#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 0.07 -0.54 -1.33 6.09 -1.94 0.29 117.51 120.15 1pra h ILE 2 Ca 0.00 0.00 0.11 0.00 -1.37 0.00 0.00 64.86 63.60 1pra h ILE 2 Cb 0.00 0.07 -0.11 0.00 0.47 0.00 0.00 36.82 37.25 1pra h ILE 2 CO 0.00 0.00 -0.21 0.77 -3.07 0.00 0.00 178.15 175.64 1pra h SER 3 N -0.70 -0.73 -0.58 2.19 4.64 -1.69 -0.47 113.55 116.22 1pra h SER 3 Ca 0.01 0.18 0.05 0.00 -0.47 0.00 0.00 61.79 61.57 1pra h SER 3 Cb 0.73 0.42 -0.05 0.00 -0.31 0.00 0.00 62.40 63.18 1pra h SER 3 CO -0.28 -0.24 0.30 0.28 -0.87 0.00 0.00 176.83 176.02 1pra h SER 4 N -0.08 0.43 0.11 4.97 0.02 -1.80 0.21 113.55 117.41 1pra h SER 4 Ca 0.25 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 1pra h SER 4 Cb 0.47 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 1pra h SER 4 CO -0.59 0.29 -0.28 0.03 -1.14 0.00 0.00 176.83 175.13 1pra h ARG 5 N 0.57 -0.42 0.22 3.45 3.08 0.12 0.33 114.38 121.73 1pra h ARG 5 Ca 0.26 0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.33 1pra h ARG 5 Cb 0.17 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1pra h ARG 5 CO -0.18 -0.28 -0.11 0.28 -1.07 0.00 0.00 179.97 178.62 1pra h VAL 6 N -0.43 0.78 0.40 2.04 2.07 -1.24 -1.28 116.25 118.58 1pra h VAL 6 Ca -0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1pra h VAL 6 Cb 0.42 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 1pra h VAL 6 CO -0.13 0.00 -0.29 0.50 0.02 0.00 0.00 177.57 177.67 1pra h LYS 7 N -0.30 -0.66 -0.81 1.57 3.64 -0.54 0.37 116.57 119.85 1pra h LYS 7 Ca -0.03 0.05 0.16 0.00 -1.27 0.00 0.00 60.65 59.56 1pra h LYS 7 Cb 0.23 0.15 -0.10 0.00 -0.41 0.00 0.00 32.23 32.10 1pra h LYS 7 CO 0.05 -0.44 0.34 0.77 -2.27 0.00 0.00 179.45 177.90 1pra h SER 8 N -0.69 0.32 -0.15 4.20 0.02 -0.30 0.29 113.55 117.24 1pra h SER 8 Ca -0.04 0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1pra h SER 8 Cb 0.59 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.21 1pra h SER 8 CO 0.01 0.09 0.07 0.50 -1.14 0.00 0.00 176.83 176.36 1pra h LYS 9 N 0.46 0.21 -0.74 3.45 3.11 -0.61 -0.93 116.57 121.52 1pra h LYS 9 Ca 0.46 -0.03 0.09 0.00 -2.81 0.00 0.00 60.65 58.36 1pra h LYS 9 Cb 0.74 -0.04 -0.07 0.00 -1.00 0.00 0.00 32.23 31.86 1pra h LYS 9 CO -0.44 0.25 0.38 -0.09 -2.81 0.00 0.00 179.45 176.74 1pra h ARG 10 N 0.12 0.62 0.37 1.90 2.43 0.54 0.38 114.38 120.74 1pra h ARG 10 Ca 0.05 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1pra h ARG 10 Cb 0.10 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1pra h ARG 10 CO -0.01 0.41 -0.40 0.82 -1.51 0.00 0.00 179.97 179.29 1pra h ILE 11 N 0.64 0.20 -0.89 1.20 5.03 -0.11 0.45 117.51 124.03 1pra h ILE 11 Ca 0.36 0.00 0.02 0.00 -0.12 0.00 0.00 64.86 65.12 1pra h ILE 11 Cb 0.37 0.20 -0.05 0.00 -3.03 0.00 0.00 36.82 34.31 1pra h ILE 11 CO -0.26 0.00 0.58 -0.61 -0.68 0.00 0.00 178.15 177.18 1pra h GLN 12 N -0.79 1.13 0.00 2.37 4.15 -0.72 0.77 115.11 122.01 1pra h GLN 12 Ca -0.03 -0.07 -0.02 0.00 0.77 0.00 0.00 58.65 59.31 1pra h GLN 12 Cb 0.72 -0.25 -0.00 0.00 0.21 0.00 0.00 27.48 28.15 1pra h GLN 12 CO -0.08 0.75 -0.08 -0.07 -1.93 0.00 0.00 178.83 177.42 1pra h LEU 13 N 1.16 0.00 -0.07 -2.39 -0.00 -0.58 -3.47 115.31 109.96 1pra h LEU 13 Ca 0.34 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 58.10 1pra h LEU 13 Cb -0.06 0.00 0.02 0.00 -0.00 0.00 0.00 40.66 40.62 1pra h LEU 13 CO -0.10 0.08 -0.18 0.61 -0.00 0.00 0.00 178.44 178.85 1pra n GLY 14 N -1.22 0.33 3.50 0.83 0.00 0.15 -5.05 105.19 103.73 1pra n GLY 14 Ca -0.03 -0.52 -0.25 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.30 2.67 0.25 0.99 1.43 -0.61 -5.03 118.68 116.08 1pra s LEU 15 Ca 0.09 -1.06 0.06 0.00 -1.03 0.00 0.00 54.13 52.18 1pra s LEU 15 Cb -0.04 -1.10 -0.03 0.00 0.03 0.00 0.00 46.19 45.05 1pra s LEU 15 CO 0.11 -0.04 0.33 0.54 0.23 0.00 0.00 176.35 177.52 1pra s ASN 16 N -3.55 6.13 0.41 2.29 4.22 -1.26 -4.45 114.94 118.72 1pra s ASN 16 Ca 0.31 -0.01 0.19 0.00 -2.14 0.00 0.00 52.86 51.21 1pra s ASN 16 Cb -0.03 -1.73 1.12 0.00 1.28 0.00 0.00 41.25 41.89 1pra s ASN 16 CO 0.16 -0.08 1.78 1.56 -2.04 0.00 0.00 177.10 178.48 1pra h GLN 17 N 1.23 0.37 0.40 3.55 4.20 -1.98 -0.26 115.11 122.61 1pra h GLN 17 Ca -0.51 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.16 1pra h GLN 17 Cb 1.23 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.93 1pra h GLN 17 CO 0.61 0.24 -0.19 0.00 -0.67 0.00 0.00 178.83 178.82 1pra h ALA 18 N 1.61 -0.53 -0.62 3.87 0.00 -1.95 0.24 119.26 121.88 1pra h ALA 18 Ca 0.57 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.45 1pra h ALA 18 Cb 1.49 0.21 -0.08 0.00 0.00 0.00 0.00 17.79 19.41 1pra h ALA 18 CO -0.26 -0.77 0.23 0.93 0.00 0.00 0.00 179.25 179.38 1pra h GLU 19 N -0.60 0.39 -0.62 0.00 4.39 -1.50 -0.80 114.58 115.84 1pra h GLU 19 Ca -0.05 -0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.57 1pra h GLU 19 Cb 0.45 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.98 1pra h GLU 19 CO 0.09 0.26 0.18 1.25 -1.16 0.00 0.00 179.01 179.63 1pra h LEU 20 N 0.40 0.92 -0.24 1.33 5.85 -0.99 -0.66 115.31 121.92 1pra h LEU 20 Ca 0.32 -0.22 0.06 0.00 0.84 0.00 0.00 57.88 58.88 1pra h LEU 20 Cb 0.41 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.12 1pra h LEU 20 CO -0.32 0.90 -0.31 0.00 -0.34 0.00 0.00 178.44 178.36 1pra h ALA 21 N 1.06 -0.27 -0.73 1.25 0.00 0.53 0.20 119.26 121.29 1pra h ALA 21 Ca 0.20 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 1pra h ALA 21 Cb 0.32 0.63 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1pra h ALA 21 CO -0.00 -0.75 0.28 -0.56 0.00 0.00 0.00 179.25 178.22 1pra h GLN 22 N -0.32 1.10 -0.84 0.00 3.07 -0.98 0.24 115.11 117.37 1pra h GLN 22 Ca 0.13 -0.20 -0.01 0.00 0.09 0.00 0.00 58.65 58.65 1pra h GLN 22 Cb 0.53 -0.18 -0.04 0.00 0.08 0.00 0.00 27.48 27.88 1pra h GLN 22 CO -0.43 0.90 0.48 0.87 0.09 0.00 0.00 178.83 180.75 1pra h LYS 23 N 1.05 1.16 -0.11 0.06 6.56 -0.25 -1.62 116.57 123.41 1pra h LYS 23 Ca 0.24 -0.12 -0.14 0.00 -1.06 0.00 0.00 60.65 59.57 1pra h LYS 23 Cb 0.22 -0.23 -0.01 0.00 -0.57 0.00 0.00 32.23 31.64 1pra h LYS 23 CO -0.02 0.83 -0.54 0.28 -2.06 0.00 0.00 179.45 177.95 1pra h VAL 24 N 1.16 1.35 0.00 0.50 2.07 -0.40 -3.45 116.25 117.48 1pra h VAL 24 Ca 0.30 -1.81 0.00 0.00 0.82 0.00 0.00 66.70 66.01 1pra h VAL 24 Cb -0.00 1.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 1pra h VAL 24 CO -0.05 0.54 0.00 0.61 0.02 0.00 0.00 177.57 178.69 1pra n GLY 25 N 0.14 1.08 0.00 2.17 0.00 0.68 -4.84 105.19 104.42 1pra n GLY 25 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.29 0.00 -4.29 2.61 5.66 -0.20 -5.00 114.28 110.78 1pra n THR 26 Ca 0.00 0.00 -0.23 0.00 -3.05 0.00 0.00 64.05 60.77 1pra n THR 26 Cb 0.11 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 68.76 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 2.92 1.65 0.33 1.09 -4.23 -1.26 -4.28 115.64 111.86 1pra s THR 27 Ca 0.00 -1.50 0.09 0.00 -1.18 0.00 0.00 61.69 59.10 1pra s THR 27 Cb 0.00 -1.50 0.32 0.00 1.34 0.00 0.00 72.50 72.66 1pra s THR 27 CO 0.00 -0.06 1.78 -0.61 -0.54 0.00 0.00 174.62 175.19 1pra h GLN 28 N 4.14 0.64 -0.96 3.99 -0.00 -1.88 0.25 115.11 121.28 1pra h GLN 28 Ca -0.45 -0.04 0.17 0.00 -0.00 0.00 0.00 58.65 58.32 1pra h GLN 28 Cb 1.18 -0.14 -0.09 0.00 0.00 0.00 0.00 27.48 28.43 1pra h GLN 28 CO 0.40 0.42 0.61 0.37 0.00 0.00 0.00 178.83 180.63 1pra h GLN 29 N 0.66 0.72 -0.67 1.69 -0.00 -1.96 0.43 115.11 115.98 1pra h GLN 29 Ca 0.57 -0.04 -0.02 0.00 -0.00 0.00 0.00 58.65 59.16 1pra h GLN 29 Cb 1.04 -0.16 -0.03 0.00 0.00 0.00 0.00 27.48 28.32 1pra h GLN 29 CO -0.35 0.48 0.33 0.77 0.00 0.00 0.00 178.83 180.05 1pra h SER 30 N 0.74 0.88 0.74 -0.69 0.02 -0.91 0.32 113.55 114.65 1pra h SER 30 Ca 0.51 -0.13 -0.04 0.00 -0.84 0.00 0.00 61.79 61.30 1pra h SER 30 Cb 0.82 -0.23 0.01 0.00 0.14 0.00 0.00 62.40 63.14 1pra h SER 30 CO -0.28 0.76 -0.35 0.40 -1.14 0.00 0.00 176.83 176.21 1pra h ILE 31 N 0.94 0.00 -0.70 3.27 5.03 -0.96 0.17 117.51 125.26 1pra h ILE 31 Ca 0.23 -0.17 0.14 0.00 -0.12 0.00 0.00 64.86 64.94 1pra h ILE 31 Cb 0.11 0.00 -0.10 0.00 -3.03 0.00 0.00 36.82 33.80 1pra h ILE 31 CO -0.03 0.00 0.21 -0.08 -0.68 0.00 0.00 178.15 177.57 1pra h GLU 32 N -1.16 0.32 0.44 2.37 4.81 -1.00 0.22 114.58 120.58 1pra h GLU 32 Ca -0.10 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 1pra h GLU 32 Cb 0.76 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.05 1pra h GLU 32 CO 0.17 0.21 -0.41 0.37 -0.73 0.00 0.00 179.01 178.62 1pra h GLN 33 N 0.33 -0.83 -0.43 1.92 4.15 -0.29 0.14 115.11 120.10 1pra h GLN 33 Ca 0.38 0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.83 1pra h GLN 33 Cb 0.59 0.19 -0.02 0.00 0.21 0.00 0.00 27.48 28.46 1pra h GLN 33 CO -0.43 -0.55 0.14 1.25 -1.93 0.00 0.00 178.83 177.31 1pra h LEU 34 N -0.86 0.61 -0.01 -2.39 5.85 0.15 0.98 115.31 119.65 1pra h LEU 34 Ca -0.04 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.49 1pra h LEU 34 Cb 0.76 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 1pra h LEU 34 CO -0.05 0.65 -0.17 -0.33 -0.34 0.00 0.00 178.44 178.19 1pra h GLU 35 N 0.55 -0.21 0.00 1.25 5.08 -0.52 0.13 114.58 120.86 1pra h GLU 35 Ca 0.14 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1pra h GLU 35 Cb 0.24 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1pra h GLU 35 CO -0.01 -0.14 0.00 -1.71 -1.00 0.00 0.00 179.01 176.16 1pra n ASN 36 N -3.46 0.00 0.04 1.42 5.15 0.47 -2.03 115.26 116.84 1pra n ASN 36 Ca -0.02 -0.40 -0.20 0.00 -0.60 0.00 0.00 54.58 53.36 1pra n ASN 36 Cb 0.13 -0.15 -0.14 0.00 -0.53 0.00 0.00 39.78 39.09 1pra n ASN 36 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 1pra h GLY 37 N 3.87 0.34 -5.97 8.20 0.00 0.22 -3.49 103.07 106.25 1pra h GLY 37 Ca 0.00 -0.87 -0.37 0.00 0.00 0.00 0.00 47.33 46.09 1pra h GLY 37 CO 0.00 0.76 -0.91 0.28 0.00 0.00 0.00 176.54 176.67 1pra n LYS 38 N -3.49 -1.79 -2.67 4.80 4.01 0.33 -4.95 118.16 114.39 1pra n LYS 38 Ca -0.24 0.60 -0.40 0.00 -0.51 0.00 0.00 58.31 57.75 1pra n LYS 38 Cb 1.06 -4.73 -0.06 0.00 -0.51 0.00 0.00 35.03 30.79 1pra n LYS 38 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 1pra s THR 39 N -3.46 3.91 -0.01 -0.18 2.01 -1.26 -5.01 115.64 111.65 1pra s THR 39 Ca 0.44 1.91 -0.24 0.00 0.31 0.00 0.00 61.69 64.11 1pra s THR 39 Cb -0.12 -4.20 -0.16 0.00 0.01 0.00 0.00 72.50 68.02 1pra s THR 39 CO 0.82 0.44 1.11 0.07 -0.69 0.00 0.00 174.62 176.37 1pra h LYS 40 N 4.00 -0.38 -2.01 4.92 5.09 -1.97 -3.44 116.57 122.79 1pra h LYS 40 Ca -0.46 0.03 -0.28 0.00 0.09 0.00 0.00 60.65 60.03 1pra h LYS 40 Cb 1.20 0.09 -0.32 0.00 0.10 0.00 0.00 32.23 33.30 1pra h LYS 40 CO 0.67 -0.04 -0.60 0.50 -2.09 0.00 0.00 179.45 177.90 1pra s ARG 41 N -4.28 0.35 0.54 0.07 3.00 -1.26 -4.84 118.95 112.53 1pra s ARG 41 Ca -0.13 -0.02 -0.09 0.00 -1.00 0.00 0.00 55.73 54.48 1pra s ARG 41 Cb 0.02 -0.55 0.13 0.00 0.00 0.00 0.00 34.95 34.55 1pra s ARG 41 CO 0.51 -1.01 0.60 -0.35 0.00 0.00 0.00 175.30 175.05 1pra n PRO 42 N 5.33 -1.36 -0.01 5.12 -0.04 -1.26 -5.02 135.00 137.75 1pra n PRO 42 Ca -0.01 -0.94 -0.16 0.00 -0.04 0.00 0.00 63.50 62.35 1pra n PRO 42 Cb 0.47 -0.74 -0.14 0.00 -0.04 0.00 0.00 33.50 33.05 1pra n PRO 42 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1pra n ARG 43 N -2.77 0.71 -0.62 0.54 3.00 -1.26 -4.14 116.66 112.12 1pra n ARG 43 Ca 0.08 0.26 0.07 0.00 -0.00 0.00 0.00 57.85 58.26 1pra n ARG 43 Cb 0.29 -1.73 0.32 0.00 0.00 0.00 0.00 32.46 31.34 1pra n ARG 43 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.63 179.60 1pra n PHE 44 N -3.29 1.47 -0.12 -0.14 -1.74 -1.26 -4.46 117.46 107.92 1pra n PHE 44 Ca -0.27 -0.54 -0.05 0.00 -0.56 0.00 0.00 57.45 56.02 1pra n PHE 44 Cb 1.05 -0.32 0.01 0.00 1.52 0.00 0.00 39.48 41.75 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 3.38 -0.62 -1.06 5.98 5.85 -1.97 0.81 115.31 127.68 1pra h LEU 45 Ca 0.00 0.15 -0.07 0.00 0.84 0.00 0.00 57.88 58.80 1pra h LEU 45 Cb 1.47 0.34 -0.02 0.00 0.37 0.00 0.00 40.66 42.82 1pra h LEU 45 CO 0.29 -0.21 -0.11 1.55 -0.34 0.00 0.00 178.44 179.62 1pra h PRO 46 N -0.10 0.55 0.09 5.25 0.13 -1.91 0.83 132.00 136.83 1pra h PRO 46 Ca 0.20 -0.16 -0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1pra h PRO 46 Cb 0.41 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.48 1pra h PRO 46 CO -0.47 0.65 -0.04 0.93 -0.23 0.00 0.00 178.00 178.84 1pra h GLU 47 N 0.51 -0.11 -0.55 0.86 4.39 -1.57 0.19 114.58 118.30 1pra h GLU 47 Ca 0.09 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.76 1pra h GLU 47 Cb 0.49 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.14 1pra h GLU 47 CO 0.03 0.13 0.18 1.25 -1.16 0.00 0.00 179.01 179.44 1pra h LEU 48 N -0.35 0.79 -0.53 1.33 6.46 -0.81 0.10 115.31 122.30 1pra h LEU 48 Ca -0.01 -0.20 0.07 0.00 -0.12 0.00 0.00 57.88 57.62 1pra h LEU 48 Cb 0.29 -0.21 -0.06 0.00 -0.73 0.00 0.00 40.66 39.96 1pra h LEU 48 CO 0.02 0.77 0.20 0.00 -0.62 0.00 0.00 178.44 178.82 1pra h ALA 49 N 1.04 0.67 0.25 1.25 0.00 -0.55 0.27 119.26 122.18 1pra h ALA 49 Ca 0.18 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1pra h ALA 49 Cb 0.26 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1pra h ALA 49 CO -0.01 -0.19 -0.12 0.77 0.00 0.00 0.00 179.25 179.70 1pra h SER 50 N 0.39 -0.29 -0.64 0.00 0.02 -0.35 0.54 113.55 113.21 1pra h SER 50 Ca 0.26 -0.13 0.12 0.00 -0.84 0.00 0.00 61.79 61.20 1pra h SER 50 Cb 0.27 0.07 -0.09 0.00 0.14 0.00 0.00 62.40 62.80 1pra h SER 50 CO -0.25 -0.04 0.17 0.00 -1.14 0.00 0.00 176.83 175.57 1pra h ALA 51 N 0.15 0.80 0.02 3.77 0.00 -0.47 -2.12 119.26 121.41 1pra h ALA 51 Ca -0.03 0.13 -0.26 0.00 0.00 0.00 0.00 54.91 54.74 1pra h ALA 51 Cb 0.40 0.16 0.02 0.00 0.00 0.00 0.00 17.79 18.36 1pra h ALA 51 CO 0.06 -0.28 -1.05 -0.07 0.00 0.00 0.00 179.25 177.91 1pra h LEU 52 N 0.31 0.77 -0.19 0.00 -0.00 -0.93 -3.49 115.31 111.77 1pra h LEU 52 Ca 0.34 -0.64 0.00 0.00 -0.00 0.00 0.00 57.88 57.59 1pra h LEU 52 Cb 0.51 -0.24 0.00 0.00 -0.00 0.00 0.00 40.66 40.94 1pra h LEU 52 CO -0.41 1.44 0.00 0.61 -0.00 0.00 0.00 178.44 180.08 1pra n GLY 53 N 1.10 1.13 3.83 0.83 0.00 0.17 -5.09 105.19 107.17 1pra n GLY 53 Ca -0.10 -0.38 -0.22 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.19 2.73 0.16 1.61 -7.23 -0.17 -5.00 120.40 110.31 1pra s VAL 54 Ca 0.00 -1.45 -0.09 0.00 -1.81 0.00 0.00 61.98 58.63 1pra s VAL 54 Cb 0.00 -3.02 -0.06 0.00 0.56 0.00 0.00 36.38 33.86 1pra s VAL 54 CO 0.00 -0.04 0.48 -0.94 -0.31 0.00 0.00 175.10 174.29 1pra s SER 55 N -4.04 6.63 0.19 4.85 1.04 -1.26 -4.45 113.70 116.67 1pra s SER 55 Ca 0.45 0.84 -0.11 0.00 0.48 0.00 0.00 55.95 57.61 1pra s SER 55 Cb -0.02 -2.20 0.16 0.00 0.10 0.00 0.00 66.02 64.06 1pra s SER 55 CO 0.26 0.04 1.82 0.58 0.98 0.00 0.00 173.24 176.93 1pra h VAL 56 N 2.35 1.05 -0.99 5.02 2.07 -1.95 0.42 116.25 124.22 1pra h VAL 56 Ca -0.47 -0.24 0.30 0.00 0.82 0.00 0.00 66.70 67.10 1pra h VAL 56 Cb 1.18 0.28 -0.14 0.00 -1.52 0.00 0.00 31.29 31.08 1pra h VAL 56 CO 0.69 0.13 0.55 -2.24 0.02 0.00 0.00 177.57 176.72 1pra h ASP 57 N 0.71 0.52 0.01 0.57 2.03 -1.98 0.28 116.42 118.56 1pra h ASP 57 Ca 0.25 0.18 -0.21 0.00 -0.73 0.00 0.00 57.03 56.52 1pra h ASP 57 Cb 0.05 0.12 0.02 0.00 -0.83 0.00 0.00 39.33 38.69 1pra h ASP 57 CO -0.12 -0.08 -0.83 -0.25 -1.03 0.00 0.00 179.24 176.94 1pra h TRP 58 N 0.38 0.82 -0.05 4.15 7.01 -1.39 0.25 115.95 127.12 1pra h TRP 58 Ca 0.70 -0.45 0.01 0.00 2.11 0.00 0.00 58.89 61.26 1pra h TRP 58 Cb 1.52 -0.09 -0.00 0.00 -2.10 0.00 0.00 29.16 28.49 1pra h TRP 58 CO -0.03 1.28 0.12 -0.07 -2.79 0.00 0.00 178.44 176.96 1pra h LEU 59 N 0.12 0.00 0.04 0.65 3.38 0.79 0.71 115.31 121.00 1pra h LEU 59 Ca -0.11 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.55 1pra h LEU 59 Cb 1.52 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.23 1pra h LEU 59 CO 0.16 0.00 -1.74 0.18 0.09 0.00 0.00 178.44 177.14 1pra n LEU 60 N -3.31 2.18 0.00 1.67 4.77 0.76 -4.77 117.00 118.30 1pra n LEU 60 Ca -0.02 0.31 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 1pra n LEU 60 Cb 0.20 -0.99 0.00 0.00 -2.33 0.00 0.00 43.42 40.30 1pra n LEU 60 CO 0.21 0.53 0.00 0.59 -1.33 0.00 0.00 177.39 177.40 1pra n ASN 61 N -4.05 0.00 -1.72 -1.43 3.02 0.87 -5.06 115.26 106.89 1pra n ASN 61 Ca -0.36 0.47 -0.01 0.00 -0.03 0.00 0.00 54.58 54.65 1pra n ASN 61 Cb 0.84 -0.49 0.00 0.00 -0.61 0.00 0.00 39.78 39.52 1pra n ASN 61 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pra n GLY 62 N 2.00 -0.77 1.21 7.41 0.00 0.24 -4.91 105.19 110.38 1pra n GLY 62 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1pra n GLY 62 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1pra n THR 63 N -0.52 -5.83 -3.15 2.61 -1.04 -1.26 -4.82 114.28 100.27 1pra n THR 63 Ca 0.02 1.10 0.05 0.00 -2.04 0.00 0.00 64.05 63.18 1pra n THR 63 Cb 0.10 -3.57 -0.00 0.00 -1.82 0.00 0.00 70.33 65.04 1pra n THR 63 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1pra s SER 64 N -0.18 -1.11 0.07 8.00 0.15 -1.26 -5.11 113.70 114.26 1pra s SER 64 Ca 0.00 0.32 -0.27 0.00 0.70 0.00 0.00 55.95 56.70 1pra s SER 64 Cb 0.00 1.78 0.08 0.00 -1.71 0.00 0.00 66.02 66.18 1pra s SER 64 CO 0.00 -0.21 0.97 1.51 1.20 0.00 0.00 173.24 176.71 1pra s ASP 65 N 2.89 -0.23 -0.82 5.45 -4.77 -1.26 -5.07 116.67 112.86 1pra s ASP 65 Ca 0.15 -0.22 -0.01 0.00 -3.30 0.00 0.00 52.55 49.17 1pra s ASP 65 Cb -0.09 0.42 0.00 0.00 -1.09 0.00 0.00 42.92 42.15 1pra s ASP 65 CO -0.22 -0.73 0.62 -1.54 0.70 0.00 0.00 175.17 174.00 1pra n SER 66 N -0.38 -5.40 -3.94 2.11 3.41 -1.26 -4.97 113.62 103.19 1pra n SER 66 Ca -0.07 -0.81 -0.30 0.00 -0.26 0.00 0.00 58.87 57.43 1pra n SER 66 Cb 0.61 -2.37 -0.14 0.00 -0.26 0.00 0.00 64.21 62.04 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 -3.00 4.37 0.02 4.04 2.47 -1.26 -5.07 114.94 116.50 1pra s ASN 67 Ca 0.01 -2.70 0.02 0.00 0.42 0.00 0.00 52.86 50.61 1pra s ASN 67 Cb -0.01 -1.56 -0.01 0.00 -1.45 0.00 0.00 41.25 38.22 1pra s ASN 67 CO 0.87 -0.28 -0.07 -0.69 -3.72 0.00 0.00 177.10 173.21 1pra s VAL 68 N 0.15 0.47 -2.00 -5.21 1.01 -1.26 -5.30 120.40 108.26 1pra s VAL 68 Ca 0.15 -0.69 0.27 0.00 0.00 0.00 0.00 61.98 61.71 1pra s VAL 68 Cb -0.24 -0.48 0.76 0.00 0.00 0.00 0.00 36.38 36.42 1pra s VAL 68 CO -0.03 -0.16 1.95 -1.14 0.00 0.00 0.00 175.10 175.72