#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 0.16 -0.95 0.44 2.10 -1.94 -1.08 117.51 116.24 1pra h ILE 2 Ca 0.00 0.00 0.04 0.00 1.08 0.00 0.00 64.86 65.98 1pra h ILE 2 Cb 0.00 0.16 -0.06 0.00 -1.09 0.00 0.00 36.82 35.83 1pra h ILE 2 CO 0.00 0.00 0.62 0.77 -1.08 0.00 0.00 178.15 178.46 1pra h SER 3 N -0.60 1.02 -0.89 2.19 4.64 -1.88 0.20 113.55 118.23 1pra h SER 3 Ca 0.04 -0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.45 1pra h SER 3 Cb 0.66 -0.23 -0.07 0.00 -0.31 0.00 0.00 62.40 62.45 1pra h SER 3 CO -0.29 0.69 0.53 -1.28 -0.87 0.00 0.00 176.83 175.61 1pra h SER 4 N 1.18 0.78 0.43 4.97 0.87 -1.76 0.37 113.55 120.38 1pra h SER 4 Ca 0.39 0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.97 1pra h SER 4 Cb 0.04 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 61.89 1pra h SER 4 CO -0.13 0.44 -0.21 0.03 -0.53 0.00 0.00 176.83 176.43 1pra h ARG 5 N 0.88 -0.55 0.13 2.24 3.08 0.28 0.25 114.38 120.70 1pra h ARG 5 Ca 0.42 0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.53 1pra h ARG 5 Cb 0.37 0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.51 1pra h ARG 5 CO -0.24 -0.25 -0.25 0.28 -1.07 0.00 0.00 179.97 178.44 1pra h VAL 6 N -0.87 0.45 -0.02 2.04 2.07 -1.11 -0.72 116.25 118.09 1pra h VAL 6 Ca -0.06 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 1pra h VAL 6 Cb 0.56 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 30.78 1pra h VAL 6 CO 0.10 0.00 0.01 0.50 0.02 0.00 0.00 177.57 178.19 1pra h LYS 7 N -0.46 0.03 -0.61 1.57 3.64 -0.33 1.00 116.57 121.41 1pra h LYS 7 Ca 0.02 -0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.52 1pra h LYS 7 Cb 0.48 -0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 32.18 1pra h LYS 7 CO -0.13 0.17 -0.14 1.03 -2.27 0.00 0.00 179.45 178.12 1pra h SER 8 N -0.13 -0.53 -0.42 4.20 0.87 -0.34 0.15 113.55 117.34 1pra h SER 8 Ca 0.01 0.18 -0.10 0.00 -1.23 0.00 0.00 61.79 60.64 1pra h SER 8 Cb 0.16 0.37 -0.01 0.00 -0.44 0.00 0.00 62.40 62.47 1pra h SER 8 CO -0.00 -0.19 -0.13 0.50 -0.53 0.00 0.00 176.83 176.47 1pra h LYS 9 N 0.01 0.84 -0.70 2.24 1.63 -0.84 -0.69 116.57 119.06 1pra h LYS 9 Ca 0.29 -0.34 0.15 0.00 -0.85 0.00 0.00 60.65 59.91 1pra h LYS 9 Cb 0.45 -0.04 -0.12 0.00 -0.60 0.00 0.00 32.23 31.92 1pra h LYS 9 CO -0.61 0.97 0.00 -0.09 -3.45 0.00 0.00 179.45 176.27 1pra h ARG 10 N 0.66 0.11 0.66 1.90 9.65 0.52 0.19 114.38 128.07 1pra h ARG 10 Ca 0.10 -0.01 -0.03 0.00 -1.10 0.00 0.00 59.98 58.94 1pra h ARG 10 Cb 0.68 -0.02 0.01 0.00 -1.39 0.00 0.00 29.97 29.24 1pra h ARG 10 CO 0.05 0.07 -0.32 0.82 2.80 0.00 0.00 179.97 183.39 1pra h ILE 11 N 0.11 0.32 -0.49 1.20 5.03 -0.32 0.31 117.51 123.68 1pra h ILE 11 Ca 0.38 -0.10 0.06 0.00 -0.12 0.00 0.00 64.86 65.08 1pra h ILE 11 Cb 0.64 0.36 -0.03 0.00 -3.03 0.00 0.00 36.82 34.76 1pra h ILE 11 CO -0.61 0.01 0.33 -0.61 -0.68 0.00 0.00 178.15 176.59 1pra h GLN 12 N -0.95 0.41 -0.05 2.37 4.15 -0.35 0.15 115.11 120.84 1pra h GLN 12 Ca -0.09 -0.02 -0.18 0.00 0.77 0.00 0.00 58.65 59.13 1pra h GLN 12 Cb 0.70 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.29 1pra h GLN 12 CO 0.15 0.27 -0.73 -0.07 -1.93 0.00 0.00 178.83 176.52 1pra h LEU 13 N 0.42 0.34 -0.60 -2.39 -0.00 -0.55 -3.48 115.31 109.05 1pra h LEU 13 Ca 0.21 -0.23 -0.01 0.00 -0.00 0.00 0.00 57.88 57.85 1pra h LEU 13 Cb 0.30 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 40.86 1pra h LEU 13 CO -0.05 0.96 -0.02 0.61 -0.00 0.00 0.00 178.44 179.94 1pra n GLY 14 N 0.56 0.71 3.73 0.83 0.00 0.95 -5.07 105.19 106.90 1pra n GLY 14 Ca -0.03 -0.73 -0.27 0.00 0.00 0.00 0.00 46.02 44.98 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 -0.81 2.88 0.35 0.99 1.43 -0.42 -5.02 118.68 118.08 1pra s LEU 15 Ca 0.01 -1.26 0.09 0.00 -1.03 0.00 0.00 54.13 51.94 1pra s LEU 15 Cb -0.00 -1.17 -0.05 0.00 0.03 0.00 0.00 46.19 44.99 1pra s LEU 15 CO 0.01 -0.63 0.06 0.54 0.23 0.00 0.00 176.35 176.56 1pra s ASN 16 N -3.89 4.33 0.44 2.29 4.22 -1.26 -4.50 114.94 116.56 1pra s ASN 16 Ca 0.33 -0.95 0.22 0.00 -2.14 0.00 0.00 52.86 50.32 1pra s ASN 16 Cb 0.04 -0.58 1.20 0.00 1.28 0.00 0.00 41.25 43.19 1pra s ASN 16 CO 0.18 -0.29 1.83 1.56 -2.04 0.00 0.00 177.10 178.35 1pra h GLN 17 N 1.70 0.29 0.43 3.55 4.20 -1.97 -0.17 115.11 123.15 1pra h GLN 17 Ca -0.43 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.24 1pra h GLN 17 Cb 1.25 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1pra h GLN 17 CO 0.66 0.19 -0.21 0.00 -0.67 0.00 0.00 178.83 178.81 1pra h ALA 18 N 1.59 -0.58 -0.76 3.87 0.00 -1.95 0.39 119.26 121.82 1pra h ALA 18 Ca 0.50 -0.19 0.13 0.00 0.00 0.00 0.00 54.91 55.36 1pra h ALA 18 Cb 1.45 0.22 -0.09 0.00 0.00 0.00 0.00 17.79 19.37 1pra h ALA 18 CO -0.17 -0.68 0.34 0.93 0.00 0.00 0.00 179.25 179.66 1pra h GLU 19 N -0.86 0.50 -0.63 0.00 4.39 -1.86 0.36 114.58 116.48 1pra h GLU 19 Ca -0.06 -0.03 -0.09 0.00 0.34 0.00 0.00 59.36 59.52 1pra h GLU 19 Cb 0.56 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 1pra h GLU 19 CO 0.10 0.33 0.06 1.25 -1.16 0.00 0.00 179.01 179.58 1pra h LEU 20 N 0.51 1.03 -0.20 1.33 5.85 -0.91 -1.08 115.31 121.85 1pra h LEU 20 Ca 0.40 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 1pra h LEU 20 Cb 0.56 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1pra h LEU 20 CO -0.36 1.06 0.12 0.00 -0.34 0.00 0.00 178.44 178.92 1pra h ALA 21 N 1.01 0.25 -0.46 1.25 0.00 0.13 0.29 119.26 121.73 1pra h ALA 21 Ca 0.18 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1pra h ALA 21 Cb 0.50 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1pra h ALA 21 CO 0.02 -0.24 0.24 -0.56 0.00 0.00 0.00 179.25 178.71 1pra h GLN 22 N 0.24 0.65 0.00 0.00 3.07 -0.89 0.25 115.11 118.44 1pra h GLN 22 Ca 0.07 -0.09 -0.09 0.00 0.09 0.00 0.00 58.65 58.64 1pra h GLN 22 Cb 0.02 -0.12 -0.01 0.00 0.08 0.00 0.00 27.48 27.44 1pra h GLN 22 CO -0.01 0.54 -0.41 1.57 0.09 0.00 0.00 178.83 180.60 1pra h LYS 23 N 0.61 0.00 0.00 0.06 2.10 -0.92 -1.14 116.57 117.28 1pra h LYS 23 Ca 0.16 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.70 1pra h LYS 23 Cb 0.08 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.40 1pra h LYS 23 CO -0.02 0.41 -0.53 0.28 -2.00 0.00 0.00 179.45 177.59 1pra h VAL 24 N 0.00 1.36 -0.63 0.07 2.07 -0.12 -3.46 116.25 115.54 1pra h VAL 24 Ca -0.00 -1.82 0.00 0.00 0.82 0.00 0.00 66.70 65.69 1pra h VAL 24 Cb 0.87 1.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.63 1pra h VAL 24 CO 0.05 0.52 0.00 0.61 0.02 0.00 0.00 177.57 178.77 1pra n GLY 25 N 0.02 0.94 0.00 2.17 0.00 0.72 -4.82 105.19 104.22 1pra n GLY 25 Ca -0.01 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.10 0.00 -4.31 2.61 5.66 -0.17 -5.03 114.28 110.94 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 0.38 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.02 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 1.51 1.04 0.33 1.09 -4.23 -1.26 -4.31 115.64 109.81 1pra s THR 27 Ca 0.00 -0.99 0.11 0.00 -1.18 0.00 0.00 61.69 59.63 1pra s THR 27 Cb 0.00 -0.95 0.33 0.00 1.34 0.00 0.00 72.50 73.21 1pra s THR 27 CO 0.00 -0.03 1.65 -0.61 -0.54 0.00 0.00 174.62 175.09 1pra h GLN 28 N 4.91 0.27 -0.56 3.99 4.15 -1.88 0.20 115.11 126.19 1pra h GLN 28 Ca -0.38 -0.02 0.10 0.00 0.77 0.00 0.00 58.65 59.13 1pra h GLN 28 Cb 1.18 -0.06 -0.11 0.00 0.21 0.00 0.00 27.48 28.70 1pra h GLN 28 CO 0.44 0.18 -0.33 -0.56 -1.93 0.00 0.00 178.83 176.63 1pra h GLN 29 N 0.28 -0.16 -0.89 1.69 3.07 -1.96 0.13 115.11 117.27 1pra h GLN 29 Ca 0.68 0.01 -0.02 0.00 0.09 0.00 0.00 58.65 59.41 1pra h GLN 29 Cb 1.52 0.04 -0.04 0.00 0.08 0.00 0.00 27.48 29.08 1pra h GLN 29 CO -0.63 -0.11 0.47 0.77 0.09 0.00 0.00 178.83 179.41 1pra h SER 30 N -0.17 1.13 -0.45 0.06 0.02 -1.01 0.29 113.55 113.42 1pra h SER 30 Ca 0.22 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.05 1pra h SER 30 Cb 0.54 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 1pra h SER 30 CO -0.65 0.92 0.22 0.40 -1.14 0.00 0.00 176.83 176.57 1pra h ILE 31 N 1.25 1.18 0.41 3.27 1.08 -1.23 -0.52 117.51 122.95 1pra h ILE 31 Ca 0.31 -0.49 -0.02 0.00 -0.39 0.00 0.00 64.86 64.27 1pra h ILE 31 Cb 0.06 0.68 0.00 0.00 -3.07 0.00 0.00 36.82 34.49 1pra h ILE 31 CO -0.05 0.19 -0.20 -0.08 -0.69 0.00 0.00 178.15 177.33 1pra h GLU 32 N 0.58 -0.53 -0.87 2.37 4.81 0.61 0.25 114.58 121.80 1pra h GLU 32 Ca 0.15 0.04 0.20 0.00 -0.13 0.00 0.00 59.36 59.62 1pra h GLU 32 Cb 0.10 0.12 -0.12 0.00 0.63 0.00 0.00 28.75 29.48 1pra h GLU 32 CO -0.02 -0.25 0.37 1.96 -0.73 0.00 0.00 179.01 180.34 1pra h GLN 33 N -0.77 0.39 -0.32 1.92 1.08 -0.49 0.21 115.11 117.13 1pra h GLN 33 Ca -0.06 -0.02 -0.10 0.00 -1.45 0.00 0.00 58.65 57.02 1pra h GLN 33 Cb 0.53 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.86 1pra h GLN 33 CO 0.09 0.26 -0.19 1.25 -0.95 0.00 0.00 178.83 179.30 1pra h LEU 34 N 0.41 0.71 -0.92 1.46 5.85 -0.87 -2.86 115.31 119.09 1pra h LEU 34 Ca 0.53 -0.42 0.16 0.00 0.84 0.00 0.00 57.88 58.99 1pra h LEU 34 Cb 0.96 -0.20 -0.10 0.00 0.37 0.00 0.00 40.66 41.70 1pra h LEU 34 CO -0.51 0.98 0.51 -0.33 -0.34 0.00 0.00 178.44 178.75 1pra h GLU 35 N 0.45 0.67 0.00 1.25 5.08 0.15 0.19 114.58 122.37 1pra h GLU 35 Ca 0.07 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1pra h GLU 35 Cb 0.73 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1pra h GLU 35 CO 0.05 0.45 0.00 0.09 -1.00 0.00 0.00 179.01 178.60 1pra n ASN 36 N -4.82 0.00 -2.51 1.42 5.03 0.51 -4.27 115.26 110.62 1pra n ASN 36 Ca 0.20 -0.33 -0.12 0.00 0.87 0.00 0.00 54.58 55.20 1pra n ASN 36 Cb 0.49 -0.12 0.06 0.00 -1.02 0.00 0.00 39.78 39.18 1pra n ASN 36 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1pra n GLY 37 N 0.17 -0.05 0.19 7.41 0.00 0.65 -4.94 105.19 108.62 1pra n GLY 37 Ca 0.12 -0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.16 1pra n GLY 37 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1pra n LYS 38 N -3.07 0.66 -4.04 1.61 5.02 -1.13 -4.88 118.16 112.32 1pra n LYS 38 Ca -0.13 -0.38 -0.09 0.00 -2.02 0.00 0.00 58.31 55.69 1pra n LYS 38 Cb 0.59 -1.49 -0.09 0.00 -0.02 0.00 0.00 35.03 34.02 1pra n LYS 38 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1pra s THR 39 N -2.60 0.14 -0.11 -0.18 -1.32 -1.26 -5.06 115.64 105.24 1pra s THR 39 Ca 0.22 -1.65 -0.00 0.00 -1.21 0.00 0.00 61.69 59.05 1pra s THR 39 Cb 0.19 -1.71 -0.25 0.00 -1.51 0.00 0.00 72.50 69.22 1pra s THR 39 CO 0.55 -0.64 0.38 2.29 -2.21 0.00 0.00 174.62 174.99 1pra n LYS 40 N -0.05 0.72 -3.39 7.08 0.00 -1.26 -4.86 118.16 116.41 1pra n LYS 40 Ca -0.10 0.25 -0.18 0.00 -0.00 0.00 0.00 58.31 58.28 1pra n LYS 40 Cb 0.62 -1.71 -0.09 0.00 -0.00 0.00 0.00 35.03 33.86 1pra n LYS 40 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 1pra s ARG 41 N -2.56 0.48 0.97 -1.58 3.00 -1.26 -4.94 118.95 113.06 1pra s ARG 41 Ca -0.19 -0.56 -0.12 0.00 -1.00 0.00 0.00 55.73 53.86 1pra s ARG 41 Cb 0.07 -0.73 0.17 0.00 0.00 0.00 0.00 34.95 34.46 1pra s ARG 41 CO 0.77 -1.12 1.11 -1.25 0.00 0.00 0.00 175.30 174.81 1pra s PRO 42 N 1.84 0.68 0.21 5.12 0.04 -1.26 -4.96 135.00 136.66 1pra s PRO 42 Ca 0.13 0.46 -0.04 0.00 0.04 0.00 0.00 61.00 61.59 1pra s PRO 42 Cb -0.15 -1.77 0.17 0.00 0.04 0.00 0.00 34.50 32.79 1pra s PRO 42 CO -0.17 -2.55 1.59 0.00 0.04 0.00 0.00 177.00 175.92 1pra h ARG 43 N -1.76 0.72 -0.88 4.56 -0.00 -2.03 -2.99 114.38 111.99 1pra h ARG 43 Ca -0.53 -0.33 -0.16 0.00 -0.50 0.00 0.00 59.98 58.46 1pra h ARG 43 Cb 1.33 -0.01 -0.10 0.00 0.00 0.00 0.00 29.97 31.19 1pra h ARG 43 CO 0.59 0.93 0.21 1.97 0.00 0.00 0.00 179.97 183.67 1pra n PHE 44 N -4.07 1.54 -0.01 3.04 -1.74 -1.26 -4.41 117.46 110.54 1pra n PHE 44 Ca -0.01 -0.89 -0.09 0.00 -0.56 0.00 0.00 57.45 55.90 1pra n PHE 44 Cb 0.48 -0.51 -0.04 0.00 1.52 0.00 0.00 39.48 40.93 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 1.65 -0.16 -0.49 5.98 7.12 -1.90 0.18 115.31 127.69 1pra h LEU 45 Ca 0.20 0.05 -0.08 0.00 0.13 0.00 0.00 57.88 58.17 1pra h LEU 45 Cb 1.76 0.10 -0.02 0.00 -0.53 0.00 0.00 40.66 41.98 1pra h LEU 45 CO 0.48 -0.06 -0.02 1.55 -0.13 0.00 0.00 178.44 180.26 1pra h PRO 46 N -0.02 0.88 -0.50 5.25 0.13 -1.87 -0.46 132.00 135.41 1pra h PRO 46 Ca 0.07 -0.29 0.04 0.00 -0.87 0.00 0.00 66.00 64.95 1pra h PRO 46 Cb 0.13 -0.07 -0.04 0.00 0.13 0.00 0.00 31.00 31.14 1pra h PRO 46 CO -0.15 0.93 0.26 0.93 -0.23 0.00 0.00 178.00 179.74 1pra h GLU 47 N 0.74 0.50 -0.44 0.86 5.08 -1.80 0.85 114.58 120.36 1pra h GLU 47 Ca 0.14 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.41 1pra h GLU 47 Cb 0.55 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1pra h GLU 47 CO 0.03 0.33 0.07 1.25 -1.00 0.00 0.00 179.01 179.69 1pra h LEU 48 N 0.52 0.70 0.29 1.33 5.85 -0.51 0.29 115.31 123.78 1pra h LEU 48 Ca 0.22 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 1pra h LEU 48 Cb 0.11 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 1pra h LEU 48 CO -0.14 0.79 -0.25 0.00 -0.34 0.00 0.00 178.44 178.50 1pra h ALA 49 N 0.95 -0.54 -0.77 1.25 0.00 -0.41 -1.65 119.26 118.10 1pra h ALA 49 Ca 0.13 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1pra h ALA 49 Cb 0.38 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 1pra h ALA 49 CO 0.01 -0.83 0.50 0.77 0.00 0.00 0.00 179.25 179.70 1pra h SER 50 N -0.55 0.84 -0.65 0.00 0.02 -0.82 0.31 113.55 112.70 1pra h SER 50 Ca -0.02 -0.01 0.12 0.00 -0.84 0.00 0.00 61.79 61.04 1pra h SER 50 Cb 0.49 -0.20 -0.09 0.00 0.14 0.00 0.00 62.40 62.75 1pra h SER 50 CO -0.03 0.59 0.19 0.00 -1.14 0.00 0.00 176.83 176.45 1pra h ALA 51 N 1.30 0.83 0.14 3.77 0.00 0.06 -1.72 119.26 123.64 1pra h ALA 51 Ca 0.30 0.12 -0.28 0.00 0.00 0.00 0.00 54.91 55.04 1pra h ALA 51 Cb -0.05 0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1pra h ALA 51 CO -0.09 -0.26 -1.30 -0.07 0.00 0.00 0.00 179.25 177.53 1pra h LEU 52 N 0.34 0.46 0.00 0.00 -0.00 -1.07 -3.49 115.31 111.54 1pra h LEU 52 Ca 0.34 -0.51 0.00 0.00 -0.00 0.00 0.00 57.88 57.72 1pra h LEU 52 Cb 0.50 -0.15 0.00 0.00 -0.00 0.00 0.00 40.66 41.01 1pra h LEU 52 CO -0.39 1.40 0.00 0.61 -0.00 0.00 0.00 178.44 180.06 1pra n GLY 53 N 1.57 0.96 3.39 0.83 0.00 0.87 -5.11 105.19 107.69 1pra n GLY 53 Ca -0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.92 1.16 0.39 1.61 -7.23 0.16 -4.98 120.40 109.59 1pra s VAL 54 Ca 0.00 -2.03 -0.15 0.00 -1.81 0.00 0.00 61.98 57.99 1pra s VAL 54 Cb 0.00 -2.55 -0.08 0.00 0.56 0.00 0.00 36.38 34.30 1pra s VAL 54 CO 0.00 -0.17 0.81 -0.94 -0.31 0.00 0.00 175.10 174.49 1pra s SER 55 N -3.40 6.71 0.23 4.85 1.04 -1.26 -3.66 113.70 118.21 1pra s SER 55 Ca 0.32 1.35 -0.07 0.00 0.48 0.00 0.00 55.95 58.03 1pra s SER 55 Cb 0.07 -2.40 0.36 0.00 0.10 0.00 0.00 66.02 64.14 1pra s SER 55 CO 0.12 -0.34 1.74 0.58 0.98 0.00 0.00 173.24 176.33 1pra h VAL 56 N 1.57 0.74 -0.82 5.02 2.07 -1.92 -0.29 116.25 122.62 1pra h VAL 56 Ca -0.48 -0.16 0.20 0.00 0.82 0.00 0.00 66.70 67.09 1pra h VAL 56 Cb 1.18 0.24 -0.14 0.00 -1.52 0.00 0.00 31.29 31.05 1pra h VAL 56 CO 0.64 0.08 0.05 -0.78 0.02 0.00 0.00 177.57 177.58 1pra h ASP 57 N 0.45 -0.31 -0.12 0.57 3.58 -1.99 0.66 116.42 119.26 1pra h ASP 57 Ca 0.36 0.21 -0.12 0.00 0.42 0.00 0.00 57.03 57.90 1pra h ASP 57 Cb 0.47 0.36 0.00 0.00 1.72 0.00 0.00 39.33 41.89 1pra h ASP 57 CO -0.34 -0.20 -0.38 -0.25 -2.88 0.00 0.00 179.24 175.18 1pra h TRP 58 N 0.11 0.62 -0.78 0.28 7.01 -1.48 0.24 115.95 121.94 1pra h TRP 58 Ca 0.47 -0.25 0.12 0.00 2.11 0.00 0.00 58.89 61.34 1pra h TRP 58 Cb 0.88 -0.10 -0.09 0.00 -2.10 0.00 0.00 29.16 27.75 1pra h TRP 58 CO -0.41 1.00 0.38 -0.07 -2.79 0.00 0.00 178.44 176.54 1pra h LEU 59 N 0.07 0.46 -0.03 0.65 3.38 -0.10 0.89 115.31 120.63 1pra h LEU 59 Ca -0.01 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1pra h LEU 59 Cb 1.01 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 1pra h LEU 59 CO 0.08 0.22 -0.02 -0.07 0.09 0.00 0.00 178.44 178.74 1pra h LEU 60 N 0.59 0.07 0.00 1.67 3.38 -0.79 -3.40 115.31 116.83 1pra h LEU 60 Ca 0.41 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1pra h LEU 60 Cb 0.53 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1pra h LEU 60 CO -0.33 0.50 0.00 0.59 0.09 0.00 0.00 178.44 179.29 1pra n ASN 61 N -4.82 0.00 0.00 -0.43 3.02 0.83 -5.02 115.26 108.84 1pra n ASN 61 Ca -0.08 0.41 0.00 0.00 -0.03 0.00 0.00 54.58 54.88 1pra n ASN 61 Cb 0.25 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 39.01 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 2.09 0.90 3.07 7.41 0.00 0.31 -5.02 105.19 113.95 1pra n GLY 62 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.62 0.21 2.61 -4.23 -1.26 -5.03 115.64 105.32 1pra s THR 63 Ca 0.00 0.05 -0.06 0.00 -1.18 0.00 0.00 61.69 60.49 1pra s THR 63 Cb 0.00 -0.74 -0.02 0.00 1.34 0.00 0.00 72.50 73.08 1pra s THR 63 CO 0.00 -0.03 0.27 -0.55 -0.54 0.00 0.00 174.62 173.77 1pra s SER 64 N 2.58 0.06 0.77 3.99 0.15 -1.26 -4.93 113.70 115.05 1pra s SER 64 Ca 0.06 -1.14 -0.11 0.00 0.70 0.00 0.00 55.95 55.46 1pra s SER 64 Cb -0.14 0.46 0.05 0.00 -1.71 0.00 0.00 66.02 64.68 1pra s SER 64 CO -0.14 -0.95 1.08 1.51 1.20 0.00 0.00 173.24 175.94 1pra s ASP 65 N -3.08 4.67 -0.65 5.45 1.47 -1.26 -5.03 116.67 118.25 1pra s ASP 65 Ca 0.29 1.48 -0.07 0.00 1.18 0.00 0.00 52.55 55.43 1pra s ASP 65 Cb 0.04 -2.25 0.17 0.00 -0.34 0.00 0.00 42.92 40.54 1pra s ASP 65 CO 0.09 -1.88 0.51 -0.44 0.68 0.00 0.00 175.17 174.13 1pra s SER 66 N -3.77 5.77 -0.44 2.11 0.01 -1.26 -5.00 113.70 111.12 1pra s SER 66 Ca 0.60 -2.61 0.03 0.00 1.31 0.00 0.00 55.95 55.28 1pra s SER 66 Cb -0.15 -1.99 0.13 0.00 0.21 0.00 0.00 66.02 64.22 1pra s SER 66 CO 0.55 -0.50 0.21 0.20 0.41 0.00 0.00 173.24 174.11 1pra s ASN 67 N 1.53 4.06 0.14 2.44 -0.87 -1.26 -5.08 114.94 115.89 1pra s ASN 67 Ca 0.15 -2.59 -0.13 0.00 -1.57 0.00 0.00 52.86 48.72 1pra s ASN 67 Cb -0.19 -1.30 0.01 0.00 -0.02 0.00 0.00 41.25 39.76 1pra s ASN 67 CO -0.04 -0.28 0.34 0.54 -2.57 0.00 0.00 177.10 175.08 1pra s VAL 68 N 0.34 0.08 0.00 1.60 0.11 -1.26 -5.24 120.40 116.02 1pra s VAL 68 Ca 0.16 -0.96 0.00 0.00 -2.93 0.00 0.00 61.98 58.24 1pra s VAL 68 Cb -0.24 -1.44 0.00 0.00 -1.53 0.00 0.00 36.38 33.18 1pra s VAL 68 CO -0.03 -0.37 0.00 -1.14 -3.33 0.00 0.00 175.10 170.22