#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 6.32 -0.10 1.61 0.15 -1.26 -4.92 113.70 115.51 2djv s SER 2 Ca 0.00 -0.31 -0.18 0.00 0.70 0.00 0.00 55.95 56.16 2djv s SER 2 Cb 0.00 -2.31 -0.28 0.00 -1.71 0.00 0.00 66.02 61.72 2djv s SER 2 CO 0.00 -0.75 0.64 0.28 1.20 0.00 0.00 173.24 174.61 2djv h SER 3 N 8.83 0.37 -2.33 5.45 0.02 -2.08 -3.50 113.55 120.30 2djv h SER 3 Ca -0.26 -0.87 0.11 0.00 -0.84 0.00 0.00 61.79 59.93 2djv h SER 3 Cb 1.10 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.49 2djv h SER 3 CO 0.88 1.53 -0.14 0.61 -1.14 0.00 0.00 176.83 178.57 2djv n GLY 4 N 1.70 -1.48 3.54 -3.77 0.00 -1.26 -4.56 105.19 99.36 2djv n GLY 4 Ca -0.22 -1.15 -0.43 0.00 0.00 0.00 0.00 46.02 44.23 2djv n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2djv n SER 5 N -2.55 2.45 -4.59 1.61 7.64 -1.26 -4.86 113.62 112.06 2djv n SER 5 Ca 0.00 0.02 -0.42 0.00 1.01 0.00 0.00 58.87 59.48 2djv n SER 5 Cb 0.18 -1.45 -0.03 0.00 -1.01 0.00 0.00 64.21 61.91 2djv n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2djv s SER 6 N 9.42 5.78 -0.06 6.43 0.01 -1.26 -4.82 113.70 129.21 2djv s SER 6 Ca 1.05 1.25 -0.10 0.00 1.31 0.00 0.00 55.95 59.46 2djv s SER 6 Cb -0.48 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.19 2djv s SER 6 CO 0.37 -1.81 -0.19 0.61 0.41 0.00 0.00 173.24 172.63 2djv n GLY 7 N 5.48 -0.31 3.87 3.44 0.00 -1.26 -5.03 105.19 111.37 2djv n GLY 7 Ca 0.23 -0.18 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 2djv n GLY 7 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2djv s THR 8 N -2.49 5.19 -0.02 2.61 -1.32 -1.26 -5.10 115.64 113.25 2djv s THR 8 Ca -0.16 0.42 -0.08 0.00 -1.21 0.00 0.00 61.69 60.65 2djv s THR 8 Cb 0.02 -3.61 0.01 0.00 -1.51 0.00 0.00 72.50 67.42 2djv s THR 8 CO 0.24 0.41 0.18 -0.89 -2.21 0.00 0.00 174.62 172.35 2djv s THR 9 N -1.26 0.06 0.18 5.08 2.01 -1.26 -5.08 115.64 115.37 2djv s THR 9 Ca 0.27 -0.48 -0.01 0.00 0.31 0.00 0.00 61.69 61.78 2djv s THR 9 Cb -0.14 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.90 2djv s THR 9 CO 0.15 -0.27 0.11 0.00 -0.69 0.00 0.00 174.62 173.92 2djv s ALA 10 N -1.00 1.09 -0.03 7.40 0.00 -1.26 -5.01 121.76 122.94 2djv s ALA 10 Ca -0.11 -1.63 -0.17 0.00 0.00 0.00 0.00 51.96 50.05 2djv s ALA 10 Cb -0.06 1.22 -0.09 0.00 0.00 0.00 0.00 23.12 24.19 2djv s ALA 10 CO 0.02 -0.56 0.70 0.87 0.00 0.00 0.00 175.76 176.79 2djv h LYS 11 N 2.69 -0.58 0.00 0.00 6.56 -1.99 0.14 116.57 123.39 2djv h LYS 11 Ca -0.36 0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.27 2djv h LYS 11 Cb 1.23 0.13 0.00 0.00 -0.57 0.00 0.00 32.23 33.03 2djv h LYS 11 CO 0.55 -0.39 0.00 -0.35 -2.06 0.00 0.00 179.45 177.20 2djv n PRO 12 N -5.18 0.49 -0.08 3.15 -0.04 -1.26 -3.06 135.00 129.02 2djv n PRO 12 Ca -0.08 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.23 2djv n PRO 12 Cb 0.24 -1.49 -0.05 0.00 -0.04 0.00 0.00 33.50 32.16 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 -0.99 0.39 -0.21 0.54 7.27 -1.21 -4.56 117.38 118.61 2djv n GLN 13 Ca 0.12 0.17 0.21 0.00 0.07 0.00 0.00 57.00 57.57 2djv n GLN 13 Cb 0.05 -1.16 0.58 0.00 2.41 0.00 0.00 30.24 32.12 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 -0.68 0.27 -0.77 3.69 3.07 -0.95 -2.11 115.11 117.63 2djv h GLN 14 Ca -0.33 -0.02 0.25 0.00 0.09 0.00 0.00 58.65 58.65 2djv h GLN 14 Cb 1.18 -0.06 -0.14 0.00 0.08 0.00 0.00 27.48 28.54 2djv h GLN 14 CO -0.20 0.18 0.16 -0.89 0.09 0.00 0.00 178.83 178.17 2djv n ILE 15 N -4.44 -0.32 -0.01 1.86 5.41 -1.17 0.14 119.36 120.82 2djv n ILE 15 Ca 0.18 1.65 -0.13 0.00 1.00 0.00 0.00 62.75 65.45 2djv n ILE 15 Cb 0.75 -2.50 -0.08 0.00 -0.71 0.00 0.00 39.64 37.10 2djv n ILE 15 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 2djv h GLN 16 N 0.00 0.08 -0.72 0.38 5.75 -1.69 -1.58 115.11 117.34 2djv h GLN 16 Ca 0.54 -0.03 0.11 0.00 -0.15 0.00 0.00 58.65 59.12 2djv h GLN 16 Cb 1.25 -0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.74 2djv h GLN 16 CO -0.68 0.41 0.48 0.00 -2.65 0.00 0.00 178.83 176.39 2djv h ALA 17 N 0.67 1.96 0.26 3.38 0.00 0.11 -2.44 119.26 123.19 2djv h ALA 17 Ca 0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2djv h ALA 17 Cb 0.38 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2djv h ALA 17 CO 0.00 -0.13 -0.12 -0.07 0.00 0.00 0.00 179.25 178.93 2djv h LEU 18 N 0.52 -0.29 -1.19 0.00 3.38 -0.83 -3.05 115.31 113.85 2djv h LEU 18 Ca 0.34 0.01 0.27 0.00 0.09 0.00 0.00 57.88 58.60 2djv h LEU 18 Cb 0.61 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 2djv h LEU 18 CO -0.12 0.01 1.11 0.24 0.09 0.00 0.00 178.44 179.77 2djv h MET 19 N -0.79 0.00 0.19 1.13 2.86 -1.14 0.37 114.93 117.55 2djv h MET 19 Ca -0.04 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 2djv h MET 19 Cb 0.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2djv h MET 19 CO 0.06 0.00 -0.09 0.22 1.06 0.00 0.00 176.91 178.16 2djv h ASP 20 N 0.00 -0.21 -0.67 1.22 3.58 -1.43 -2.82 116.42 116.08 2djv h ASP 20 Ca 0.45 -0.24 -0.05 0.00 0.42 0.00 0.00 57.03 57.61 2djv h ASP 20 Cb 2.66 0.06 -0.03 0.00 1.72 0.00 0.00 39.33 43.74 2djv h ASP 20 CO -0.00 0.33 0.24 1.05 -2.88 0.00 0.00 179.24 177.97 2djv h GLU 21 N -0.97 1.05 -0.23 0.28 4.11 -0.29 -2.94 114.58 115.58 2djv h GLU 21 Ca -0.03 -0.20 0.03 0.00 0.07 0.00 0.00 59.36 59.23 2djv h GLU 21 Cb 0.44 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 2djv h GLU 21 CO 0.04 0.88 0.06 0.28 0.07 0.00 0.00 179.01 180.34 2djv h VAL 22 N 1.01 0.91 -0.24 -1.06 2.07 -0.93 -1.97 116.25 116.04 2djv h VAL 22 Ca 0.23 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.75 2djv h VAL 22 Cb 0.26 0.74 -0.08 0.00 -1.52 0.00 0.00 31.29 30.69 2djv h VAL 22 CO -0.01 0.03 -0.39 0.74 0.02 0.00 0.00 177.57 177.96 2djv h THR 23 N 0.16 0.18 -0.89 2.57 2.02 -1.31 -0.20 112.91 115.43 2djv h THR 23 Ca 0.11 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.38 2djv h THR 23 Cb 0.09 0.18 -0.06 0.00 -1.74 0.00 0.00 68.15 66.61 2djv h THR 23 CO -0.13 0.00 0.58 0.50 0.37 0.00 0.00 175.52 176.84 2djv h LYS 24 N -0.39 0.87 -0.00 6.66 3.64 -1.48 -2.89 116.57 122.98 2djv h LYS 24 Ca 0.11 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 2djv h LYS 24 Cb 0.59 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.21 2djv h LYS 24 CO -0.46 0.58 -0.03 0.37 -2.27 0.00 0.00 179.45 177.65 2djv h GLN 25 N 0.90 -0.03 -1.13 1.90 -0.00 -0.25 0.20 115.11 116.70 2djv h GLN 25 Ca 0.41 0.00 0.31 0.00 -0.00 0.00 0.00 58.65 59.38 2djv h GLN 25 Cb 0.39 0.01 -0.08 0.00 0.00 0.00 0.00 27.48 27.79 2djv h GLN 25 CO -0.18 -0.02 0.76 0.78 0.00 0.00 0.00 178.83 180.17 2djv h GLY 26 N -0.03 0.80 1.50 2.39 0.00 -1.37 0.51 103.07 106.86 2djv h GLY 26 Ca 0.00 -0.12 -0.10 0.00 0.00 0.00 0.00 47.33 47.11 2djv h GLY 26 CO -0.02 -0.12 -0.20 3.43 0.00 0.00 0.00 176.54 179.63 2djv h ASN 27 N 0.22 0.59 -0.33 0.19 2.35 -1.05 -1.63 115.58 115.92 2djv h ASN 27 Ca 0.61 -0.19 -0.17 0.00 -0.55 0.00 0.00 56.30 56.00 2djv h ASN 27 Cb 1.90 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 40.11 2djv h ASN 27 CO -0.21 0.80 -0.47 0.40 -1.65 0.00 0.00 177.43 176.30 2djv h ILE 28 N 0.53 1.27 -0.23 2.81 2.04 0.20 -2.24 117.51 121.89 2djv h ILE 28 Ca 0.08 -1.64 -0.11 0.00 1.00 0.00 0.00 64.86 64.19 2djv h ILE 28 Cb 0.64 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 2djv h ILE 28 CO 0.05 0.54 -0.32 0.58 0.00 0.00 0.00 178.15 179.00 2djv h VAL 29 N 0.69 1.28 0.21 1.67 2.07 -1.24 -1.13 116.25 119.82 2djv h VAL 29 Ca 0.03 -1.40 -0.01 0.00 0.82 0.00 0.00 66.70 66.14 2djv h VAL 29 Cb 1.07 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 2djv h VAL 29 CO 0.11 0.44 -0.10 -0.09 0.02 0.00 0.00 177.57 177.95 2djv h ARG 30 N 0.41 -0.28 -0.92 1.57 2.43 -1.24 -2.63 114.38 113.72 2djv h ARG 30 Ca 0.05 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 2djv h ARG 30 Cb 0.77 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.34 2djv h ARG 30 CO 0.06 0.08 0.54 1.05 -1.51 0.00 0.00 179.97 180.19 2djv h GLU 31 N -0.71 1.27 0.18 0.20 4.11 -1.42 -0.74 114.58 117.46 2djv h GLU 31 Ca -0.03 -0.13 0.01 0.00 0.07 0.00 0.00 59.36 59.29 2djv h GLU 31 Cb 0.49 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 2djv h GLU 31 CO 0.05 0.90 -0.30 -0.07 0.07 0.00 0.00 179.01 179.66 2djv h LEU 32 N 1.28 -0.84 -0.76 3.06 3.38 -1.22 -0.17 115.31 120.04 2djv h LEU 32 Ca 0.33 0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.35 2djv h LEU 32 Cb -0.03 0.31 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 2djv h LEU 32 CO -0.06 -0.40 0.31 0.11 0.09 0.00 0.00 178.44 178.49 2djv h LYS 33 N -0.55 1.14 0.00 1.13 1.57 -1.31 -1.29 116.57 117.26 2djv h LYS 33 Ca 0.02 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 2djv h LYS 33 Cb 0.55 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 2djv h LYS 33 CO -0.14 0.93 -0.03 0.00 -0.57 0.00 0.00 179.45 179.64 2djv h ALA 34 N 1.16 1.28 -0.73 3.86 0.00 -0.71 -0.73 119.26 123.39 2djv h ALA 34 Ca 0.26 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.95 2djv h ALA 34 Cb 0.21 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.88 2djv h ALA 34 CO -0.02 0.04 0.24 1.04 0.00 0.00 0.00 179.25 180.54 2djv n GLN 35 N -3.53 3.98 -3.81 0.00 6.02 -0.11 -4.91 117.38 115.02 2djv n GLN 35 Ca -0.02 -3.12 -0.30 0.00 -0.01 0.00 0.00 57.00 53.55 2djv n GLN 35 Cb 0.13 -2.24 -0.02 0.00 1.02 0.00 0.00 30.24 29.13 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 -0.01 -2.94 -0.82 -1.09 4.01 -0.28 -4.88 118.16 112.15 2djv n LYS 36 Ca 0.39 0.35 -0.32 0.00 -0.51 0.00 0.00 58.31 58.23 2djv n LYS 36 Cb 1.38 -5.04 0.15 0.00 -0.51 0.00 0.00 35.03 31.01 2djv n LYS 36 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2djv n ALA 37 N -3.87 -0.64 -1.66 7.82 0.00 -0.57 -4.84 120.51 116.75 2djv n ALA 37 Ca 0.04 -0.48 -0.46 0.00 0.00 0.00 0.00 53.44 52.55 2djv n ALA 37 Cb 0.50 -2.20 -0.04 0.00 0.00 0.00 0.00 19.45 17.72 2djv n ALA 37 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2djv n ASP 38 N -3.78 3.68 -0.33 0.00 -0.08 -1.26 -4.82 116.55 109.95 2djv n ASP 38 Ca 0.12 0.86 0.05 0.00 -1.51 0.00 0.00 54.79 54.32 2djv n ASP 38 Cb 0.52 -1.44 0.13 0.00 2.34 0.00 0.00 41.12 42.66 2djv n ASP 38 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2djv n LYS 39 N 7.24 -0.09 -0.20 -0.67 5.02 -1.26 0.13 118.16 128.32 2djv n LYS 39 Ca 0.23 1.44 -0.09 0.00 -2.02 0.00 0.00 58.31 57.87 2djv n LYS 39 Cb 0.35 -2.15 0.02 0.00 -0.02 0.00 0.00 35.03 33.23 2djv n LYS 39 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 2djv h ASN 40 N 0.00 0.98 0.08 4.39 -0.73 -2.01 -2.54 115.58 115.75 2djv h ASN 40 Ca 0.44 -0.30 -0.01 0.00 1.87 0.00 0.00 56.30 58.30 2djv h ASN 40 Cb 0.67 -0.26 -0.00 0.00 0.27 0.00 0.00 38.32 38.99 2djv h ASN 40 CO -0.95 1.04 -0.06 -0.08 -0.37 0.00 0.00 177.43 177.01 2djv h GLU 41 N 0.89 0.00 -0.03 6.67 4.57 0.65 -2.14 114.58 125.19 2djv h GLU 41 Ca 0.16 0.00 -0.24 0.00 -1.18 0.00 0.00 59.36 58.11 2djv h GLU 41 Cb 0.53 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.13 2djv h GLU 41 CO 0.03 0.06 -0.94 0.28 -1.18 0.00 0.00 179.01 177.26 2djv h VAL 42 N 0.00 1.33 -0.35 0.32 2.07 -0.31 -3.30 116.25 116.01 2djv h VAL 42 Ca -0.00 -2.27 0.07 0.00 0.82 0.00 0.00 66.70 65.32 2djv h VAL 42 Cb 0.12 2.31 -0.07 0.00 -1.52 0.00 0.00 31.29 32.12 2djv h VAL 42 CO 0.01 0.69 -0.15 0.00 0.02 0.00 0.00 177.57 178.15 2djv h ALA 43 N 0.60 0.14 -0.89 1.67 0.00 -1.04 -1.31 119.26 118.42 2djv h ALA 43 Ca -0.09 0.13 0.31 0.00 0.00 0.00 0.00 54.91 55.26 2djv h ALA 43 Cb 1.57 0.37 -0.16 0.00 0.00 0.00 0.00 17.79 19.57 2djv h ALA 43 CO 0.18 -0.52 0.24 0.00 0.00 0.00 0.00 179.25 179.14 2djv n ALA 44 N -2.74 0.68 0.06 0.00 0.00 -1.20 -0.03 120.51 117.28 2djv n ALA 44 Ca 0.01 0.93 -0.06 0.00 0.00 0.00 0.00 53.44 54.33 2djv n ALA 44 Cb 0.24 -0.80 -0.03 0.00 0.00 0.00 0.00 19.45 18.86 2djv n ALA 44 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2djv h GLU 45 N 0.00 -0.25 -0.74 0.00 4.39 -1.44 -3.25 114.58 113.29 2djv h GLU 45 Ca 0.65 0.02 0.22 0.00 0.34 0.00 0.00 59.36 60.58 2djv h GLU 45 Cb 1.54 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 30.22 2djv h GLU 45 CO -0.77 -0.06 0.82 0.28 -1.16 0.00 0.00 179.01 178.12 2djv h VAL 46 N -1.04 0.20 -0.33 3.13 2.07 -0.43 0.78 116.25 120.63 2djv h VAL 46 Ca -0.03 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.38 2djv h VAL 46 Cb 0.30 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2djv h VAL 46 CO 0.04 0.00 -0.28 0.00 0.02 0.00 0.00 177.57 177.35 2djv h ALA 47 N 1.07 0.89 0.00 1.67 0.00 -0.49 -2.46 119.26 119.94 2djv h ALA 47 Ca 0.35 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 2djv h ALA 47 Cb 1.98 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.62 2djv h ALA 47 CO -0.00 0.63 -0.51 1.57 0.00 0.00 0.00 179.25 180.94 2djv h LYS 48 N 0.59 0.00 -0.15 0.00 2.10 0.48 -3.29 116.57 116.30 2djv h LYS 48 Ca 0.07 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.54 2djv h LYS 48 Cb 0.78 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.11 2djv h LYS 48 CO 0.06 0.27 -0.66 1.25 -2.00 0.00 0.00 179.45 178.37 2djv h LEU 49 N 0.00 0.66 -0.81 7.07 5.85 -1.16 -2.24 115.31 124.67 2djv h LEU 49 Ca -0.02 -0.40 0.03 0.00 0.84 0.00 0.00 57.88 58.33 2djv h LEU 49 Cb 1.25 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 42.04 2djv h LEU 49 CO 0.04 1.14 0.52 -0.07 -0.34 0.00 0.00 178.44 179.73 2djv h LEU 50 N 0.41 0.87 -0.08 2.25 3.38 -1.51 -2.08 115.31 118.55 2djv h LEU 50 Ca -0.02 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 2djv h LEU 50 Cb 1.24 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2djv h LEU 50 CO 0.12 0.61 -0.24 0.44 0.09 0.00 0.00 178.44 179.46 2djv h ASP 51 N 1.03 0.35 -0.43 -0.43 5.19 -1.67 -3.30 116.42 117.16 2djv h ASP 51 Ca 0.32 -0.61 0.09 0.00 -0.62 0.00 0.00 57.03 56.20 2djv h ASP 51 Cb -0.01 -0.10 -0.09 0.00 0.18 0.00 0.00 39.33 39.30 2djv h ASP 51 CO -0.10 0.90 -0.28 -0.07 -3.12 0.00 0.00 179.24 176.56 2djv h LEU 52 N -0.18 -0.95 -0.98 1.55 3.38 -1.16 -0.09 115.31 116.87 2djv h LEU 52 Ca -0.01 0.18 0.29 0.00 0.09 0.00 0.00 57.88 58.44 2djv h LEU 52 Cb 0.87 0.47 -0.18 0.00 0.09 0.00 0.00 40.66 41.91 2djv h LEU 52 CO 0.05 -0.29 0.13 0.11 0.09 0.00 0.00 178.44 178.53 2djv h LYS 53 N -0.20 0.02 0.22 1.13 1.57 -1.46 0.16 116.57 118.01 2djv h LYS 53 Ca 0.19 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 2djv h LYS 53 Cb 0.51 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.82 2djv h LYS 53 CO -0.54 0.02 -0.10 0.87 -0.57 0.00 0.00 179.45 179.12 2djv h LYS 54 N 0.02 -0.28 -1.30 3.15 1.57 -1.16 -0.53 116.57 118.05 2djv h LYS 54 Ca 0.63 0.02 0.38 0.00 -1.87 0.00 0.00 60.65 59.81 2djv h LYS 54 Cb 1.38 0.06 -0.05 0.00 0.08 0.00 0.00 32.23 33.70 2djv h LYS 54 CO -0.87 -0.19 1.19 1.96 -0.57 0.00 0.00 179.45 180.97 2djv h GLN 55 N -0.49 0.00 0.00 3.15 4.20 -0.51 0.52 115.11 121.98 2djv h GLN 55 Ca -0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2djv h GLN 55 Cb 0.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.00 2djv h GLN 55 CO 0.05 0.00 -0.09 1.25 -0.67 0.00 0.00 178.83 179.37 2djv h LEU 56 N 0.00 0.00 0.06 1.46 7.12 -0.67 -3.10 115.31 120.18 2djv h LEU 56 Ca 0.62 0.00 0.02 0.00 0.13 0.00 0.00 57.88 58.65 2djv h LEU 56 Cb 3.00 0.00 -0.04 0.00 -0.53 0.00 0.00 40.66 43.09 2djv h LEU 56 CO -0.01 0.28 -0.25 0.00 -0.13 0.00 0.00 178.44 178.33 2djv h ALA 57 N -1.53 -0.39 -0.59 1.25 0.00 0.25 -1.64 119.26 116.61 2djv h ALA 57 Ca 0.00 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 54.99 2djv h ALA 57 Cb 0.09 0.42 -0.08 0.00 0.00 0.00 0.00 17.79 18.22 2djv h ALA 57 CO 0.00 -0.77 0.16 0.28 0.00 0.00 0.00 179.25 178.92 2djv h VAL 58 N -0.43 0.69 -0.92 0.00 2.07 -0.19 -0.68 116.25 116.80 2djv h VAL 58 Ca 0.04 -0.10 0.07 0.00 0.82 0.00 0.00 66.70 67.53 2djv h VAL 58 Cb 0.48 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.54 2djv h VAL 58 CO -0.18 0.05 0.57 0.00 0.02 0.00 0.00 177.57 178.04 2djv h ALA 59 N 1.45 1.28 -0.38 1.67 0.00 -1.36 -2.25 119.26 119.67 2djv h ALA 59 Ca 0.31 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 2djv h ALA 59 Cb 0.43 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2djv h ALA 59 CO -0.37 0.31 0.16 0.93 0.00 0.00 0.00 179.25 180.29 2djv h GLU 60 N 1.03 0.57 0.00 0.00 5.08 -0.21 -3.45 114.58 117.59 2djv h GLU 60 Ca 0.41 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 2djv h GLU 60 Cb 0.21 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2djv h GLU 60 CO -0.19 0.53 0.00 0.41 -1.00 0.00 0.00 179.01 178.76 2djv n GLY 61 N -0.79 2.39 3.41 -3.84 0.00 -0.70 -5.10 105.19 100.56 2djv n GLY 61 Ca -0.00 -0.27 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 2djv n GLY 61 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2djv n LYS 62 N 0.00 0.37 -2.26 1.61 5.02 -1.18 -4.90 118.16 116.82 2djv n LYS 62 Ca 0.00 0.13 -0.35 0.00 -2.02 0.00 0.00 58.31 56.07 2djv n LYS 62 Cb 0.00 -1.32 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 2djv n LYS 62 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2djv s PRO 63 N -1.35 3.39 0.00 1.97 0.04 -1.26 -4.14 135.00 133.65 2djv s PRO 63 Ca 0.62 1.62 0.00 0.00 0.04 0.00 0.00 61.00 63.28 2djv s PRO 63 Cb -0.65 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 31.85 2djv s PRO 63 CO 0.59 -0.82 0.00 -0.35 0.04 0.00 0.00 177.00 176.46 2djv n PRO 64 N -1.23 0.20 -0.87 0.56 -0.04 -1.26 -4.79 135.00 127.57 2djv n PRO 64 Ca 0.11 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.41 2djv n PRO 64 Cb 0.51 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.86 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 -0.59 1.99 -0.27 0.54 4.71 -1.26 -4.71 120.64 121.05 2djv n GLU 65 Ca 0.00 -1.10 -0.07 0.00 -0.01 0.00 0.00 57.16 55.98 2djv n GLU 65 Cb 0.00 -2.11 -0.06 0.00 -1.01 0.00 0.00 31.44 28.25 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 2.97 -0.40 0.00 0.62 0.00 -1.26 -1.18 120.51 121.26 2djv n ALA 66 Ca 0.43 0.54 -0.13 0.00 0.00 0.00 0.00 53.44 54.27 2djv n ALA 66 Cb 0.57 -0.05 -0.10 0.00 0.00 0.00 0.00 19.45 19.87 2djv n ALA 66 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2djv h PRO 67 N 0.00 -0.04 -2.74 0.00 0.13 -2.01 -3.31 132.00 124.03 2djv h PRO 67 Ca 0.10 0.00 -0.70 0.00 -0.87 0.00 0.00 66.00 64.54 2djv h PRO 67 Cb 0.26 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 31.34 2djv h PRO 67 CO -0.59 0.43 2.90 1.17 -0.23 0.00 0.00 178.00 181.67 2djv n LYS 68 N -4.88 4.15 -1.59 0.86 4.81 -0.32 -4.69 118.16 116.50 2djv n LYS 68 Ca -0.08 -2.89 -0.37 0.00 -0.87 0.00 0.00 58.31 54.09 2djv n LYS 68 Cb 0.25 -2.68 0.06 0.00 0.02 0.00 0.00 35.03 32.69 2djv n LYS 68 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2djv n GLY 69 N 2.45 5.70 3.64 3.14 0.00 -0.60 -4.71 105.19 114.81 2djv n GLY 69 Ca 0.68 -2.38 -0.54 0.00 0.00 0.00 0.00 46.02 43.78 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 -0.73 1.16 -4.40 1.61 3.00 -1.26 -4.95 118.16 112.58 2djv n LYS 70 Ca 0.59 0.42 -0.33 0.00 -0.00 0.00 0.00 58.31 58.99 2djv n LYS 70 Cb 0.47 -2.08 -0.16 0.00 0.00 0.00 0.00 35.03 33.25 2djv n LYS 70 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 2djv s LYS 71 N 1.82 3.05 -0.10 1.64 2.20 -1.26 -5.00 119.74 122.08 2djv s LYS 71 Ca 0.90 -0.82 -0.11 0.00 -0.36 0.00 0.00 55.97 55.58 2djv s LYS 71 Cb -1.00 -2.54 -0.05 0.00 -1.51 0.00 0.00 37.83 32.73 2djv s LYS 71 CO 0.55 -0.10 -0.23 1.17 -0.36 0.00 0.00 175.35 176.38 2djv n LYS 72 N 4.32 0.35 -4.22 4.03 3.00 -1.26 -5.09 118.16 119.28 2djv n LYS 72 Ca -0.20 0.14 -0.13 0.00 -0.00 0.00 0.00 58.31 58.12 2djv n LYS 72 Cb 0.51 -1.11 -0.10 0.00 0.00 0.00 0.00 35.03 34.33 2djv n LYS 72 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2djv s LYS 73 N -2.53 1.23 0.25 1.64 1.02 -1.26 -5.17 119.74 114.92 2djv s LYS 73 Ca -0.20 -1.65 0.10 0.00 0.02 0.00 0.00 55.97 54.24 2djv s LYS 73 Cb 0.04 0.16 -0.04 0.00 -0.52 0.00 0.00 37.83 37.46 2djv s LYS 73 CO 0.29 -0.36 -0.06 -1.12 -0.92 0.00 0.00 175.35 173.17 2djv s SER 74 N -3.19 4.32 -0.89 2.83 0.01 -1.26 -5.09 113.70 110.44 2djv s SER 74 Ca 0.38 -0.69 -0.05 0.00 1.31 0.00 0.00 55.95 56.90 2djv s SER 74 Cb 0.07 -0.73 0.22 0.00 0.21 0.00 0.00 66.02 65.80 2djv s SER 74 CO 0.12 0.03 0.80 -0.83 0.41 0.00 0.00 173.24 173.77 2djv s GLY 75 N -3.45 2.96 1.22 3.44 0.00 -1.26 -5.07 107.32 105.16 2djv s GLY 75 Ca 0.30 -3.68 -0.20 0.00 0.00 0.00 0.00 44.72 41.14 2djv s GLY 75 CO 0.18 1.22 1.11 2.56 0.00 0.00 0.00 173.10 178.17 2djv s PRO 76 N -0.91 -1.34 -0.23 2.90 0.04 -1.26 -5.04 135.00 129.17 2djv s PRO 76 Ca 0.25 -0.10 -0.16 0.00 0.04 0.00 0.00 61.00 61.03 2djv s PRO 76 Cb -0.10 -1.59 -0.11 0.00 0.04 0.00 0.00 34.50 32.74 2djv s PRO 76 CO -0.09 -3.78 -0.24 0.43 0.04 0.00 0.00 177.00 173.36 2djv n SER 77 N -4.80 1.92 -4.63 6.66 7.64 -1.26 -4.95 113.62 114.20 2djv n SER 77 Ca 0.14 0.38 -0.48 0.00 1.01 0.00 0.00 58.87 59.92 2djv n SER 77 Cb 0.60 -0.83 -0.04 0.00 -1.01 0.00 0.00 64.21 62.92 2djv n SER 77 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2djv n SER 78 N -4.36 2.16 0.00 6.43 3.41 -1.26 -5.35 113.62 114.64 2djv n SER 78 Ca -0.37 1.13 0.00 0.00 -0.26 0.00 0.00 58.87 59.37 2djv n SER 78 Cb 0.71 -1.32 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 2djv n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49