#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 -0.54 0.28 1.61 1.04 -1.26 -5.04 113.70 109.79 2djv s SER 2 Ca 0.00 0.63 0.00 0.00 0.48 0.00 0.00 55.95 57.06 2djv s SER 2 Cb 0.00 0.50 0.64 0.00 0.10 0.00 0.00 66.02 67.26 2djv s SER 2 CO 0.00 -0.46 1.67 0.77 0.98 0.00 0.00 173.24 176.20 2djv h SER 3 N 2.96 0.10 0.00 7.02 4.64 -2.12 -3.46 113.55 122.70 2djv h SER 3 Ca -0.24 0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2djv h SER 3 Cb 1.15 0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 2djv h SER 3 CO 0.33 -0.08 0.00 0.61 -0.87 0.00 0.00 176.83 176.82 2djv n GLY 4 N -1.36 0.67 0.17 -0.77 0.00 -1.26 -5.07 105.19 97.58 2djv n GLY 4 Ca 0.19 -0.72 -0.11 0.00 0.00 0.00 0.00 46.02 45.38 2djv n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2djv h SER 5 N 0.00 -0.29 -1.79 1.61 4.64 -2.04 -3.40 113.55 112.28 2djv h SER 5 Ca 0.00 -0.24 -0.47 0.00 -0.47 0.00 0.00 61.79 60.61 2djv h SER 5 Cb 0.00 0.07 -0.04 0.00 -0.31 0.00 0.00 62.40 62.12 2djv h SER 5 CO 0.00 0.18 1.23 -0.55 -0.87 0.00 0.00 176.83 176.83 2djv s SER 6 N -5.25 5.36 0.00 4.97 0.15 -1.26 -4.85 113.70 112.81 2djv s SER 6 Ca -0.13 0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.59 2djv s SER 6 Cb 0.01 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 2djv s SER 6 CO 0.47 -2.37 0.00 0.61 1.20 0.00 0.00 173.24 173.14 2djv n GLY 7 N 5.88 0.27 1.70 9.45 0.00 -1.26 -4.83 105.19 116.40 2djv n GLY 7 Ca 0.22 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.14 2djv n GLY 7 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2djv n THR 8 N 0.00 2.37 -0.14 2.61 -2.24 -1.26 -3.66 114.28 111.96 2djv n THR 8 Ca 0.00 -1.15 -0.29 0.00 -2.27 0.00 0.00 64.05 60.34 2djv n THR 8 Cb 0.00 -1.30 -0.10 0.00 -2.10 0.00 0.00 70.33 66.83 2djv n THR 8 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2djv n THR 9 N 0.61 1.53 -3.22 4.28 -2.24 -1.26 -4.96 114.28 109.02 2djv n THR 9 Ca 0.20 -0.35 -0.38 0.00 -2.27 0.00 0.00 64.05 61.24 2djv n THR 9 Cb 0.60 -1.90 -0.06 0.00 -2.10 0.00 0.00 70.33 66.87 2djv n THR 9 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2djv s ALA 10 N -2.51 3.55 0.03 6.98 0.00 -1.26 -4.98 121.76 123.57 2djv s ALA 10 Ca -0.38 0.08 -0.31 0.00 0.00 0.00 0.00 51.96 51.35 2djv s ALA 10 Cb 0.14 -2.69 -0.17 0.00 0.00 0.00 0.00 23.12 20.40 2djv s ALA 10 CO 0.50 0.38 1.28 0.87 0.00 0.00 0.00 175.76 178.79 2djv h LYS 11 N 4.27 -1.07 0.00 0.00 1.79 -1.93 0.14 116.57 119.78 2djv h LYS 11 Ca -0.49 0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.05 2djv h LYS 11 Cb 1.21 0.24 0.00 0.00 -1.58 0.00 0.00 32.23 32.10 2djv h LYS 11 CO 0.64 -0.71 0.00 -0.35 -1.08 0.00 0.00 179.45 177.95 2djv n PRO 12 N -5.51 0.48 -0.12 3.15 -0.04 -1.26 -3.04 135.00 128.67 2djv n PRO 12 Ca -0.14 0.01 -0.23 0.00 -0.04 0.00 0.00 63.50 63.10 2djv n PRO 12 Cb 0.44 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.31 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 -1.01 0.51 0.06 0.54 -0.06 -1.08 -4.49 117.38 111.85 2djv n GLN 13 Ca 0.12 0.20 0.11 0.00 -2.00 0.00 0.00 57.00 55.42 2djv n GLN 13 Cb 0.06 -1.36 0.57 0.00 -4.06 0.00 0.00 30.24 25.44 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 -0.65 0.22 -0.52 3.69 3.07 -0.64 -2.94 115.11 117.35 2djv h GLN 14 Ca -0.57 -0.01 0.05 0.00 0.09 0.00 0.00 58.65 58.21 2djv h GLN 14 Cb 1.58 -0.05 -0.08 0.00 0.08 0.00 0.00 27.48 29.01 2djv h GLN 14 CO -0.30 0.15 -0.50 0.82 0.09 0.00 0.00 178.83 179.09 2djv h ILE 15 N 0.23 0.00 -0.73 1.86 2.04 -1.76 0.26 117.51 119.41 2djv h ILE 15 Ca 0.16 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.18 2djv h ILE 15 Cb 0.33 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.28 2djv h ILE 15 CO -0.03 0.00 -0.05 -0.61 0.00 0.00 0.00 178.15 177.46 2djv h GLN 16 N -0.25 0.07 -0.18 2.37 5.75 -1.78 0.08 115.11 121.17 2djv h GLN 16 Ca 0.09 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.58 2djv h GLN 16 Cb 0.48 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.01 2djv h GLN 16 CO -0.62 0.05 0.11 0.00 -2.65 0.00 0.00 178.83 175.72 2djv h ALA 17 N 1.69 0.23 -0.22 3.38 0.00 -1.10 -2.55 119.26 120.70 2djv h ALA 17 Ca 0.38 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.32 2djv h ALA 17 Cb 0.65 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.29 2djv h ALA 17 CO -0.67 -0.27 -0.34 -0.07 0.00 0.00 0.00 179.25 177.89 2djv h LEU 18 N 0.23 -1.09 -0.93 0.00 3.38 0.13 0.25 115.31 117.28 2djv h LEU 18 Ca 0.07 0.17 0.15 0.00 0.09 0.00 0.00 57.88 58.35 2djv h LEU 18 Cb 0.00 0.47 -0.09 0.00 0.09 0.00 0.00 40.66 41.13 2djv h LEU 18 CO -0.01 -0.36 0.54 0.24 0.09 0.00 0.00 178.44 178.94 2djv h MET 19 N -0.37 0.76 0.03 1.13 2.86 -1.20 -1.72 114.93 116.42 2djv h MET 19 Ca 0.11 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.71 2djv h MET 19 Cb 0.56 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.05 2djv h MET 19 CO -0.42 0.50 -0.01 0.22 1.06 0.00 0.00 176.91 178.26 2djv h ASP 20 N 0.78 -0.03 -0.31 1.22 1.82 -0.68 -3.11 116.42 116.10 2djv h ASP 20 Ca 0.50 -0.12 0.06 0.00 -0.39 0.00 0.00 57.03 57.09 2djv h ASP 20 Cb 0.65 0.01 -0.08 0.00 0.68 0.00 0.00 39.33 40.59 2djv h ASP 20 CO -0.33 0.10 -0.39 -0.33 -1.61 0.00 0.00 179.24 176.68 2djv h GLU 21 N -0.16 -0.34 -0.94 0.28 4.39 -0.12 -0.02 114.58 117.67 2djv h GLU 21 Ca -0.00 0.02 0.29 0.00 0.34 0.00 0.00 59.36 60.01 2djv h GLU 21 Cb 0.15 0.08 -0.15 0.00 -0.10 0.00 0.00 28.75 28.72 2djv h GLU 21 CO 0.01 -0.23 0.36 0.28 -1.16 0.00 0.00 179.01 178.27 2djv h VAL 22 N -0.35 0.25 0.26 3.13 2.07 -1.41 0.48 116.25 120.68 2djv h VAL 22 Ca 0.13 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 2djv h VAL 22 Cb 0.58 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 2djv h VAL 22 CO -0.50 0.04 -0.12 0.74 0.02 0.00 0.00 177.57 177.74 2djv h THR 23 N 0.21 0.00 0.31 2.57 2.02 -0.95 0.55 112.91 117.62 2djv h THR 23 Ca 0.65 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 67.77 2djv h THR 23 Cb 1.43 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 2djv h THR 23 CO -0.67 0.00 -0.32 0.50 0.37 0.00 0.00 175.52 175.40 2djv h LYS 24 N -0.39 -0.61 -1.08 6.66 1.63 -0.78 -0.87 116.57 121.13 2djv h LYS 24 Ca -0.04 0.04 0.29 0.00 -0.85 0.00 0.00 60.65 60.10 2djv h LYS 24 Cb 0.26 0.14 -0.09 0.00 -0.60 0.00 0.00 32.23 31.94 2djv h LYS 24 CO 0.06 -0.41 0.71 0.37 -3.45 0.00 0.00 179.45 176.73 2djv h GLN 25 N -0.63 0.29 -0.01 1.90 5.75 -0.19 0.26 115.11 122.48 2djv h GLN 25 Ca -0.04 -0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.44 2djv h GLN 25 Cb 0.55 -0.07 -0.00 0.00 1.07 0.00 0.00 27.48 29.03 2djv h GLN 25 CO -0.04 0.19 0.00 0.78 -2.65 0.00 0.00 178.83 177.11 2djv h GLY 26 N 0.30 0.02 1.68 2.39 0.00 -0.15 -2.42 103.07 104.88 2djv h GLY 26 Ca 0.60 -0.01 -0.12 0.00 0.00 0.00 0.00 47.33 47.80 2djv h GLY 26 CO -0.26 0.01 -0.44 3.45 0.00 0.00 0.00 176.54 179.30 2djv h ASN 27 N -0.26 0.38 -0.74 0.19 7.08 0.32 -2.64 115.58 119.90 2djv h ASN 27 Ca 0.00 -0.17 0.00 0.00 -3.08 0.00 0.00 56.30 53.05 2djv h ASN 27 Cb 0.29 -0.11 -0.04 0.00 -2.08 0.00 0.00 38.32 36.39 2djv h ASN 27 CO 0.00 0.78 0.48 0.40 -2.08 0.00 0.00 177.43 177.01 2djv h ILE 28 N 0.29 1.20 -0.23 6.14 2.04 -0.52 -0.91 117.51 125.52 2djv h ILE 28 Ca 0.02 -0.38 -0.09 0.00 1.00 0.00 0.00 64.86 65.41 2djv h ILE 28 Cb 0.90 0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 2djv h ILE 28 CO 0.07 0.19 -0.22 0.58 0.00 0.00 0.00 178.15 178.78 2djv h VAL 29 N 1.01 1.32 -0.07 1.67 2.07 -1.34 -1.92 116.25 118.98 2djv h VAL 29 Ca 0.27 -1.38 0.02 0.00 0.82 0.00 0.00 66.70 66.43 2djv h VAL 29 Cb -0.09 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 2djv h VAL 29 CO -0.06 0.43 -0.05 -0.09 0.02 0.00 0.00 177.57 177.82 2djv h ARG 30 N 0.25 -0.06 -0.69 1.57 9.65 -1.23 -2.57 114.38 121.29 2djv h ARG 30 Ca 0.04 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.90 2djv h ARG 30 Cb 0.77 0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 29.33 2djv h ARG 30 CO 0.05 -0.04 0.36 1.05 2.80 0.00 0.00 179.97 184.20 2djv h GLU 31 N -0.06 0.98 -0.53 0.20 4.11 -1.20 -2.52 114.58 115.56 2djv h GLU 31 Ca 0.05 -0.13 0.10 0.00 0.07 0.00 0.00 59.36 59.45 2djv h GLU 31 Cb 0.13 -0.19 -0.11 0.00 0.50 0.00 0.00 28.75 29.09 2djv h GLU 31 CO -0.11 0.75 -0.24 -0.07 0.07 0.00 0.00 179.01 179.41 2djv h LEU 32 N 0.96 -0.85 -0.88 3.06 3.38 -0.96 0.24 115.31 120.27 2djv h LEU 32 Ca 0.24 0.19 -0.06 0.00 0.09 0.00 0.00 57.88 58.35 2djv h LEU 32 Cb 0.07 0.46 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 2djv h LEU 32 CO -0.04 -0.26 0.18 0.11 0.09 0.00 0.00 178.44 178.52 2djv h LYS 33 N -0.12 1.01 -0.83 1.13 1.57 -1.31 -0.14 116.57 117.88 2djv h LYS 33 Ca 0.24 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 2djv h LYS 33 Cb 0.50 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.62 2djv h LYS 33 CO -0.61 0.88 0.43 0.00 -0.57 0.00 0.00 179.45 179.59 2djv h ALA 34 N 1.23 1.20 -0.25 3.86 0.00 -0.47 -1.82 119.26 123.00 2djv h ALA 34 Ca 0.21 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 2djv h ALA 34 Cb 0.31 -0.33 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 2djv h ALA 34 CO -0.00 0.63 0.13 0.00 0.00 0.00 0.00 179.25 180.01 2djv n GLN 35 N -4.33 1.59 -4.17 0.00 10.64 0.61 -4.85 117.38 116.87 2djv n GLN 35 Ca 0.09 -0.88 -0.30 0.00 -1.83 0.00 0.00 57.00 54.07 2djv n GLN 35 Cb 0.11 -1.45 -0.06 0.00 -0.86 0.00 0.00 30.24 27.98 2djv n GLN 35 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2djv n LYS 36 N 0.07 -2.16 -1.03 2.61 5.02 -0.68 -4.90 118.16 117.08 2djv n LYS 36 Ca 0.15 0.26 -0.29 0.00 -2.02 0.00 0.00 58.31 56.40 2djv n LYS 36 Cb 0.75 -4.24 0.17 0.00 -0.02 0.00 0.00 35.03 31.69 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 -4.00 0.99 0.10 7.82 0.00 -0.09 -4.96 121.76 121.63 2djv s ALA 37 Ca 0.15 -0.11 -0.31 0.00 0.00 0.00 0.00 51.96 51.69 2djv s ALA 37 Cb -0.09 -3.20 -0.07 0.00 0.00 0.00 0.00 23.12 19.76 2djv s ALA 37 CO 0.95 -2.80 1.29 0.34 0.00 0.00 0.00 175.76 175.54 2djv s ASP 38 N -3.21 6.95 0.24 0.00 -1.08 -1.26 -4.90 116.67 113.41 2djv s ASP 38 Ca 0.65 2.20 -0.06 0.00 -0.52 0.00 0.00 52.55 54.82 2djv s ASP 38 Cb -0.20 -2.59 0.43 0.00 -1.46 0.00 0.00 42.92 39.10 2djv s ASP 38 CO 0.59 -0.55 1.67 0.50 0.52 0.00 0.00 175.17 177.90 2djv h LYS 39 N 6.58 0.21 -0.19 4.34 3.11 -1.99 0.15 116.57 128.78 2djv h LYS 39 Ca -0.42 -0.01 -0.00 0.00 -2.81 0.00 0.00 60.65 57.40 2djv h LYS 39 Cb 1.21 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 32.39 2djv h LYS 39 CO 0.83 0.14 0.11 -2.95 -2.81 0.00 0.00 179.45 174.77 2djv h ASN 40 N 0.22 0.23 -0.02 4.20 -1.07 -2.00 -0.83 115.58 116.31 2djv h ASN 40 Ca 0.40 -0.07 0.01 0.00 0.07 0.00 0.00 56.30 56.71 2djv h ASN 40 Cb 0.67 -0.06 -0.01 0.00 -2.07 0.00 0.00 38.32 36.85 2djv h ASN 40 CO -0.53 0.23 -0.04 -0.33 0.07 0.00 0.00 177.43 176.83 2djv h GLU 41 N 0.21 -0.07 -0.55 4.14 5.08 -1.53 -2.73 114.58 119.13 2djv h GLU 41 Ca 0.07 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.48 2djv h GLU 41 Cb 0.05 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.27 2djv h GLU 41 CO -0.01 -0.05 0.29 0.28 -1.00 0.00 0.00 179.01 178.52 2djv h VAL 42 N -0.07 0.97 -0.72 3.13 2.07 -0.66 -2.53 116.25 118.43 2djv h VAL 42 Ca 0.02 -0.19 0.15 0.00 0.82 0.00 0.00 66.70 67.50 2djv h VAL 42 Cb 0.11 0.36 -0.14 0.00 -1.52 0.00 0.00 31.29 30.10 2djv h VAL 42 CO -0.06 0.10 -0.15 0.00 0.02 0.00 0.00 177.57 177.48 2djv h ALA 43 N 1.29 0.53 -0.62 1.67 0.00 -0.84 0.23 119.26 121.51 2djv h ALA 43 Ca 0.24 0.27 0.11 0.00 0.00 0.00 0.00 54.91 55.53 2djv h ALA 43 Cb 0.14 0.53 -0.12 0.00 0.00 0.00 0.00 17.79 18.33 2djv h ALA 43 CO -0.16 -0.42 -0.36 0.00 0.00 0.00 0.00 179.25 178.32 2djv h ALA 44 N 1.72 -0.07 -0.28 0.00 0.00 -1.31 -0.12 119.26 119.18 2djv h ALA 44 Ca 0.36 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.40 2djv h ALA 44 Cb 0.56 0.83 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 2djv h ALA 44 CO -0.73 -0.70 0.04 0.93 0.00 0.00 0.00 179.25 178.80 2djv h GLU 45 N -0.16 0.47 -0.28 0.00 4.39 -1.19 -2.87 114.58 114.94 2djv h GLU 45 Ca 0.23 -0.13 0.04 0.00 0.34 0.00 0.00 59.36 59.85 2djv h GLU 45 Cb 0.56 -0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 29.08 2djv h GLU 45 CO -0.71 0.58 -0.54 0.28 -1.16 0.00 0.00 179.01 177.47 2djv h VAL 46 N 0.29 0.01 -0.03 3.13 2.07 0.40 0.19 116.25 122.31 2djv h VAL 46 Ca 0.09 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.64 2djv h VAL 46 Cb 0.34 0.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.07 2djv h VAL 46 CO 0.01 0.00 -0.40 0.00 0.02 0.00 0.00 177.57 177.19 2djv h ALA 47 N -0.11 -0.61 -0.30 1.67 0.00 -1.10 -1.78 119.26 117.02 2djv h ALA 47 Ca 0.06 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.01 2djv h ALA 47 Cb 0.64 0.72 -0.08 0.00 0.00 0.00 0.00 17.79 19.06 2djv h ALA 47 CO -0.52 -0.93 -0.32 -0.22 0.00 0.00 0.00 179.25 177.27 2djv h LYS 48 N -0.54 -0.28 -0.65 0.00 3.64 -1.19 -1.35 116.57 116.20 2djv h LYS 48 Ca 0.06 0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.59 2djv h LYS 48 Cb 0.63 0.06 -0.12 0.00 -0.41 0.00 0.00 32.23 32.40 2djv h LYS 48 CO -0.33 -0.19 -0.12 1.25 -2.27 0.00 0.00 179.45 177.79 2djv h LEU 49 N -0.29 -0.53 -0.82 5.20 5.85 -0.19 0.16 115.31 124.69 2djv h LEU 49 Ca 0.15 0.19 0.12 0.00 0.84 0.00 0.00 57.88 59.18 2djv h LEU 49 Cb 0.53 0.37 -0.08 0.00 0.37 0.00 0.00 40.66 41.85 2djv h LEU 49 CO -0.47 -0.20 0.43 -0.07 -0.34 0.00 0.00 178.44 177.80 2djv h LEU 50 N 0.02 0.55 -1.07 2.25 3.38 -0.40 -0.12 115.31 119.92 2djv h LEU 50 Ca 0.32 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.33 2djv h LEU 50 Cb 0.50 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 2djv h LEU 50 CO -0.64 0.27 0.23 0.44 0.09 0.00 0.00 178.44 178.82 2djv h ASP 51 N 0.66 0.81 0.17 -0.43 3.32 -0.19 -2.05 116.42 118.71 2djv h ASP 51 Ca 0.43 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.33 2djv h ASP 51 Cb 0.53 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.87 2djv h ASP 51 CO -0.32 0.74 -0.16 -0.07 -1.72 0.00 0.00 179.24 177.71 2djv h LEU 52 N 0.87 0.00 -0.79 1.55 3.38 -0.06 0.35 115.31 120.61 2djv h LEU 52 Ca 0.20 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.07 2djv h LEU 52 Cb 0.19 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2djv h LEU 52 CO -0.02 0.16 -0.20 0.11 0.09 0.00 0.00 178.44 178.58 2djv h LYS 53 N 0.00 0.69 0.06 1.13 1.57 -0.89 -1.65 116.57 117.48 2djv h LYS 53 Ca -0.00 -0.26 -0.31 0.00 -1.87 0.00 0.00 60.65 58.21 2djv h LYS 53 Cb 0.28 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 2djv h LYS 53 CO 0.02 0.84 -1.66 1.57 -0.57 0.00 0.00 179.45 179.66 2djv h LYS 54 N 0.61 0.14 -0.70 3.15 2.10 -1.33 -3.28 116.57 117.25 2djv h LYS 54 Ca 0.09 -0.23 -0.05 0.00 -2.00 0.00 0.00 60.65 58.46 2djv h LYS 54 Cb 0.68 0.09 -0.03 0.00 -0.90 0.00 0.00 32.23 32.06 2djv h LYS 54 CO 0.05 0.88 0.25 1.96 -2.00 0.00 0.00 179.45 180.59 2djv h GLN 55 N 0.04 1.07 0.42 0.07 4.20 -0.30 -2.73 115.11 117.89 2djv h GLN 55 Ca -0.28 -0.21 -0.02 0.00 0.06 0.00 0.00 58.65 58.20 2djv h GLN 55 Cb 2.00 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 29.62 2djv h GLN 55 CO 0.11 0.90 -0.20 1.25 -0.67 0.00 0.00 178.83 180.22 2djv h LEU 56 N 1.01 -0.48 -0.96 1.46 6.46 -1.44 -2.91 115.31 118.44 2djv h LEU 56 Ca 0.23 0.02 0.15 0.00 -0.12 0.00 0.00 57.88 58.16 2djv h LEU 56 Cb 0.26 0.12 -0.16 0.00 -0.73 0.00 0.00 40.66 40.16 2djv h LEU 56 CO -0.01 -0.30 -0.37 0.00 -0.62 0.00 0.00 178.44 177.14 2djv n ALA 57 N -2.35 -0.09 -0.29 1.25 0.00 -1.23 0.95 120.51 118.74 2djv n ALA 57 Ca -0.07 0.97 0.11 0.00 0.00 0.00 0.00 53.44 54.44 2djv n ALA 57 Cb 0.22 -0.44 0.27 0.00 0.00 0.00 0.00 19.45 19.50 2djv n ALA 57 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2djv h VAL 58 N 0.00 0.52 0.55 0.00 2.07 -1.27 0.31 116.25 118.44 2djv h VAL 58 Ca 0.34 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.70 2djv h VAL 58 Cb 0.58 0.08 0.01 0.00 -1.52 0.00 0.00 31.29 30.44 2djv h VAL 58 CO -0.96 0.07 -0.26 0.00 0.02 0.00 0.00 177.57 176.44 2djv h ALA 59 N 1.67 -0.74 -0.98 1.67 0.00 0.79 -3.13 119.26 118.53 2djv h ALA 59 Ca 0.52 -0.20 0.16 0.00 0.00 0.00 0.00 54.91 55.39 2djv h ALA 59 Cb 0.93 0.29 -0.09 0.00 0.00 0.00 0.00 17.79 18.91 2djv h ALA 59 CO -0.50 -0.78 0.61 0.93 0.00 0.00 0.00 179.25 179.52 2djv h GLU 60 N -1.02 0.79 0.00 0.00 5.08 -0.54 -3.46 114.58 115.43 2djv h GLU 60 Ca -0.08 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 2djv h GLU 60 Cb 0.64 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2djv h GLU 60 CO 0.12 0.53 0.00 0.41 -1.00 0.00 0.00 179.01 179.07 2djv n GLY 61 N -1.37 1.87 3.34 -3.84 0.00 0.85 -5.10 105.19 100.95 2djv n GLY 61 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 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 0.00 1.38 0.51 1.61 3.01 0.26 -4.99 119.74 121.51 2djv s LYS 62 Ca 0.00 -1.23 -0.21 0.00 -1.01 0.00 0.00 55.97 53.52 2djv s LYS 62 Cb 0.00 -1.74 -0.06 0.00 -1.01 0.00 0.00 37.83 35.02 2djv s LYS 62 CO 0.00 0.42 1.14 -1.25 0.51 0.00 0.00 175.35 176.17 2djv s PRO 63 N -1.84 3.51 0.54 -1.68 0.04 -1.26 -2.70 135.00 131.61 2djv s PRO 63 Ca 0.11 1.67 -0.09 0.00 0.04 0.00 0.00 61.00 62.73 2djv s PRO 63 Cb -0.10 -2.15 0.13 0.00 0.04 0.00 0.00 34.50 32.42 2djv s PRO 63 CO 0.05 -0.73 0.48 -0.35 0.04 0.00 0.00 177.00 176.48 2djv n PRO 64 N -0.99 -1.96 -0.26 0.56 -0.04 -1.26 -4.84 135.00 126.20 2djv n PRO 64 Ca 0.10 -0.77 0.05 0.00 -0.04 0.00 0.00 63.50 62.84 2djv n PRO 64 Cb 0.50 -0.72 0.11 0.00 -0.04 0.00 0.00 33.50 33.35 2djv n PRO 64 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2djv n GLU 65 N -2.98 -0.06 -3.40 0.54 0.28 -1.26 -4.80 120.64 108.96 2djv n GLU 65 Ca 0.07 1.12 -0.17 0.00 -0.16 0.00 0.00 57.16 58.01 2djv n GLU 65 Cb 0.26 -1.68 0.08 0.00 1.43 0.00 0.00 31.44 31.53 2djv n GLU 65 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2djv n ALA 66 N -3.69 -2.20 0.41 -1.84 0.00 -1.26 -4.88 120.51 107.05 2djv n ALA 66 Ca 0.12 -0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.66 2djv n ALA 66 Cb 0.38 -3.59 0.45 0.00 0.00 0.00 0.00 19.45 16.69 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 -3.84 0.15 -2.28 0.00 -0.04 -1.26 -4.72 135.00 123.01 2djv n PRO 67 Ca -0.21 0.39 -0.42 0.00 -0.04 0.00 0.00 63.50 63.22 2djv n PRO 67 Cb 0.65 -1.80 -0.03 0.00 -0.04 0.00 0.00 33.50 32.29 2djv n PRO 67 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2djv s LYS 68 N -3.26 4.28 0.00 0.54 1.02 -1.26 -4.87 119.74 116.20 2djv s LYS 68 Ca 0.05 1.88 0.00 0.00 0.02 0.00 0.00 55.97 57.92 2djv s LYS 68 Cb 0.09 -3.64 0.00 0.00 -0.52 0.00 0.00 37.83 33.77 2djv s LYS 68 CO 0.36 -0.59 0.00 0.41 -0.92 0.00 0.00 175.35 174.61 2djv n GLY 69 N 3.63 1.09 4.02 -3.33 0.00 -1.26 -5.04 105.19 104.30 2djv n GLY 69 Ca 0.13 -1.97 -0.31 0.00 0.00 0.00 0.00 46.02 43.87 2djv n GLY 69 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2djv n LYS 70 N -1.92 -4.35 -4.27 1.61 3.00 -1.26 -4.96 118.16 106.01 2djv n LYS 70 Ca 0.00 0.49 -0.27 0.00 -0.00 0.00 0.00 58.31 58.53 2djv n LYS 70 Cb 0.00 -5.20 -0.09 0.00 0.00 0.00 0.00 35.03 29.74 2djv n LYS 70 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 2djv s LYS 71 N -6.68 2.09 0.15 1.64 -2.85 -1.26 -5.05 119.74 107.78 2djv s LYS 71 Ca 0.56 -1.22 0.00 0.00 -1.00 0.00 0.00 55.97 54.30 2djv s LYS 71 Cb -0.29 -2.19 0.00 0.00 -2.06 0.00 0.00 37.83 33.29 2djv s LYS 71 CO 0.87 0.45 0.00 1.63 0.10 0.00 0.00 175.35 178.40 2djv n LYS 72 N 0.11 0.00 -4.31 1.78 5.02 -1.26 -5.02 118.16 114.48 2djv n LYS 72 Ca -0.11 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.81 2djv n LYS 72 Cb 0.55 -0.34 -0.05 0.00 -0.02 0.00 0.00 35.03 35.17 2djv n LYS 72 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2djv n LYS 73 N -3.42 -2.27 -2.84 1.97 0.00 -1.26 -4.89 118.16 105.45 2djv n LYS 73 Ca 0.00 0.28 -0.37 0.00 0.00 0.00 0.00 58.31 58.22 2djv n LYS 73 Cb 0.04 -4.82 -0.06 0.00 0.00 0.00 0.00 35.03 30.19 2djv n LYS 73 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 2djv s SER 74 N -3.46 7.33 0.00 3.14 0.01 -1.26 -4.91 113.70 114.55 2djv s SER 74 Ca 0.65 1.77 0.00 0.00 1.31 0.00 0.00 55.95 59.68 2djv s SER 74 Cb -0.36 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.32 2djv s SER 74 CO 0.96 -0.00 0.00 0.61 0.41 0.00 0.00 173.24 175.22 2djv n GLY 75 N 0.77 -1.21 0.00 3.44 0.00 -1.26 -4.95 105.19 101.99 2djv n GLY 75 Ca 0.00 0.59 0.08 0.00 0.00 0.00 0.00 46.02 46.69 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 0.00 0.48 -2.28 1.61 -0.04 -1.26 -4.76 135.00 128.75 2djv n PRO 76 Ca 0.00 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.20 2djv n PRO 76 Cb 0.00 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.09 2djv n PRO 76 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2djv s SER 77 N -2.02 3.96 1.15 3.54 0.15 -1.26 -5.07 113.70 114.16 2djv s SER 77 Ca 0.23 0.01 -0.14 0.00 0.70 0.00 0.00 55.95 56.74 2djv s SER 77 Cb 0.11 -0.31 0.27 0.00 -1.71 0.00 0.00 66.02 64.38 2djv s SER 77 CO 0.18 -2.14 1.05 -0.94 1.20 0.00 0.00 173.24 172.58 2djv s SER 78 N -4.76 1.22 0.00 5.45 1.04 -1.26 -5.14 113.70 110.25 2djv s SER 78 Ca 0.68 1.21 0.00 0.00 0.48 0.00 0.00 55.95 58.32 2djv s SER 78 Cb -0.06 -1.86 0.00 0.00 0.10 0.00 0.00 66.02 64.20 2djv s SER 78 CO 0.48 -4.01 0.02 0.61 0.98 0.00 0.00 173.24 171.32