#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2djv s SER 2 N 0.00 5.73 -0.20 1.61 0.15 -1.26 -5.02 113.70 114.71 2djv s SER 2 Ca 0.00 -3.31 -0.23 0.00 0.70 0.00 0.00 55.95 53.11 2djv s SER 2 Cb 0.00 -1.91 0.06 0.00 -1.71 0.00 0.00 66.02 62.47 2djv s SER 2 CO 0.00 -0.28 0.64 -0.55 1.20 0.00 0.00 173.24 174.24 2djv s SER 3 N 0.34 -0.65 0.00 5.45 0.15 -1.26 -5.09 113.70 112.64 2djv s SER 3 Ca 0.23 1.14 0.00 0.00 0.70 0.00 0.00 55.95 58.02 2djv s SER 3 Cb -0.13 1.14 0.00 0.00 -1.71 0.00 0.00 66.02 65.32 2djv s SER 3 CO -0.08 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 174.67 2djv n GLY 4 N 2.36 0.04 3.32 9.45 0.00 -1.26 -5.10 105.19 114.00 2djv n GLY 4 Ca -0.15 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.73 2djv n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2djv s SER 5 N -4.00 -0.45 0.04 1.61 1.04 -1.26 -5.17 113.70 105.51 2djv s SER 5 Ca 0.00 0.87 0.02 0.00 0.48 0.00 0.00 55.95 57.31 2djv s SER 5 Cb 0.00 0.87 -0.03 0.00 0.10 0.00 0.00 66.02 66.96 2djv s SER 5 CO 0.00 -0.15 -0.07 -0.55 0.98 0.00 0.00 173.24 173.45 2djv s SER 6 N 0.34 0.78 0.00 7.02 0.15 -1.26 -5.06 113.70 115.67 2djv s SER 6 Ca -0.01 -0.59 0.00 0.00 0.70 0.00 0.00 55.95 56.05 2djv s SER 6 Cb -0.03 0.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.33 2djv s SER 6 CO -0.01 -0.25 0.00 0.61 1.20 0.00 0.00 173.24 174.80 2djv n GLY 7 N 1.34 0.00 3.68 9.45 0.00 -1.26 -5.08 105.19 113.32 2djv n GLY 7 Ca -0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 2djv n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2djv s THR 8 N -1.72 4.02 -0.29 2.61 2.01 -1.26 -5.08 115.64 115.93 2djv s THR 8 Ca 0.00 -0.93 -0.29 0.00 0.31 0.00 0.00 61.69 60.78 2djv s THR 8 Cb 0.00 -2.89 0.01 0.00 0.01 0.00 0.00 72.50 69.63 2djv s THR 8 CO 0.00 0.17 1.13 -0.89 -0.69 0.00 0.00 174.62 174.34 2djv s THR 9 N -1.26 4.44 -0.01 -0.82 2.01 -1.26 -5.02 115.64 113.73 2djv s THR 9 Ca 0.24 1.68 -0.20 0.00 0.31 0.00 0.00 61.69 63.72 2djv s THR 9 Cb -0.12 -4.31 -0.05 0.00 0.01 0.00 0.00 72.50 68.03 2djv s THR 9 CO 0.17 -0.40 0.59 0.00 -0.69 0.00 0.00 174.62 174.29 2djv s ALA 10 N 3.70 3.49 -0.03 7.40 0.00 -1.26 -5.01 121.76 130.05 2djv s ALA 10 Ca 0.48 0.03 -0.16 0.00 0.00 0.00 0.00 51.96 52.31 2djv s ALA 10 Cb -0.14 -2.74 -0.09 0.00 0.00 0.00 0.00 23.12 20.15 2djv s ALA 10 CO 0.15 0.16 0.67 0.87 0.00 0.00 0.00 175.76 177.61 2djv h LYS 11 N 5.65 -0.56 0.00 0.00 1.57 -1.99 0.31 116.57 121.55 2djv h LYS 11 Ca -0.45 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 2djv h LYS 11 Cb 1.20 0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.64 2djv h LYS 11 CO 0.70 -0.37 0.00 -0.35 -0.57 0.00 0.00 179.45 178.86 2djv n PRO 12 N -5.16 0.49 -0.06 3.15 -0.04 -1.26 -2.96 135.00 129.15 2djv n PRO 12 Ca -0.07 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.27 2djv n PRO 12 Cb 0.23 -1.36 -0.05 0.00 -0.04 0.00 0.00 33.50 32.28 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 -0.86 0.28 -0.22 0.54 7.27 -1.21 -4.67 117.38 118.52 2djv n GLN 13 Ca 0.08 0.10 -0.03 0.00 0.07 0.00 0.00 57.00 57.22 2djv n GLN 13 Cb 0.04 -1.07 0.08 0.00 2.41 0.00 0.00 30.24 31.70 2djv n GLN 13 CO 0.00 0.00 0.00 -0.56 0.07 0.00 0.00 177.06 176.57 2djv h GLN 14 N -0.28 0.67 -0.93 3.69 3.07 -0.83 -2.93 115.11 117.56 2djv h GLN 14 Ca -0.31 -0.04 0.09 0.00 0.09 0.00 0.00 58.65 58.49 2djv h GLN 14 Cb 1.34 -0.15 -0.12 0.00 0.08 0.00 0.00 27.48 28.63 2djv h GLN 14 CO -0.14 0.44 -0.56 0.82 0.09 0.00 0.00 178.83 179.48 2djv h ILE 15 N 0.69 0.00 -0.76 1.86 2.04 -1.77 0.37 117.51 119.95 2djv h ILE 15 Ca 0.27 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.30 2djv h ILE 15 Cb 0.11 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.07 2djv h ILE 15 CO -0.15 0.00 0.05 -0.61 0.00 0.00 0.00 178.15 177.45 2djv h GLN 16 N -0.04 0.13 0.82 2.37 5.75 -1.79 0.71 115.11 123.05 2djv h GLN 16 Ca 0.17 -0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.62 2djv h GLN 16 Cb 0.45 -0.03 0.01 0.00 1.07 0.00 0.00 27.48 28.98 2djv h GLN 16 CO -0.91 0.09 -0.39 0.00 -2.65 0.00 0.00 178.83 174.97 2djv h ALA 17 N 1.69 -1.10 -0.64 3.38 0.00 -0.44 -3.15 119.26 119.01 2djv h ALA 17 Ca 0.42 -0.24 0.13 0.00 0.00 0.00 0.00 54.91 55.21 2djv h ALA 17 Cb 0.75 0.42 -0.12 0.00 0.00 0.00 0.00 17.79 18.85 2djv h ALA 17 CO -0.64 -1.05 -0.21 -0.07 0.00 0.00 0.00 179.25 177.29 2djv h LEU 18 N -1.24 -0.76 -0.91 0.00 3.38 -0.05 -0.89 115.31 114.84 2djv h LEU 18 Ca -0.11 0.21 0.14 0.00 0.09 0.00 0.00 57.88 58.20 2djv h LEU 18 Cb 0.85 0.45 -0.15 0.00 0.09 0.00 0.00 40.66 41.91 2djv h LEU 18 CO 0.18 -0.24 -0.40 0.24 0.09 0.00 0.00 178.44 178.31 2djv h MET 19 N -0.05 -0.04 -0.68 1.13 2.86 -0.86 0.48 114.93 117.77 2djv h MET 19 Ca 0.30 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 58.00 2djv h MET 19 Cb 0.51 0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.12 2djv h MET 19 CO -0.68 -0.03 0.38 0.22 1.06 0.00 0.00 176.91 177.86 2djv h ASP 20 N -0.04 0.57 -0.26 1.22 1.82 -1.13 -2.35 116.42 116.24 2djv h ASP 20 Ca 0.30 0.03 0.04 0.00 -0.39 0.00 0.00 57.03 57.01 2djv h ASP 20 Cb 0.57 -0.08 -0.04 0.00 0.68 0.00 0.00 39.33 40.47 2djv h ASP 20 CO -0.92 0.36 0.04 -0.33 -1.61 0.00 0.00 179.24 176.78 2djv h GLU 21 N 0.70 0.13 -0.68 0.28 4.39 0.27 -0.00 114.58 119.67 2djv h GLU 21 Ca 0.30 -0.01 0.12 0.00 0.34 0.00 0.00 59.36 60.11 2djv h GLU 21 Cb 0.19 -0.03 -0.09 0.00 -0.10 0.00 0.00 28.75 28.72 2djv h GLU 21 CO -0.18 0.09 0.24 0.28 -1.16 0.00 0.00 179.01 178.28 2djv h VAL 22 N 0.13 0.70 0.56 3.13 2.07 -0.49 0.99 116.25 123.34 2djv h VAL 22 Ca 0.12 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 2djv h VAL 22 Cb 0.13 0.26 0.01 0.00 -1.52 0.00 0.00 31.29 30.16 2djv h VAL 22 CO -0.17 0.07 -0.27 0.74 0.02 0.00 0.00 177.57 177.97 2djv h THR 23 N 0.40 0.00 -0.74 2.57 2.02 -1.09 -3.15 112.91 112.92 2djv h THR 23 Ca 0.36 -0.32 0.16 0.00 0.77 0.00 0.00 66.41 67.37 2djv h THR 23 Cb 0.51 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 66.78 2djv h THR 23 CO -0.37 0.00 -0.09 0.50 0.37 0.00 0.00 175.52 175.93 2djv h LYS 24 N -1.07 0.04 -0.31 6.66 1.63 -0.84 -1.97 116.57 120.72 2djv h LYS 24 Ca -0.08 -0.00 0.03 0.00 -0.85 0.00 0.00 60.65 59.75 2djv h LYS 24 Cb 0.57 -0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 32.14 2djv h LYS 24 CO 0.13 0.03 -0.31 0.37 -3.45 0.00 0.00 179.45 176.21 2djv h GLN 25 N 0.05 -0.16 -1.15 1.90 -0.00 -0.85 0.24 115.11 115.14 2djv h GLN 25 Ca 0.38 0.01 0.38 0.00 -0.00 0.00 0.00 58.65 59.42 2djv h GLN 25 Cb 0.63 0.04 -0.14 0.00 0.00 0.00 0.00 27.48 28.01 2djv h GLN 25 CO -0.71 -0.11 0.71 0.78 0.00 0.00 0.00 178.83 179.50 2djv h GLY 26 N -0.17 1.63 0.87 2.39 0.00 -1.32 0.41 103.07 106.88 2djv h GLY 26 Ca 0.05 -0.17 -0.13 0.00 0.00 0.00 0.00 47.33 47.08 2djv h GLY 26 CO -0.38 -0.44 -0.45 3.43 0.00 0.00 0.00 176.54 178.70 2djv h ASN 27 N 0.19 0.61 -0.81 0.19 2.35 -0.52 -2.70 115.58 114.88 2djv h ASN 27 Ca 0.77 -0.62 0.07 0.00 -0.55 0.00 0.00 56.30 55.97 2djv h ASN 27 Cb 2.13 -0.18 -0.06 0.00 0.05 0.00 0.00 38.32 40.26 2djv h ASN 27 CO -0.50 1.12 0.49 0.40 -1.65 0.00 0.00 177.43 177.30 2djv h ILE 28 N 0.13 1.01 -0.50 2.81 2.04 0.26 -1.07 117.51 122.19 2djv h ILE 28 Ca -0.02 -0.30 -0.08 0.00 1.00 0.00 0.00 64.86 65.45 2djv h ILE 28 Cb 1.08 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 2djv h ILE 28 CO 0.09 0.16 -0.02 0.58 0.00 0.00 0.00 178.15 178.97 2djv h VAL 29 N 0.89 1.26 -0.02 1.67 2.07 -1.24 -0.09 116.25 120.79 2djv h VAL 29 Ca 0.36 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.77 2djv h VAL 29 Cb 0.20 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2djv h VAL 29 CO -0.19 0.39 0.01 -0.09 0.02 0.00 0.00 177.57 177.72 2djv h ARG 30 N 0.76 0.03 -0.35 1.57 2.43 -1.04 -2.67 114.38 115.11 2djv h ARG 30 Ca 0.14 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.26 2djv h ARG 30 Cb 0.54 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 2djv h ARG 30 CO 0.03 0.03 0.01 1.05 -1.51 0.00 0.00 179.97 179.58 2djv h GLU 31 N 0.01 0.60 -0.80 0.20 4.11 -1.18 -2.62 114.58 114.90 2djv h GLU 31 Ca 0.01 -0.18 0.19 0.00 0.07 0.00 0.00 59.36 59.45 2djv h GLU 31 Cb 0.01 -0.06 -0.13 0.00 0.50 0.00 0.00 28.75 29.07 2djv h GLU 31 CO -0.00 0.71 0.12 -0.07 0.07 0.00 0.00 179.01 179.84 2djv h LEU 32 N 0.42 -0.16 -0.30 3.06 3.38 -0.86 0.35 115.31 121.20 2djv h LEU 32 Ca 0.10 0.19 -0.09 0.00 0.09 0.00 0.00 57.88 58.17 2djv h LEU 32 Cb 0.43 0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2djv h LEU 32 CO 0.02 -0.15 -0.17 0.11 0.09 0.00 0.00 178.44 178.34 2djv h LYS 33 N 0.17 0.65 -0.05 1.13 1.57 -1.37 -1.74 116.57 116.94 2djv h LYS 33 Ca 0.47 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 2djv h LYS 33 Cb 0.88 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.17 2djv h LYS 33 CO -0.64 0.88 -0.04 0.00 -0.57 0.00 0.00 179.45 179.08 2djv h ALA 34 N 0.75 1.85 -0.34 3.86 0.00 -0.49 -1.30 119.26 123.59 2djv h ALA 34 Ca 0.07 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2djv h ALA 34 Cb 0.70 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.38 2djv h ALA 34 CO 0.05 0.12 0.16 1.04 0.00 0.00 0.00 179.25 180.62 2djv n GLN 35 N -4.45 1.92 -4.49 0.00 6.02 0.99 -4.86 117.38 112.52 2djv n GLN 35 Ca -0.02 -1.24 -0.40 0.00 -0.01 0.00 0.00 57.00 55.33 2djv n GLN 35 Cb 0.15 -1.61 -0.08 0.00 1.02 0.00 0.00 30.24 29.72 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 -0.00 -0.88 -2.09 -1.09 5.02 -0.49 -4.85 118.16 113.77 2djv n LYS 36 Ca 0.19 0.14 -0.35 0.00 -2.02 0.00 0.00 58.31 56.27 2djv n LYS 36 Cb 0.84 -4.54 0.02 0.00 -0.02 0.00 0.00 35.03 31.33 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 -3.45 2.60 0.22 7.82 0.00 -0.67 -4.92 121.76 123.35 2djv s ALA 37 Ca 0.68 0.90 -0.31 0.00 0.00 0.00 0.00 51.96 53.23 2djv s ALA 37 Cb -0.40 -3.40 -0.15 0.00 0.00 0.00 0.00 23.12 19.17 2djv s ALA 37 CO 1.02 -1.01 1.16 -3.47 0.00 0.00 0.00 175.76 173.46 2djv n ASP 38 N -1.54 1.58 -0.01 0.00 -0.08 -1.26 -4.75 116.55 110.49 2djv n ASP 38 Ca 0.13 1.15 -0.14 0.00 -1.51 0.00 0.00 54.79 54.42 2djv n ASP 38 Cb 0.50 -1.27 -0.08 0.00 2.34 0.00 0.00 41.12 42.61 2djv n ASP 38 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2djv h LYS 39 N 3.11 -0.52 -0.33 -0.67 6.56 -1.99 -0.10 116.57 122.62 2djv h LYS 39 Ca -0.42 0.04 0.07 0.00 -1.06 0.00 0.00 60.65 59.27 2djv h LYS 39 Cb 1.33 0.12 -0.07 0.00 -0.57 0.00 0.00 32.23 33.04 2djv h LYS 39 CO 0.68 -0.35 -0.11 -0.91 -2.06 0.00 0.00 179.45 176.70 2djv h ASN 40 N -0.54 -0.40 -0.32 0.86 2.35 -2.00 -1.45 115.58 114.08 2djv h ASN 40 Ca 0.05 0.11 0.07 0.00 -0.55 0.00 0.00 56.30 55.99 2djv h ASN 40 Cb 0.66 0.24 -0.08 0.00 0.05 0.00 0.00 38.32 39.19 2djv h ASN 40 CO -0.44 -0.15 -0.25 -0.33 -1.65 0.00 0.00 177.43 174.62 2djv h GLU 41 N -0.05 -0.21 -0.42 0.81 4.39 -1.72 -1.09 114.58 116.30 2djv h GLU 41 Ca 0.16 0.01 0.06 0.00 0.34 0.00 0.00 59.36 59.94 2djv h GLU 41 Cb 0.29 0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 28.94 2djv h GLU 41 CO -0.36 -0.14 0.08 0.28 -1.16 0.00 0.00 179.01 177.71 2djv h VAL 42 N -0.22 0.78 -0.54 3.13 2.07 -0.44 -2.15 116.25 118.89 2djv h VAL 42 Ca 0.16 -0.07 0.09 0.00 0.82 0.00 0.00 66.70 67.69 2djv h VAL 42 Cb 0.47 0.55 -0.07 0.00 -1.52 0.00 0.00 31.29 30.72 2djv h VAL 42 CO -0.45 0.04 0.16 0.00 0.02 0.00 0.00 177.57 177.34 2djv h ALA 43 N 1.31 0.65 -0.97 1.67 0.00 -0.31 -1.87 119.26 119.75 2djv h ALA 43 Ca 0.20 0.09 0.25 0.00 0.00 0.00 0.00 54.91 55.46 2djv h ALA 43 Cb 0.24 0.10 -0.18 0.00 0.00 0.00 0.00 17.79 17.95 2djv h ALA 43 CO -0.26 -0.25 -0.01 0.00 0.00 0.00 0.00 179.25 178.72 2djv h ALA 44 N 1.39 1.07 -0.15 0.00 0.00 -0.54 0.35 119.26 121.38 2djv h ALA 44 Ca 0.27 0.34 -0.13 0.00 0.00 0.00 0.00 54.91 55.38 2djv h ALA 44 Cb 0.34 0.60 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2djv h ALA 44 CO -0.31 -0.53 -0.43 0.93 0.00 0.00 0.00 179.25 178.91 2djv h GLU 45 N 0.02 0.56 -0.75 0.00 4.39 -1.38 -3.15 114.58 114.27 2djv h GLU 45 Ca 0.57 -0.40 0.11 0.00 0.34 0.00 0.00 59.36 59.98 2djv h GLU 45 Cb 1.12 0.06 -0.13 0.00 -0.10 0.00 0.00 28.75 29.71 2djv h GLU 45 CO -0.91 1.02 -0.41 0.28 -1.16 0.00 0.00 179.01 177.83 2djv h VAL 46 N 0.20 0.07 0.46 3.13 2.07 0.22 0.13 116.25 122.54 2djv h VAL 46 Ca -0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 2djv h VAL 46 Cb 1.05 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 2djv h VAL 46 CO 0.09 0.00 -0.33 0.00 0.02 0.00 0.00 177.57 177.36 2djv h ALA 47 N 0.95 -0.78 -0.80 1.67 0.00 -1.46 -2.70 119.26 116.14 2djv h ALA 47 Ca 0.24 -0.14 0.19 0.00 0.00 0.00 0.00 54.91 55.20 2djv h ALA 47 Cb 0.56 0.42 -0.13 0.00 0.00 0.00 0.00 17.79 18.64 2djv h ALA 47 CO -0.80 -0.96 0.14 -0.22 0.00 0.00 0.00 179.25 177.40 2djv h LYS 48 N -0.77 0.18 -0.46 0.00 3.11 -1.22 0.11 116.57 117.52 2djv h LYS 48 Ca -0.05 -0.01 0.09 0.00 -2.81 0.00 0.00 60.65 57.87 2djv h LYS 48 Cb 0.65 -0.04 -0.09 0.00 -1.00 0.00 0.00 32.23 31.74 2djv h LYS 48 CO 0.02 0.12 -0.16 1.25 -2.81 0.00 0.00 179.45 177.87 2djv h LEU 49 N 0.19 -0.58 -0.86 5.20 5.85 -0.46 -0.00 115.31 124.65 2djv h LEU 49 Ca 0.47 0.16 0.19 0.00 0.84 0.00 0.00 57.88 59.53 2djv h LEU 49 Cb 0.87 0.34 -0.11 0.00 0.37 0.00 0.00 40.66 42.13 2djv h LEU 49 CO -0.62 -0.20 0.39 -0.07 -0.34 0.00 0.00 178.44 177.60 2djv h LEU 50 N -0.06 0.38 -0.08 2.25 -0.00 -0.82 -0.72 115.31 116.25 2djv h LEU 50 Ca 0.22 0.13 -0.00 0.00 -0.00 0.00 0.00 57.88 58.23 2djv h LEU 50 Cb 0.40 0.09 -0.00 0.00 -0.00 0.00 0.00 40.66 41.15 2djv h LEU 50 CO -0.51 0.08 0.04 -0.78 -0.00 0.00 0.00 178.44 177.27 2djv h ASP 51 N 0.47 0.11 -0.55 -0.43 3.58 -0.88 -3.02 116.42 115.70 2djv h ASP 51 Ca 0.51 -0.12 0.11 0.00 0.42 0.00 0.00 57.03 57.95 2djv h ASP 51 Cb 0.88 -0.03 -0.11 0.00 1.72 0.00 0.00 39.33 41.79 2djv h ASP 51 CO -0.46 0.19 -0.15 -0.07 -2.88 0.00 0.00 179.24 175.87 2djv h LEU 52 N 0.02 -0.56 -0.92 2.28 3.38 -0.38 0.64 115.31 119.78 2djv h LEU 52 Ca 0.03 0.17 0.25 0.00 0.09 0.00 0.00 57.88 58.42 2djv h LEU 52 Cb 0.11 0.36 -0.14 0.00 0.09 0.00 0.00 40.66 41.08 2djv h LEU 52 CO -0.00 -0.19 0.38 0.11 0.09 0.00 0.00 178.44 178.82 2djv h LYS 53 N -0.02 0.30 0.26 1.13 1.57 -1.29 -0.53 116.57 117.99 2djv h LYS 53 Ca 0.26 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 59.01 2djv h LYS 53 Cb 0.42 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2djv h LYS 53 CO -0.57 0.20 -0.13 0.87 -0.57 0.00 0.00 179.45 179.25 2djv h LYS 54 N 0.31 -0.34 -0.61 3.15 1.57 -0.90 -1.21 116.57 118.53 2djv h LYS 54 Ca 0.60 0.02 0.18 0.00 -1.87 0.00 0.00 60.65 59.58 2djv h LYS 54 Cb 1.24 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.60 2djv h LYS 54 CO -0.60 -0.23 0.99 1.96 -0.57 0.00 0.00 179.45 181.00 2djv h GLN 55 N -0.54 0.00 0.00 3.15 4.20 -0.88 0.13 115.11 121.18 2djv h GLN 55 Ca -0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.67 2djv h GLN 55 Cb 0.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.05 2djv h GLN 55 CO 0.06 0.00 -0.08 1.25 -0.67 0.00 0.00 178.83 179.39 2djv h LEU 56 N 0.00 0.00 0.16 1.46 7.12 -1.01 -3.29 115.31 119.75 2djv h LEU 56 Ca 0.29 0.00 0.01 0.00 0.13 0.00 0.00 57.88 58.31 2djv h LEU 56 Cb 2.27 0.00 -0.04 0.00 -0.53 0.00 0.00 40.66 42.36 2djv h LEU 56 CO -0.00 0.22 -0.45 0.00 -0.13 0.00 0.00 178.44 178.08 2djv h ALA 57 N -1.64 -0.83 -1.24 1.25 0.00 0.05 -0.20 119.26 116.65 2djv h ALA 57 Ca 0.00 -0.09 0.39 0.00 0.00 0.00 0.00 54.91 55.21 2djv h ALA 57 Cb 0.08 0.74 -0.12 0.00 0.00 0.00 0.00 17.79 18.50 2djv h ALA 57 CO 0.00 -1.03 0.81 0.28 0.00 0.00 0.00 179.25 179.30 2djv h VAL 58 N -0.71 0.24 -0.01 0.00 2.07 -1.03 0.44 116.25 117.26 2djv h VAL 58 Ca 0.01 -0.06 -0.17 0.00 0.82 0.00 0.00 66.70 67.30 2djv h VAL 58 Cb 0.71 0.06 0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2djv h VAL 58 CO -0.24 0.03 -0.65 0.00 0.02 0.00 0.00 177.57 176.73 2djv h ALA 59 N 1.60 0.09 -0.19 1.67 0.00 -1.26 -3.19 119.26 117.98 2djv h ALA 59 Ca 0.75 -0.58 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2djv h ALA 59 Cb 2.28 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 20.06 2djv h ALA 59 CO -0.37 0.40 0.09 0.39 0.00 0.00 0.00 179.25 179.76 2djv n GLU 60 N -4.17 1.50 -4.39 0.00 1.02 0.14 -4.85 120.64 109.89 2djv n GLU 60 Ca -0.10 -0.68 -0.35 0.00 -0.02 0.00 0.00 57.16 56.01 2djv n GLU 60 Cb 0.69 -1.41 -0.09 0.00 -0.02 0.00 0.00 31.44 30.61 2djv n GLU 60 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2djv n GLY 61 N 0.14 -0.21 3.88 0.62 0.00 -0.39 -4.90 105.19 104.32 2djv n GLY 61 Ca 0.11 0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.96 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 -7.33 3.74 0.46 1.61 -0.14 -0.69 -5.02 119.74 112.37 2djv s LYS 62 Ca 0.28 0.17 -0.23 0.00 -1.36 0.00 0.00 55.97 54.83 2djv s LYS 62 Cb -0.16 -2.66 -0.07 0.00 -1.68 0.00 0.00 37.83 33.26 2djv s LYS 62 CO 1.01 0.29 1.16 -1.25 -0.76 0.00 0.00 175.35 175.80 2djv s PRO 63 N -3.03 3.76 0.00 -1.68 0.04 -1.26 -4.64 135.00 128.19 2djv s PRO 63 Ca 0.46 1.77 0.00 0.00 0.04 0.00 0.00 61.00 63.27 2djv s PRO 63 Cb -0.11 -2.41 0.00 0.00 0.04 0.00 0.00 34.50 32.02 2djv s PRO 63 CO 0.24 -0.55 0.00 -0.35 0.04 0.00 0.00 177.00 176.38 2djv n PRO 64 N -0.49 0.02 -0.89 0.56 -0.04 -1.26 -4.81 135.00 128.09 2djv n PRO 64 Ca 0.07 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.43 2djv n PRO 64 Cb 0.48 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.79 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 -0.73 1.79 -0.49 0.54 1.02 -1.26 -4.89 120.64 116.62 2djv n GLU 65 Ca 0.00 -0.88 -0.08 0.00 -0.02 0.00 0.00 57.16 56.18 2djv n GLU 65 Cb 0.00 -1.93 -0.07 0.00 -0.02 0.00 0.00 31.44 29.42 2djv n GLU 65 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2djv n ALA 66 N 2.53 0.34 -1.22 0.62 0.00 -1.26 -4.80 120.51 116.72 2djv n ALA 66 Ca 0.38 -0.25 -0.30 0.00 0.00 0.00 0.00 53.44 53.27 2djv n ALA 66 Cb 0.82 -0.78 0.12 0.00 0.00 0.00 0.00 19.45 19.62 2djv n ALA 66 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2djv s PRO 67 N 2.34 1.58 -0.26 0.00 0.04 -1.26 -4.88 135.00 132.56 2djv s PRO 67 Ca 0.43 0.94 -0.41 0.00 0.04 0.00 0.00 61.00 62.00 2djv s PRO 67 Cb -0.29 -1.84 -0.17 0.00 0.04 0.00 0.00 34.50 32.24 2djv s PRO 67 CO 0.18 -2.05 1.61 1.63 0.04 0.00 0.00 177.00 178.42 2djv n LYS 68 N -3.77 0.81 0.00 4.56 4.76 -1.26 -4.50 118.16 118.76 2djv n LYS 68 Ca 0.08 0.30 0.00 0.00 -2.87 0.00 0.00 58.31 55.81 2djv n LYS 68 Cb 0.54 -1.92 0.00 0.00 -1.84 0.00 0.00 35.03 31.81 2djv n LYS 68 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2djv n GLY 69 N 3.76 -1.87 3.28 0.72 0.00 -1.26 -5.15 105.19 104.66 2djv n GLY 69 Ca 0.26 0.77 -0.13 0.00 0.00 0.00 0.00 46.02 46.92 2djv n GLY 69 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2djv s LYS 70 N 0.00 0.46 0.46 1.61 -2.85 -1.26 -5.16 119.74 112.99 2djv s LYS 70 Ca 0.00 0.50 -0.12 0.00 -1.00 0.00 0.00 55.97 55.35 2djv s LYS 70 Cb 0.00 0.22 -0.07 0.00 -2.06 0.00 0.00 37.83 35.93 2djv s LYS 70 CO 0.00 -0.06 0.86 -1.59 0.10 0.00 0.00 175.35 174.66 2djv s LYS 71 N 0.13 3.81 -0.47 1.78 0.00 -1.26 -5.05 119.74 118.68 2djv s LYS 71 Ca -0.01 0.63 0.03 0.00 0.00 0.00 0.00 55.97 56.62 2djv s LYS 71 Cb -0.03 -2.29 0.14 0.00 0.00 0.00 0.00 37.83 35.65 2djv s LYS 71 CO 0.01 -0.16 0.26 0.21 0.00 0.00 0.00 175.35 175.67 2djv s LYS 72 N -4.06 1.44 -0.84 1.78 2.47 -1.26 -5.01 119.74 114.26 2djv s LYS 72 Ca 0.54 -2.18 0.01 0.00 -1.56 0.00 0.00 55.97 52.78 2djv s LYS 72 Cb -0.10 -2.50 0.27 0.00 -1.46 0.00 0.00 37.83 34.05 2djv s LYS 72 CO 0.34 -1.17 1.06 1.63 0.16 0.00 0.00 175.35 177.36 2djv n LYS 73 N 3.35 3.36 0.02 4.03 4.76 -1.26 -4.85 118.16 127.57 2djv n LYS 73 Ca 0.10 -4.62 -0.11 0.00 -2.87 0.00 0.00 58.31 50.81 2djv n LYS 73 Cb 0.35 -2.37 -0.08 0.00 -1.84 0.00 0.00 35.03 31.09 2djv n LYS 73 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2djv h SER 74 N 4.78 -0.12 -4.12 4.39 4.64 -2.01 -3.45 113.55 117.66 2djv h SER 74 Ca 0.20 -0.45 -0.50 0.00 -0.47 0.00 0.00 61.79 60.57 2djv h SER 74 Cb 0.65 0.03 0.07 0.00 -0.31 0.00 0.00 62.40 62.83 2djv h SER 74 CO 1.05 0.51 0.40 -0.83 -0.87 0.00 0.00 176.83 177.09 2djv s GLY 75 N -3.47 2.45 -0.02 -0.77 0.00 -1.26 -4.98 107.32 99.26 2djv s GLY 75 Ca -0.13 0.67 -0.25 0.00 0.00 0.00 0.00 44.72 45.00 2djv s GLY 75 CO 0.49 1.01 1.27 -0.56 0.00 0.00 0.00 173.10 175.31 2djv h PRO 76 N 0.94 0.03 -5.88 2.90 0.13 -2.03 -3.44 132.00 124.66 2djv h PRO 76 Ca -0.49 -0.02 -0.68 0.00 -0.87 0.00 0.00 66.00 63.95 2djv h PRO 76 Cb 1.24 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.13 2djv h PRO 76 CO 0.57 0.51 -0.76 0.45 -0.23 0.00 0.00 178.00 178.54 2djv s SER 77 N -5.73 4.09 -0.76 1.44 0.15 -1.26 -5.06 113.70 106.57 2djv s SER 77 Ca -0.16 -0.23 -0.26 0.00 0.70 0.00 0.00 55.95 56.00 2djv s SER 77 Cb 0.02 -1.20 -0.02 0.00 -1.71 0.00 0.00 66.02 63.11 2djv s SER 77 CO 0.68 0.27 1.78 -0.44 1.20 0.00 0.00 173.24 176.73 2djv s SER 78 N -0.27 5.45 0.00 5.45 0.01 -1.26 -5.15 113.70 117.93 2djv s SER 78 Ca 0.02 -0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.03 2djv s SER 78 Cb -0.13 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.55 2djv s SER 78 CO 0.03 -2.36 0.00 0.61 0.41 0.00 0.00 173.24 171.93