#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2djv n SER 2 N 0.00 -2.40 -0.16 1.61 3.41 -1.26 -4.85 113.62 109.97 2djv n SER 2 Ca 0.00 0.61 -0.02 0.00 -0.26 0.00 0.00 58.87 59.20 2djv n SER 2 Cb 0.00 -1.05 0.07 0.00 -0.26 0.00 0.00 64.21 62.97 2djv n SER 2 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2djv h SER 3 N -0.17 -0.07 0.00 4.04 0.87 -2.05 -3.47 113.55 112.70 2djv h SER 3 Ca -0.44 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.22 2djv h SER 3 Cb 1.39 0.15 0.00 0.00 -0.44 0.00 0.00 62.40 63.50 2djv h SER 3 CO 0.41 -0.01 0.00 0.61 -0.53 0.00 0.00 176.83 177.32 2djv n GLY 4 N -1.29 1.29 3.84 5.77 0.00 -1.26 -5.01 105.19 108.53 2djv n GLY 4 Ca 0.06 -0.87 -0.28 0.00 0.00 0.00 0.00 46.02 44.93 2djv n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2djv s SER 5 N -4.00 4.48 0.11 1.61 0.15 -1.26 -5.05 113.70 109.74 2djv s SER 5 Ca 0.00 -1.32 -0.24 0.00 0.70 0.00 0.00 55.95 55.09 2djv s SER 5 Cb 0.00 0.29 -0.10 0.00 -1.71 0.00 0.00 66.02 64.50 2djv s SER 5 CO 0.00 -0.95 1.69 0.28 1.20 0.00 0.00 173.24 175.46 2djv h SER 6 N 1.01 -0.35 -2.92 5.45 0.02 -2.04 -3.42 113.55 111.30 2djv h SER 6 Ca -0.40 0.05 -0.62 0.00 -0.84 0.00 0.00 61.79 59.98 2djv h SER 6 Cb 1.30 0.14 -0.04 0.00 0.14 0.00 0.00 62.40 63.93 2djv h SER 6 CO 0.63 -0.18 -0.50 -0.83 -1.14 0.00 0.00 176.83 174.81 2djv s GLY 7 N -2.38 2.18 -0.86 -3.77 0.00 -1.26 -5.06 107.32 96.17 2djv s GLY 7 Ca -0.14 -0.84 -0.03 0.00 0.00 0.00 0.00 44.72 43.70 2djv s GLY 7 CO 0.66 -0.82 0.75 -1.59 0.00 0.00 0.00 173.10 172.10 2djv s THR 8 N -1.49 4.48 -0.30 0.90 2.01 -1.26 -4.94 115.64 115.04 2djv s THR 8 Ca 0.34 -3.57 -0.14 0.00 0.31 0.00 0.00 61.69 58.64 2djv s THR 8 Cb -0.13 -3.79 0.18 0.00 0.01 0.00 0.00 72.50 68.77 2djv s THR 8 CO 0.27 -1.05 1.08 0.28 -0.69 0.00 0.00 174.62 174.51 2djv s THR 9 N -1.01 -0.27 0.00 -0.82 -1.32 -1.26 -5.05 115.64 105.92 2djv s THR 9 Ca 0.25 0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.45 2djv s THR 9 Cb -0.10 -0.89 0.10 0.00 -1.51 0.00 0.00 72.50 70.10 2djv s THR 9 CO -0.10 0.00 0.92 0.00 -2.21 0.00 0.00 174.62 173.23 2djv s ALA 10 N 2.96 -1.82 0.05 11.08 0.00 -1.26 -5.00 121.76 127.77 2djv s ALA 10 Ca 0.02 0.94 -0.36 0.00 0.00 0.00 0.00 51.96 52.55 2djv s ALA 10 Cb -0.09 0.42 -0.20 0.00 0.00 0.00 0.00 23.12 23.25 2djv s ALA 10 CO -0.12 -0.73 1.49 -0.22 0.00 0.00 0.00 175.76 176.18 2djv h LYS 11 N 2.00 -1.23 0.00 0.00 1.63 -2.02 0.18 116.57 117.13 2djv h LYS 11 Ca -0.22 0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.67 2djv h LYS 11 Cb 1.24 0.28 0.00 0.00 -0.60 0.00 0.00 32.23 33.15 2djv h LYS 11 CO 0.30 -0.82 0.00 -0.35 -3.45 0.00 0.00 179.45 175.13 2djv n PRO 12 N -5.62 0.01 -0.09 1.90 -0.04 -1.26 -3.36 135.00 126.53 2djv n PRO 12 Ca -0.16 0.25 -0.13 0.00 -0.04 0.00 0.00 63.50 63.42 2djv n PRO 12 Cb 0.50 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.40 2djv n PRO 12 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2djv n GLN 13 N -1.49 0.51 -0.02 0.54 -0.06 -1.05 -4.13 117.38 111.68 2djv n GLN 13 Ca 0.04 0.53 0.22 0.00 -2.00 0.00 0.00 57.00 55.79 2djv n GLN 13 Cb 0.16 -1.70 0.54 0.00 -4.06 0.00 0.00 30.24 25.18 2djv n GLN 13 CO 0.00 0.00 0.00 -0.56 -0.20 0.00 0.00 177.06 176.30 2djv h GLN 14 N -1.00 0.00 0.17 3.69 3.07 -0.64 -0.28 115.11 120.12 2djv h GLN 14 Ca -0.18 0.00 0.02 0.00 0.09 0.00 0.00 58.65 58.57 2djv h GLN 14 Cb 0.92 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 28.44 2djv h GLN 14 CO -0.11 0.00 -0.35 0.82 0.09 0.00 0.00 178.83 179.28 2djv h ILE 15 N 0.00 0.27 -0.58 1.86 2.04 -1.71 -0.34 117.51 119.04 2djv h ILE 15 Ca 0.31 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.27 2djv h ILE 15 Cb 2.02 0.27 -0.08 0.00 -0.74 0.00 0.00 36.82 38.29 2djv h ILE 15 CO -0.00 0.00 0.16 -0.61 0.00 0.00 0.00 178.15 177.70 2djv h GLN 16 N -0.61 0.30 -0.27 2.37 5.75 -1.27 -1.76 115.11 119.62 2djv h GLN 16 Ca 0.02 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.53 2djv h GLN 16 Cb 0.62 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 29.07 2djv h GLN 16 CO -0.18 0.20 0.07 0.00 -2.65 0.00 0.00 178.83 176.27 2djv h ALA 17 N 1.44 0.29 -0.02 3.38 0.00 -1.50 -2.91 119.26 119.95 2djv h ALA 17 Ca 0.30 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.29 2djv h ALA 17 Cb 0.41 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 2djv h ALA 17 CO -0.35 -0.34 -0.37 -0.07 0.00 0.00 0.00 179.25 178.12 2djv h LEU 18 N 0.18 -1.12 -0.94 0.00 3.38 -0.22 -1.27 115.31 115.31 2djv h LEU 18 Ca 0.12 0.14 0.35 0.00 0.09 0.00 0.00 57.88 58.59 2djv h LEU 18 Cb 0.11 0.45 -0.17 0.00 0.09 0.00 0.00 40.66 41.14 2djv h LEU 18 CO -0.15 -0.42 0.34 0.23 0.09 0.00 0.00 178.44 178.53 2djv n MET 19 N -5.43 -0.06 -0.19 1.13 2.81 -0.88 0.18 117.12 114.67 2djv n MET 19 Ca -0.05 1.34 -0.09 0.00 -1.81 0.00 0.00 57.70 57.09 2djv n MET 19 Cb 0.35 -2.31 0.01 0.00 -0.71 0.00 0.00 33.22 30.57 2djv n MET 19 CO 0.00 0.00 0.00 0.22 1.51 0.00 0.00 175.97 177.70 2djv h ASP 20 N 0.00 0.83 -0.10 7.83 1.82 -1.21 -2.55 116.42 123.05 2djv h ASP 20 Ca 0.72 -0.24 -0.00 0.00 -0.39 0.00 0.00 57.03 57.12 2djv h ASP 20 Cb 1.79 -0.22 -0.00 0.00 0.68 0.00 0.00 39.33 41.58 2djv h ASP 20 CO -0.78 0.86 0.05 -0.33 -1.61 0.00 0.00 179.24 177.43 2djv h GLU 21 N 0.76 0.14 -0.86 0.28 4.39 0.22 -1.21 114.58 118.29 2djv h GLU 21 Ca 0.17 -0.02 0.11 0.00 0.34 0.00 0.00 59.36 59.96 2djv h GLU 21 Cb 0.36 -0.03 -0.08 0.00 -0.10 0.00 0.00 28.75 28.91 2djv h GLU 21 CO 0.00 0.18 0.50 0.28 -1.16 0.00 0.00 179.01 178.81 2djv h VAL 22 N 0.06 0.88 0.62 3.13 2.07 -1.10 0.42 116.25 122.34 2djv h VAL 22 Ca 0.03 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 2djv h VAL 22 Cb 0.08 0.01 0.01 0.00 -1.52 0.00 0.00 31.29 29.87 2djv h VAL 22 CO -0.01 0.15 -0.30 0.74 0.02 0.00 0.00 177.57 178.17 2djv h THR 23 N 0.80 0.15 0.70 2.57 2.02 -1.19 -2.93 112.91 115.05 2djv h THR 23 Ca 0.43 -0.35 -0.03 0.00 0.77 0.00 0.00 66.41 67.22 2djv h THR 23 Cb 0.43 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 2djv h THR 23 CO -0.27 0.02 -0.48 0.50 0.37 0.00 0.00 175.52 175.66 2djv h LYS 24 N -1.14 -1.09 -0.70 6.66 3.64 -1.00 -3.02 116.57 119.92 2djv h LYS 24 Ca -0.09 0.07 0.06 0.00 -1.27 0.00 0.00 60.65 59.43 2djv h LYS 24 Cb 0.68 0.25 -0.08 0.00 -0.41 0.00 0.00 32.23 32.66 2djv h LYS 24 CO 0.14 -0.72 -0.41 0.94 -2.27 0.00 0.00 179.45 177.12 2djv n GLN 25 N -5.60 -0.31 -0.24 1.90 -0.06 0.15 -0.46 117.38 112.76 2djv n GLN 25 Ca -0.14 1.17 -0.09 0.00 -2.00 0.00 0.00 57.00 55.94 2djv n GLN 25 Cb 0.48 -1.72 -0.04 0.00 -4.06 0.00 0.00 30.24 24.89 2djv n GLN 25 CO 0.00 0.00 0.00 0.78 -0.20 0.00 0.00 177.06 177.64 2djv h GLY 26 N 0.00 -0.53 -0.24 1.69 0.00 -1.44 -0.69 103.07 101.87 2djv h GLY 26 Ca 0.11 0.61 0.10 0.00 0.00 0.00 0.00 47.33 48.15 2djv h GLY 26 CO -0.66 -0.13 -0.27 3.43 0.00 0.00 0.00 176.54 178.90 2djv h ASN 27 N -0.20 -0.93 -0.80 0.19 2.35 -0.64 0.85 115.58 116.39 2djv h ASN 27 Ca 0.18 0.20 0.16 0.00 -0.55 0.00 0.00 56.30 56.29 2djv h ASN 27 Cb 0.55 0.48 -0.10 0.00 0.05 0.00 0.00 38.32 39.30 2djv h ASN 27 CO -0.73 -0.28 0.33 0.40 -1.65 0.00 0.00 177.43 175.50 2djv h ILE 28 N -0.15 0.61 -0.37 2.81 2.04 -0.36 -0.08 117.51 122.01 2djv h ILE 28 Ca 0.23 -0.15 -0.04 0.00 1.00 0.00 0.00 64.86 65.90 2djv h ILE 28 Cb 0.51 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.70 2djv h ILE 28 CO -0.60 0.08 0.09 0.58 0.00 0.00 0.00 178.15 178.30 2djv h VAL 29 N 0.44 1.22 -0.06 1.67 2.07 -0.10 0.50 116.25 122.00 2djv h VAL 29 Ca 0.46 -0.76 0.02 0.00 0.82 0.00 0.00 66.70 67.23 2djv h VAL 29 Cb 0.75 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 2djv h VAL 29 CO -0.44 0.26 -0.03 -0.09 0.02 0.00 0.00 177.57 177.29 2djv h ARG 30 N 0.46 -0.02 -0.60 1.57 9.65 0.41 -2.60 114.38 123.25 2djv h ARG 30 Ca 0.12 0.00 -0.08 0.00 -1.10 0.00 0.00 59.98 58.91 2djv h ARG 30 Cb 0.30 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.86 2djv h ARG 30 CO 0.00 -0.01 0.04 1.05 2.80 0.00 0.00 179.97 183.85 2djv h GLU 31 N -0.02 1.01 -0.46 0.20 4.11 -1.02 -2.90 114.58 115.51 2djv h GLU 31 Ca 0.04 -0.29 0.09 0.00 0.07 0.00 0.00 59.36 59.27 2djv h GLU 31 Cb 0.07 -0.11 -0.10 0.00 0.50 0.00 0.00 28.75 29.12 2djv h GLU 31 CO -0.08 0.97 -0.20 -0.07 0.07 0.00 0.00 179.01 179.70 2djv h LEU 32 N 0.94 -0.69 -0.54 3.06 3.38 -0.53 0.33 115.31 121.26 2djv h LEU 32 Ca 0.18 0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.30 2djv h LEU 32 Cb 0.49 0.38 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 2djv h LEU 32 CO 0.02 -0.23 0.29 0.11 0.09 0.00 0.00 178.44 178.72 2djv h LYS 33 N -0.10 0.76 -0.28 1.13 1.57 -1.40 -1.94 116.57 116.32 2djv h LYS 33 Ca 0.22 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 2djv h LYS 33 Cb 0.44 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 2djv h LYS 33 CO -0.53 0.60 0.08 0.00 -0.57 0.00 0.00 179.45 179.03 2djv h ALA 34 N 1.12 1.62 -0.30 3.86 0.00 -0.98 -1.56 119.26 123.02 2djv h ALA 34 Ca 0.19 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 2djv h ALA 34 Cb 0.07 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.67 2djv h ALA 34 CO -0.03 0.29 0.15 1.04 0.00 0.00 0.00 179.25 180.70 2djv n GLN 35 N -4.39 1.80 -3.92 0.00 6.02 0.10 -4.86 117.38 112.13 2djv n GLN 35 Ca 0.01 -1.10 -0.32 0.00 -0.01 0.00 0.00 57.00 55.58 2djv n GLN 35 Cb 0.15 -1.55 -0.07 0.00 1.02 0.00 0.00 30.24 29.80 2djv n GLN 35 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2djv n LYS 36 N 0.02 -0.80 -1.39 -1.09 5.02 -0.59 -4.83 118.16 114.50 2djv n LYS 36 Ca 0.17 0.10 -0.33 0.00 -2.02 0.00 0.00 58.31 56.24 2djv n LYS 36 Cb 0.80 -3.57 0.09 0.00 -0.02 0.00 0.00 35.03 32.33 2djv n LYS 36 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2djv s ALA 37 N -3.03 2.15 0.22 7.82 0.00 -0.78 -4.92 121.76 123.21 2djv s ALA 37 Ca 0.54 0.64 -0.31 0.00 0.00 0.00 0.00 51.96 52.83 2djv s ALA 37 Cb -0.32 -3.39 -0.12 0.00 0.00 0.00 0.00 23.12 19.30 2djv s ALA 37 CO 0.81 -1.81 1.68 0.34 0.00 0.00 0.00 175.76 176.78 2djv s ASP 38 N -2.50 6.40 0.29 0.00 2.15 -1.26 -4.85 116.67 116.90 2djv s ASP 38 Ca 0.69 2.87 0.05 0.00 0.43 0.00 0.00 52.55 56.58 2djv s ASP 38 Cb -0.24 -2.61 0.73 0.00 -0.30 0.00 0.00 42.92 40.51 2djv s ASP 38 CO 0.48 -0.95 1.73 0.07 -0.17 0.00 0.00 175.17 176.33 2djv h LYS 39 N 6.36 0.52 -0.00 4.34 2.10 -1.99 0.05 116.57 127.94 2djv h LYS 39 Ca -0.44 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 58.18 2djv h LYS 39 Cb 1.21 -0.12 -0.00 0.00 -0.90 0.00 0.00 32.23 32.42 2djv h LYS 39 CO 0.92 0.34 0.00 -0.97 -2.00 0.00 0.00 179.45 177.74 2djv h ASN 40 N 0.53 0.00 -0.78 7.07 -0.73 -2.00 -0.84 115.58 118.83 2djv h ASN 40 Ca 0.57 -0.07 0.03 0.00 1.87 0.00 0.00 56.30 58.69 2djv h ASN 40 Cb 1.00 -0.00 -0.05 0.00 0.27 0.00 0.00 38.32 39.55 2djv h ASN 40 CO -0.47 0.07 0.50 -0.33 -0.37 0.00 0.00 177.43 176.84 2djv h GLU 41 N -0.07 0.95 -0.03 6.67 5.08 -1.49 -2.74 114.58 122.95 2djv h GLU 41 Ca 0.00 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2djv h GLU 41 Cb 0.07 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 2djv h GLU 41 CO -0.00 0.63 0.01 0.28 -1.00 0.00 0.00 179.01 178.93 2djv h VAL 42 N 0.98 1.08 -0.69 3.13 2.07 -0.83 -3.06 116.25 118.92 2djv h VAL 42 Ca 0.31 -0.22 0.13 0.00 0.82 0.00 0.00 66.70 67.73 2djv h VAL 42 Cb -0.01 1.18 -0.13 0.00 -1.52 0.00 0.00 31.29 30.82 2djv h VAL 42 CO -0.10 0.06 -0.29 0.00 0.02 0.00 0.00 177.57 177.26 2djv h ALA 43 N 0.92 0.16 -0.91 1.67 0.00 -0.86 0.11 119.26 120.35 2djv h ALA 43 Ca 0.01 0.22 0.22 0.00 0.00 0.00 0.00 54.91 55.36 2djv h ALA 43 Cb 0.09 0.74 -0.17 0.00 0.00 0.00 0.00 17.79 18.45 2djv h ALA 43 CO -0.00 -0.58 -0.03 0.00 0.00 0.00 0.00 179.25 178.63 2djv h ALA 44 N 1.29 0.93 -0.21 0.00 0.00 -1.41 0.32 119.26 120.18 2djv h ALA 44 Ca 0.29 0.31 -0.04 0.00 0.00 0.00 0.00 54.91 55.47 2djv h ALA 44 Cb 0.56 0.56 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2djv h ALA 44 CO -0.75 -0.48 -0.04 0.93 0.00 0.00 0.00 179.25 178.91 2djv h GLU 45 N 0.04 0.39 -0.93 0.00 4.39 -0.89 -3.07 114.58 114.51 2djv h GLU 45 Ca 0.51 -0.15 0.08 0.00 0.34 0.00 0.00 59.36 60.14 2djv h GLU 45 Cb 0.95 -0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 29.51 2djv h GLU 45 CO -0.85 0.63 0.58 0.28 -1.16 0.00 0.00 179.01 178.50 2djv h VAL 46 N 0.12 1.02 -0.35 3.13 2.07 0.37 0.10 116.25 122.71 2djv h VAL 46 Ca 0.05 -0.35 0.06 0.00 0.82 0.00 0.00 66.70 67.29 2djv h VAL 46 Cb 0.48 -0.10 -0.06 0.00 -1.52 0.00 0.00 31.29 30.10 2djv h VAL 46 CO 0.02 0.19 -0.00 0.00 0.02 0.00 0.00 177.57 177.79 2djv h ALA 47 N 1.45 0.32 -0.00 1.67 0.00 -0.44 0.18 119.26 122.43 2djv h ALA 47 Ca 0.42 0.10 -0.13 0.00 0.00 0.00 0.00 54.91 55.31 2djv h ALA 47 Cb 0.25 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2djv h ALA 47 CO -0.20 -0.40 -0.60 1.57 0.00 0.00 0.00 179.25 179.62 2djv h LYS 48 N 0.09 0.01 0.13 0.00 2.10 -1.36 -3.19 116.57 114.36 2djv h LYS 48 Ca 0.17 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.81 2djv h LYS 48 Cb 0.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.57 2djv h LYS 48 CO -0.29 0.61 -0.06 1.25 -2.00 0.00 0.00 179.45 178.95 2djv h LEU 49 N 0.01 -0.15 -0.87 7.07 5.85 0.08 -1.84 115.31 125.47 2djv h LEU 49 Ca -0.01 -0.27 0.19 0.00 0.84 0.00 0.00 57.88 58.64 2djv h LEU 49 Cb 1.06 0.04 -0.11 0.00 0.37 0.00 0.00 40.66 42.02 2djv h LEU 49 CO 0.08 0.20 0.39 -0.07 -0.34 0.00 0.00 178.44 178.70 2djv h LEU 50 N -0.52 0.37 0.52 2.25 3.38 -0.72 -1.85 115.31 118.73 2djv h LEU 50 Ca -0.02 0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2djv h LEU 50 Cb 0.41 0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.26 2djv h LEU 50 CO 0.03 0.07 -0.25 -0.78 0.09 0.00 0.00 178.44 177.60 2djv h ASP 51 N 0.46 -0.59 -1.41 -0.43 3.58 -1.53 -3.02 116.42 113.48 2djv h ASP 51 Ca 0.52 -0.06 0.44 0.00 0.42 0.00 0.00 57.03 58.35 2djv h ASP 51 Cb 0.90 0.15 -0.11 0.00 1.72 0.00 0.00 39.33 42.00 2djv h ASP 51 CO -0.47 -0.22 0.95 -0.07 -2.88 0.00 0.00 179.24 176.55 2djv h LEU 52 N -1.01 0.19 -0.95 2.28 3.38 -0.66 1.09 115.31 119.62 2djv h LEU 52 Ca -0.07 0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2djv h LEU 52 Cb 0.61 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.40 2djv h LEU 52 CO 0.12 -0.11 0.60 0.11 0.09 0.00 0.00 178.44 179.25 2djv h LYS 53 N 0.08 1.26 0.16 1.13 1.57 -1.22 -0.50 116.57 119.06 2djv h LYS 53 Ca 0.80 -0.09 -0.30 0.00 -1.87 0.00 0.00 60.65 59.19 2djv h LYS 53 Cb 2.70 -0.28 0.01 0.00 0.08 0.00 0.00 32.23 34.75 2djv h LYS 53 CO -0.29 0.86 -1.35 1.57 -0.57 0.00 0.00 179.45 179.67 2djv h LYS 54 N 1.29 0.35 -0.26 3.15 2.10 0.11 -3.24 116.57 120.07 2djv h LYS 54 Ca 0.34 -0.59 0.00 0.00 -2.00 0.00 0.00 60.65 58.40 2djv h LYS 54 Cb -0.11 0.22 -0.01 0.00 -0.90 0.00 0.00 32.23 31.43 2djv h LYS 54 CO -0.07 1.27 0.16 1.96 -2.00 0.00 0.00 179.45 180.78 2djv h GLN 55 N 0.09 0.35 0.14 0.07 4.20 -0.81 -1.35 115.11 117.81 2djv h GLN 55 Ca -0.18 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.49 2djv h GLN 55 Cb 2.03 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 29.74 2djv h GLN 55 CO 0.22 0.26 -0.10 1.25 -0.67 0.00 0.00 178.83 179.79 2djv h LEU 56 N 0.34 -0.27 -0.31 1.46 7.12 -1.21 0.36 115.31 122.81 2djv h LEU 56 Ca 0.09 0.02 0.04 0.00 0.13 0.00 0.00 57.88 58.16 2djv h LEU 56 Cb -0.01 0.08 -0.06 0.00 -0.53 0.00 0.00 40.66 40.15 2djv h LEU 56 CO -0.02 -0.15 -0.39 0.00 -0.13 0.00 0.00 178.44 177.75 2djv h ALA 57 N -1.69 -0.63 -0.40 1.25 0.00 -1.60 -0.92 119.26 115.28 2djv h ALA 57 Ca -0.02 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.98 2djv h ALA 57 Cb 0.19 1.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.91 2djv h ALA 57 CO 0.01 -0.82 -0.24 0.28 0.00 0.00 0.00 179.25 178.48 2djv h VAL 58 N -0.27 0.35 -0.29 0.00 2.07 -1.27 -1.30 116.25 115.53 2djv h VAL 58 Ca 0.05 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.61 2djv h VAL 58 Cb 0.41 0.35 -0.06 0.00 -1.52 0.00 0.00 31.29 30.47 2djv h VAL 58 CO -0.43 0.00 -0.43 0.00 0.02 0.00 0.00 177.57 176.73 2djv h ALA 59 N 1.03 -0.69 -1.00 1.67 0.00 0.61 0.12 119.26 121.00 2djv h ALA 59 Ca 0.19 -0.01 0.19 0.00 0.00 0.00 0.00 54.91 55.28 2djv h ALA 59 Cb 0.47 1.02 -0.11 0.00 0.00 0.00 0.00 17.79 19.18 2djv h ALA 59 CO -0.50 -0.89 0.60 0.93 0.00 0.00 0.00 179.25 179.38 2djv h GLU 60 N -0.33 0.73 0.00 0.00 5.08 -0.76 -3.46 114.58 115.84 2djv h GLU 60 Ca 0.05 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2djv h GLU 60 Cb 0.47 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2djv h GLU 60 CO -0.45 0.48 0.00 0.41 -1.00 0.00 0.00 179.01 178.45 2djv n GLY 61 N -1.33 1.82 3.92 -3.84 0.00 0.03 -5.12 105.19 100.67 2djv n GLY 61 Ca 0.23 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.04 2djv n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2djv s LYS 62 N -0.46 3.20 0.40 1.61 1.02 -1.05 -5.03 119.74 119.44 2djv s LYS 62 Ca 0.00 -0.91 -0.25 0.00 0.02 0.00 0.00 55.97 54.82 2djv s LYS 62 Cb 0.00 -2.76 -0.08 0.00 -0.52 0.00 0.00 37.83 34.47 2djv s LYS 62 CO 0.00 0.35 1.19 -1.25 -0.92 0.00 0.00 175.35 174.72 2djv s PRO 63 N -3.97 4.02 0.00 -1.68 0.04 -1.26 -4.41 135.00 127.74 2djv s PRO 63 Ca 0.36 1.88 0.00 0.00 0.04 0.00 0.00 61.00 63.27 2djv s PRO 63 Cb -0.09 -2.67 0.00 0.00 0.04 0.00 0.00 34.50 31.79 2djv s PRO 63 CO 0.28 -0.36 0.00 -0.35 0.04 0.00 0.00 177.00 176.61 2djv n PRO 64 N 0.04 0.13 -0.75 0.56 -0.04 -1.26 -4.81 135.00 128.88 2djv n PRO 64 Ca 0.04 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.43 2djv n PRO 64 Cb 0.46 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.82 2djv n PRO 64 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2djv n GLU 65 N -0.65 1.50 -0.49 0.54 4.71 -1.26 -4.89 120.64 120.10 2djv n GLU 65 Ca 0.00 -0.60 -0.08 0.00 -0.01 0.00 0.00 57.16 56.47 2djv n GLU 65 Cb 0.00 -1.66 -0.07 0.00 -1.01 0.00 0.00 31.44 28.70 2djv n GLU 65 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2djv n ALA 66 N 2.23 0.34 0.98 0.62 0.00 -1.26 -4.62 120.51 118.79 2djv n ALA 66 Ca 0.26 -0.25 0.06 0.00 0.00 0.00 0.00 53.44 53.51 2djv n ALA 66 Cb 0.70 -0.78 0.36 0.00 0.00 0.00 0.00 19.45 19.74 2djv n ALA 66 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2djv n PRO 67 N 1.89 0.49 -4.39 0.00 -0.04 -1.26 -4.72 135.00 126.98 2djv n PRO 67 Ca 0.22 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.44 2djv n PRO 67 Cb 0.04 -1.39 -0.09 0.00 -0.04 0.00 0.00 33.50 32.02 2djv n PRO 67 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 2djv s LYS 68 N -2.00 1.97 0.00 0.54 0.00 -1.26 -5.14 119.74 113.84 2djv s LYS 68 Ca 0.18 -1.59 0.00 0.00 0.00 0.00 0.00 55.97 54.56 2djv s LYS 68 Cb 0.08 -1.96 0.00 0.00 0.00 0.00 0.00 37.83 35.96 2djv s LYS 68 CO 0.14 0.35 0.00 0.41 0.00 0.00 0.00 175.35 176.25 2djv n GLY 69 N -0.71 2.47 2.27 0.59 0.00 -1.26 -5.03 105.19 103.51 2djv n GLY 69 Ca -0.06 -0.90 -0.26 0.00 0.00 0.00 0.00 46.02 44.80 2djv n GLY 69 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2djv n LYS 70 N 0.00 3.47 0.04 1.61 2.85 -1.26 -4.86 118.16 120.00 2djv n LYS 70 Ca 0.00 -4.27 -0.13 0.00 -1.05 0.00 0.00 58.31 52.86 2djv n LYS 70 Cb 0.00 -2.27 -0.07 0.00 -0.65 0.00 0.00 35.03 32.04 2djv n LYS 70 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 177.40 178.22 2djv h LYS 71 N 2.38 -0.54 -6.31 -1.58 6.56 -2.05 -3.42 116.57 111.62 2djv h LYS 71 Ca 0.36 0.04 -0.59 0.00 -1.06 0.00 0.00 60.65 59.39 2djv h LYS 71 Cb 1.18 0.12 -0.10 0.00 -0.57 0.00 0.00 32.23 32.86 2djv h LYS 71 CO 0.86 -0.36 -0.64 0.21 -2.06 0.00 0.00 179.45 177.45 2djv s LYS 72 N -5.86 2.47 0.66 3.15 2.20 -1.26 -5.12 119.74 115.97 2djv s LYS 72 Ca -0.16 -1.10 -0.12 0.00 -0.36 0.00 0.00 55.97 54.24 2djv s LYS 72 Cb 0.08 -2.38 -0.01 0.00 -1.51 0.00 0.00 37.83 34.01 2djv s LYS 72 CO 0.63 0.45 1.05 0.21 -0.36 0.00 0.00 175.35 177.33 2djv s LYS 73 N -3.04 3.21 -0.11 4.03 2.20 -1.26 -5.06 119.74 119.71 2djv s LYS 73 Ca 0.28 0.91 0.02 0.00 -0.36 0.00 0.00 55.97 56.83 2djv s LYS 73 Cb -0.09 -2.03 -0.01 0.00 -1.51 0.00 0.00 37.83 34.19 2djv s LYS 73 CO 0.19 -0.88 -0.19 -1.12 -0.36 0.00 0.00 175.35 172.99 2djv s SER 74 N -3.79 3.50 -0.48 1.43 0.01 -1.26 -5.05 113.70 108.06 2djv s SER 74 Ca 0.58 -0.45 0.08 0.00 1.31 0.00 0.00 55.95 57.46 2djv s SER 74 Cb -0.13 -1.49 0.28 0.00 0.21 0.00 0.00 66.02 64.89 2djv s SER 74 CO 0.52 0.16 0.66 0.61 0.41 0.00 0.00 173.24 175.61 2djv n GLY 75 N 3.51 3.82 0.00 3.44 0.00 -1.26 -4.91 105.19 109.79 2djv n GLY 75 Ca -0.19 -2.05 0.07 0.00 0.00 0.00 0.00 46.02 43.85 2djv n GLY 75 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2djv n PRO 76 N 0.89 0.48 -0.31 1.61 -0.04 -1.26 -4.05 135.00 132.33 2djv n PRO 76 Ca 0.25 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.70 2djv n PRO 76 Cb 0.50 -1.44 0.03 0.00 -0.04 0.00 0.00 33.50 32.56 2djv n PRO 76 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2djv n SER 77 N -0.94 -0.53 -3.80 3.54 7.64 -1.26 -4.14 113.62 114.14 2djv n SER 77 Ca 0.10 1.39 -0.22 0.00 1.01 0.00 0.00 58.87 61.15 2djv n SER 77 Cb 0.05 -0.32 -0.17 0.00 -1.01 0.00 0.00 64.21 62.76 2djv n SER 77 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2djv s SER 78 N -5.29 1.38 0.00 6.43 1.04 -1.26 -5.35 113.70 110.65 2djv s SER 78 Ca -0.11 -0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.23 2djv s SER 78 Cb 0.16 -0.42 0.00 0.00 0.10 0.00 0.00 66.02 65.86 2djv s SER 78 CO 0.57 -0.16 0.00 0.61 0.98 0.00 0.00 173.24 175.24