00 0.00 179.97 182.45 1pra n PHE 44 N -3.92 0.75 -0.01 3.04 1.16 -1.26 -4.34 117.46 112.89 1pra n PHE 44 Ca -0.05 -0.28 -0.09 0.00 -1.87 0.00 0.00 57.45 55.16 1pra n PHE 44 Cb 0.69 -0.21 -0.04 0.00 -1.61 0.00 0.00 39.48 38.32 1pra n PHE 44 CO 0.00 0.00 0.00 1.25 -1.87 0.00 0.00 176.76 176.14 1pra h LEU 45 N 1.67 -0.21 -0.54 5.98 7.12 -1.93 0.26 115.31 127.66 1pra h LEU 45 Ca 0.00 0.05 -0.09 0.00 0.13 0.00 0.00 57.88 57.97 1pra h LEU 45 Cb 0.95 0.12 -0.02 0.00 -0.53 0.00 0.00 40.66 41.17 1pra h LEU 45 CO 0.16 -0.09 -0.01 1.55 -0.13 0.00 0.00 178.44 179.92 1pra h PRO 46 N -0.05 0.97 -0.48 5.25 0.13 -1.87 -0.03 132.00 135.91 1pra h PRO 46 Ca 0.07 -0.31 0.04 0.00 -0.87 0.00 0.00 66.00 64.93 1pra h PRO 46 Cb 0.16 -0.08 -0.04 0.00 0.13 0.00 0.00 31.00 31.16 1pra h PRO 46 CO -0.16 0.98 0.24 0.93 -0.23 0.00 0.00 178.00 179.75 1pra h GLU 47 N 0.84 0.45 -0.42 0.86 5.08 -1.79 0.37 114.58 119.97 1pra h GLU 47 Ca 0.15 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.35 1pra h GLU 47 Cb 0.55 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1pra h GLU 47 CO 0.03 0.30 -0.26 1.25 -1.00 0.00 0.00 179.01 179.33 1pra h LEU 48 N 0.47 0.96 0.50 1.33 6.46 -0.29 0.13 115.31 124.86 1pra h LEU 48 Ca 0.21 -0.42 -0.01 0.00 -0.12 0.00 0.00 57.88 57.54 1pra h LEU 48 Cb 0.13 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 39.77 1pra h LEU 48 CO -0.15 1.17 -0.45 0.00 -0.62 0.00 0.00 178.44 178.39 1pra h ALA 49 N 0.82 -1.02 -0.30 1.25 0.00 -0.59 0.12 119.26 119.54 1pra h ALA 49 Ca 0.09 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1pra h ALA 49 Cb 0.83 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 1pra h ALA 49 CO 0.07 -1.11 0.16 0.66 0.00 0.00 0.00 179.25 179.03 1pra h SER 50 N -0.94 0.38 -0.65 0.00 4.64 -0.90 0.38 113.55 116.46 1pra h SER 50 Ca -0.05 -0.10 0.13 0.00 -0.47 0.00 0.00 61.79 61.30 1pra h SER 50 Cb 0.81 -0.10 -0.10 0.00 -0.31 0.00 0.00 62.40 62.71 1pra h SER 50 CO -0.03 0.37 0.13 0.00 -0.87 0.00 0.00 176.83 176.42 1pra h ALA 51 N 1.02 0.78 -0.02 5.18 0.00 -0.64 -1.40 119.26 124.19 1pra h ALA 51 Ca 0.10 0.15 -0.21 0.00 0.00 0.00 0.00 54.91 54.96 1pra h ALA 51 Cb 0.08 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1pra h ALA 51 CO -0.02 -0.33 -0.87 -0.07 0.00 0.00 0.00 179.25 177.97 1pra h LEU 52 N 0.25 0.47 -0.45 0.00 3.38 -0.68 -3.49 115.31 114.79 1pra h LEU 52 Ca 0.35 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pra h LEU 52 Cb 0.56 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1pra h LEU 52 CO -0.46 1.13 0.00 0.61 0.09 0.00 0.00 178.44 179.82 1pra n GLY 53 N 0.82 0.74 3.29 0.83 0.00 0.11 -5.04 105.19 105.94 1pra n GLY 53 Ca -0.05 -0.18 -0.16 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.96 0.36 0.37 1.61 -7.23 0.15 -5.00 120.40 108.70 1pra s VAL 54 Ca 0.00 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.02 1pra s VAL 54 Cb 0.00 -2.58 -0.08 0.00 0.56 0.00 0.00 36.38 34.28 1pra s VAL 54 CO 0.00 0.00 0.78 -0.94 -0.31 0.00 0.00 175.10 174.63 1pra s SER 55 N -3.29 6.72 0.22 4.85 1.04 -1.26 -3.77 113.70 118.21 1pra s SER 55 Ca 0.38 1.31 -0.08 0.00 0.48 0.00 0.00 55.95 58.04 1pra s SER 55 Cb 0.07 -2.39 0.32 0.00 0.10 0.00 0.00 66.02 64.12 1pra s SER 55 CO 0.14 -0.29 1.77 0.58 0.98 0.00 0.00 173.24 176.41 1pra h VAL 56 N 1.67 0.82 -0.94 5.02 2.07 -1.92 0.78 116.25 123.75 1pra h VAL 56 Ca -0.48 -0.19 0.14 0.00 0.82 0.00 0.00 66.70 66.99 1pra h VAL 56 Cb 1.18 0.24 -0.09 0.00 -1.52 0.00 0.00 31.29 31.10 1pra h VAL 56 CO 0.64 0.10 0.56 0.44 0.02 0.00 0.00 177.57 179.33 1pra h ASP 57 N 0.54 0.77 -0.09 0.57 5.19 -1.93 0.16 116.42 121.62 1pra h ASP 57 Ca 0.34 0.07 -0.17 0.00 -0.62 0.00 0.00 57.03 56.64 1pra h ASP 57 Cb 0.37 -0.08 0.01 0.00 0.18 0.00 0.00 39.33 39.81 1pra h ASP 57 CO -0.28 0.37 -0.60 -0.25 -3.12 0.00 0.00 179.24 175.35 1pra h TRP 58 N 0.83 0.79 -0.78 4.55 7.01 -1.45 0.17 115.95 127.08 1pra h TRP 58 Ca 0.49 -0.36 0.11 0.00 2.11 0.00 0.00 58.89 61.24 1pra h TRP 58 Cb 0.60 -0.12 -0.05 0.00 -2.10 0.00 0.00 29.16 27.49 1pra h TRP 58 CO -0.03 1.16 0.51 -0.07 -2.79 0.00 0.00 178.44 177.22 1pra h LEU 59 N 0.19 0.57 0.01 0.65 3.38 0.69 1.00 115.31 121.80 1pra h LEU 59 Ca -0.05 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1pra h LEU 59 Cb 1.26 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1pra h LEU 59 CO 0.12 0.32 -0.12 -0.07 0.09 0.00 0.00 178.44 178.79 1pra h LEU 60 N 0.62 0.08 0.00 1.67 3.38 -0.70 -3.41 115.31 116.95 1pra h LEU 60 Ca 0.37 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.45 1pra h LEU 60 Cb 0.58 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1pra h LEU 60 CO -0.14 0.96 -0.01 0.78 0.09 0.00 0.00 178.44 180.12 1pra h ASN 61 N -0.78 0.00 0.00 -0.43 2.35 -0.43 -3.49 115.58 112.80 1pra h ASN 61 Ca -0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1pra h ASN 61 Cb 0.99 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.36 1pra h ASN 61 CO 0.02 0.28 0.00 0.61 -1.65 0.00 0.00 177.43 176.69 1pra n GLY 62 N 1.87 0.75 3.00 2.83 0.00 0.34 -4.98 105.19 109.00 1pra n GLY 62 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 1pra n GLY 62 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pra s THR 63 N -2.00 -0.76 0.28 2.61 -4.23 -1.26 -5.03 115.64 105.25 1pra s THR 63 Ca 0.00 -0.20 0.00 0.00 -1.18 0.00 0.00 61.69 60.31 1pra s THR 63 Cb 0.00 -0.96 0.00 0.00 1.34 0.00 0.00 72.50 72.88 1pra s THR 63 CO 0.00 -0.19 0.00 -0.24 -0.54 0.00 0.00 174.62 173.65 1pra n SER 64 N 5.33 -7.07 -4.50 3.99 2.88 -1.26 -3.77 113.62 109.21 1pra n SER 64 Ca 0.03 0.48 -0.42 0.00 -1.33 0.00 0.00 58.87 57.62 1pra n SER 64 Cb 0.51 -3.61 -0.04 0.00 -0.75 0.00 0.00 64.21 60.33 1pra n SER 64 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1pra s ASP 65 N -6.26 6.23 -0.29 -3.46 2.15 -1.26 -4.17 116.67 109.60 1pra s ASP 65 Ca 0.00 -0.62 -0.06 0.00 0.43 0.00 0.00 52.55 52.31 1pra s ASP 65 Cb 0.00 -2.47 0.01 0.00 -0.30 0.00 0.00 42.92 40.16 1pra s ASP 65 CO 0.00 -1.51 0.16 -1.20 -0.17 0.00 0.00 175.17 172.45 1pra n SER 66 N 8.17 -7.61 0.00 -0.34 7.64 -1.26 -4.85 113.62 115.36 1pra n SER 66 Ca 0.00 0.98 0.00 0.00 1.01 0.00 0.00 58.87 60.86 1pra n SER 66 Cb 0.47 -4.45 0.00 0.00 -1.01 0.00 0.00 64.21 59.22 1pra n SER 66 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1pra n ASN 67 N 0.56 -1.48 -4.70 6.43 3.02 -1.26 -4.94 115.26 112.89 1pra n ASN 67 Ca 0.02 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.13 1pra n ASN 67 Cb 0.22 0.95 -0.02 0.00 -0.61 0.00 0.00 39.78 40.32 1pra n ASN 67 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1pra n VAL 68 N -0.54 1.17 0.32 2.41 0.31 -1.25 -4.70 118.33 116.05 1pra n VAL 68 Ca 0.00 -0.29 0.03 0.00 -0.01 0.00 0.00 64.34 64.06 1pra n VAL 68 Cb 0.00 -1.64 0.15 0.00 -0.91 0.00 0.00 33.84 31.45 1pra n VAL 68 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05