#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dgn s ASP 3 N 0.00 -1.26 -0.41 0.00 -4.77 -1.26 -5.04 116.67 103.93 1dgn s ASP 3 Ca 0.00 -0.79 0.10 0.00 -3.30 0.00 0.00 52.55 48.55 1dgn s ASP 3 Cb 0.00 1.62 0.36 0.00 -1.09 0.00 0.00 42.92 43.81 1dgn s ASP 3 CO 0.00 -0.12 1.06 0.00 0.70 0.00 0.00 175.17 176.81 1dgn n GLN 4 N 4.00 1.07 0.27 2.11 1.13 -1.26 -5.00 117.38 119.70 1dgn n GLN 4 Ca 0.11 -2.42 -0.15 0.00 -1.94 0.00 0.00 57.00 52.60 1dgn n GLN 4 Cb 0.58 -0.99 -0.08 0.00 0.11 0.00 0.00 30.24 29.86 1dgn n GLN 4 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1dgn h LEU 5 N 2.77 -0.59 0.07 1.08 6.46 -2.00 -3.11 115.31 120.00 1dgn h LEU 5 Ca -0.09 -0.06 0.02 0.00 -0.12 0.00 0.00 57.88 57.62 1dgn h LEU 5 Cb 1.13 0.15 -0.05 0.00 -0.73 0.00 0.00 40.66 41.16 1dgn h LEU 5 CO 0.22 -0.26 -0.51 -0.07 -0.62 0.00 0.00 178.44 177.20 1dgn h LEU 6 N -0.92 -1.54 -0.42 2.25 -0.00 -1.94 0.25 115.31 112.99 1dgn h LEU 6 Ca -0.07 0.17 0.04 0.00 -0.00 0.00 0.00 57.88 58.02 1dgn h LEU 6 Cb 0.61 0.58 -0.05 0.00 -0.00 0.00 0.00 40.66 41.80 1dgn h LEU 6 CO 0.12 -0.53 -0.25 -1.14 -0.00 0.00 0.00 178.44 176.64 1dgn n ARG 7 N -5.48 -0.18 -0.21 1.13 0.00 -1.24 0.26 116.66 110.93 1dgn n ARG 7 Ca -0.08 1.05 -0.08 0.00 -0.00 0.00 0.00 57.85 58.75 1dgn n ARG 7 Cb 0.40 -1.56 0.03 0.00 0.00 0.00 0.00 32.46 31.33 1dgn n ARG 7 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.63 178.50 1dgn h LYS 8 N 0.00 0.95 -0.20 -0.14 1.57 -1.45 -1.98 116.57 115.32 1dgn h LYS 8 Ca 0.07 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1dgn h LYS 8 Cb 0.17 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1dgn h LYS 8 CO -0.39 0.85 0.00 1.63 -0.57 0.00 0.00 179.45 180.97 1dgn n LYS 9 N -4.38 1.11 -0.08 3.15 4.76 0.87 -3.93 118.16 119.66 1dgn n LYS 9 Ca 0.03 -0.14 -0.11 0.00 -2.87 0.00 0.00 58.31 55.22 1dgn n LYS 9 Cb 0.22 -1.12 -0.04 0.00 -1.84 0.00 0.00 35.03 32.25 1dgn n LYS 9 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 1dgn h ARG 10 N 0.22 0.42 -0.05 1.97 1.12 0.43 -0.29 114.38 118.19 1dgn h ARG 10 Ca 0.00 -0.12 -0.06 0.00 -1.11 0.00 0.00 59.98 58.69 1dgn h ARG 10 Cb 0.14 -0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 30.05 1dgn h ARG 10 CO 0.00 0.56 -0.26 0.00 -3.11 0.00 0.00 179.97 177.16 1dgn h ARG 11 N 0.21 0.09 0.15 0.20 3.08 -1.78 -1.22 114.38 115.11 1dgn h ARG 11 Ca 0.07 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 1dgn h ARG 11 Cb 0.35 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1dgn h ARG 11 CO 0.01 0.35 -0.07 0.82 -1.07 0.00 0.00 179.97 180.00 1dgn h ILE 12 N 0.08 0.38 0.08 2.04 2.04 -1.76 -2.98 117.51 117.39 1dgn h ILE 12 Ca 0.01 -1.07 0.01 0.00 1.00 0.00 0.00 64.86 64.81 1dgn h ILE 12 Cb 0.51 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1dgn h ILE 12 CO 0.04 0.12 -0.09 0.15 0.00 0.00 0.00 178.15 178.36 1dgn h PHE 13 N -1.01 -0.23 -0.40 1.37 3.04 -1.09 -2.96 116.94 115.66 1dgn h PHE 13 Ca -0.02 0.00 0.08 0.00 3.98 0.00 0.00 57.97 62.01 1dgn h PHE 13 Cb 0.34 0.09 -0.08 0.00 2.56 0.00 0.00 35.95 38.87 1dgn h PHE 13 CO 0.05 -0.14 -0.10 0.97 -2.02 0.00 0.00 178.31 177.07 1dgn h ILE 14 N -0.20 0.60 -1.14 1.41 2.10 -1.38 -0.29 117.51 118.62 1dgn h ILE 14 Ca 0.01 0.00 -0.59 0.00 1.08 0.00 0.00 64.86 65.36 1dgn h ILE 14 Cb 0.20 0.60 -0.16 0.00 -1.09 0.00 0.00 36.82 36.36 1dgn h ILE 14 CO -0.04 0.00 1.11 1.41 -1.08 0.00 0.00 178.15 179.56 1dgn n HIS 15 N -5.31 1.99 0.08 2.19 8.25 -1.12 -4.21 115.22 117.08 1dgn n HIS 15 Ca 0.02 -2.26 0.00 0.00 -0.26 0.00 0.00 57.72 55.22 1dgn n HIS 15 Cb 0.22 -1.53 0.00 0.00 1.12 0.00 0.00 29.99 29.80 1dgn n HIS 15 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1dgn n SER 16 N 1.12 -1.37 -4.71 0.41 7.64 -0.92 -4.90 113.62 110.88 1dgn n SER 16 Ca 0.54 0.38 -0.65 0.00 1.01 0.00 0.00 58.87 60.14 1dgn n SER 16 Cb 0.43 1.52 -0.09 0.00 -1.01 0.00 0.00 64.21 65.06 1dgn n SER 16 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1dgn n VAL 17 N -2.80 0.04 -2.92 0.44 3.14 -0.16 -4.89 118.33 111.18 1dgn n VAL 17 Ca 0.00 -0.01 -0.36 0.00 -2.96 0.00 0.00 64.34 61.01 1dgn n VAL 17 Cb 0.00 -0.53 -0.06 0.00 -1.06 0.00 0.00 33.84 32.19 1dgn n VAL 17 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1dgn s GLY 18 N 2.64 2.67 0.63 7.55 0.00 -1.26 -4.90 107.32 114.64 1dgn s GLY 18 Ca 1.02 0.36 0.19 0.00 0.00 0.00 0.00 44.72 46.29 1dgn s GLY 18 CO 0.76 0.74 1.36 0.00 0.00 0.00 0.00 173.10 175.97 1dgn h ALA 19 N 3.09 2.35 0.11 3.20 0.00 -1.99 -0.85 119.26 125.16 1dgn h ALA 19 Ca -0.47 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1dgn h ALA 19 Cb 1.19 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1dgn h ALA 19 CO 0.65 -1.20 -0.05 0.78 0.00 0.00 0.00 179.25 179.43 1dgn h GLY 20 N 0.00 -0.15 -0.22 0.00 0.00 -2.00 -3.33 103.07 97.37 1dgn h GLY 20 Ca 0.23 0.06 0.28 0.00 0.00 0.00 0.00 47.33 47.90 1dgn h GLY 20 CO -0.00 -0.06 0.70 -0.84 0.00 0.00 0.00 176.54 176.34 1dgn h THR 21 N -0.89 0.48 0.14 4.70 2.02 -1.54 -2.08 112.91 115.75 1dgn h THR 21 Ca -0.01 -0.11 0.01 0.00 0.77 0.00 0.00 66.41 67.06 1dgn h THR 21 Cb 0.11 0.12 -0.04 0.00 -1.74 0.00 0.00 68.15 66.61 1dgn h THR 21 CO 0.02 0.06 -0.43 0.40 0.37 0.00 0.00 175.52 175.94 1dgn h ILE 22 N 0.33 0.00 -1.00 3.11 2.04 -1.59 0.76 117.51 121.17 1dgn h ILE 22 Ca 0.61 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.67 1dgn h ILE 22 Cb 1.65 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 37.62 1dgn h ILE 22 CO -0.28 0.00 0.61 -1.13 0.00 0.00 0.00 178.15 177.36 1dgn h ASN 23 N -0.65 0.71 1.26 1.72 -1.24 -1.49 0.25 115.58 116.15 1dgn h ASN 23 Ca -0.01 0.09 -0.10 0.00 0.71 0.00 0.00 56.30 56.99 1dgn h ASN 23 Cb 0.64 -0.03 -0.01 0.00 0.73 0.00 0.00 38.32 39.64 1dgn h ASN 23 CO -0.21 0.24 -0.47 0.00 -1.29 0.00 0.00 177.43 175.70 1dgn h ALA 24 N 1.64 0.77 0.19 1.57 0.00 -1.25 -2.87 119.26 119.31 1dgn h ALA 24 Ca 0.57 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1dgn h ALA 24 Cb 1.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1dgn h ALA 24 CO -0.36 0.59 -0.09 1.25 0.00 0.00 0.00 179.25 180.64 1dgn h LEU 25 N 0.00 -0.22 -1.40 0.00 7.12 0.38 -3.02 115.31 118.18 1dgn h LEU 25 Ca -0.00 -0.09 0.02 0.00 0.13 0.00 0.00 57.88 57.94 1dgn h LEU 25 Cb 1.23 0.06 -0.03 0.00 -0.53 0.00 0.00 40.66 41.38 1dgn h LEU 25 CO 0.06 0.28 0.43 0.17 -0.13 0.00 0.00 178.44 179.25 1dgn h LEU 26 N -1.04 0.69 -0.55 2.25 8.10 -1.21 -1.74 115.31 121.80 1dgn h LEU 26 Ca -0.03 -0.01 0.04 0.00 0.11 0.00 0.00 57.88 57.99 1dgn h LEU 26 Cb 0.30 -0.16 -0.04 0.00 -0.44 0.00 0.00 40.66 40.31 1dgn h LEU 26 CO 0.04 0.48 0.31 -0.78 -4.11 0.00 0.00 178.44 174.39 1dgn h ASP 27 N 0.80 0.48 -0.62 0.17 3.58 -1.61 -2.22 116.42 117.00 1dgn h ASP 27 Ca 0.25 0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.69 1dgn h ASP 27 Cb 0.01 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 40.95 1dgn h ASP 27 CO -0.06 0.33 0.29 0.00 -2.88 0.00 0.00 179.24 176.91 1dgn h LEU 29 N 0.85 0.12 -0.76 0.00 3.38 -0.86 0.16 115.31 118.21 1dgn h LEU 29 Ca 0.21 0.14 0.01 0.00 0.09 0.00 0.00 57.88 58.33 1dgn h LEU 29 Cb 0.14 0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1dgn h LEU 29 CO -0.02 -0.00 0.50 -0.07 0.09 0.00 0.00 178.44 178.93 1dgn h LEU 30 N 0.33 0.87 -0.98 1.67 4.07 -1.26 -1.81 115.31 118.19 1dgn h LEU 30 Ca 0.44 -0.02 0.27 0.00 0.08 0.00 0.00 57.88 58.65 1dgn h LEU 30 Cb 0.76 -0.22 -0.14 0.00 1.08 0.00 0.00 40.66 42.15 1dgn h LEU 30 CO -0.50 0.63 0.53 -0.08 -1.08 0.00 0.00 178.44 177.95 1dgn h GLU 31 N 1.03 0.42 0.00 1.13 4.81 -0.58 1.30 114.58 122.68 1dgn h GLU 31 Ca 0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1dgn h GLU 31 Cb -0.12 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.17 1dgn h GLU 31 CO -0.06 0.27 -0.05 -0.44 -0.73 0.00 0.00 179.01 178.01 1dgn h ASP 32 N 0.43 0.00 -2.69 1.04 3.32 -1.17 -3.47 116.42 113.87 1dgn h ASP 32 Ca 0.66 -0.00 -0.25 0.00 0.02 0.00 0.00 57.03 57.46 1dgn h ASP 32 Cb 1.38 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.96 1dgn h ASP 32 CO -0.55 0.00 -0.36 -0.62 -1.72 0.00 0.00 179.24 175.99 1dgn n GLU 33 N -3.05 -2.59 -0.00 3.56 1.02 0.45 -4.94 120.64 115.08 1dgn n GLU 33 Ca 0.04 0.58 -0.17 0.00 -0.02 0.00 0.00 57.16 57.58 1dgn n GLU 33 Cb 0.53 -4.73 -0.13 0.00 -0.02 0.00 0.00 31.44 27.09 1dgn n GLU 33 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 1dgn h VAL 34 N -0.67 1.55 -3.41 2.62 3.04 -1.78 -3.46 116.25 114.14 1dgn h VAL 34 Ca -0.32 -2.23 -0.50 0.00 -1.01 0.00 0.00 66.70 62.64 1dgn h VAL 34 Cb 1.23 2.98 0.01 0.00 -2.01 0.00 0.00 31.29 33.49 1dgn h VAL 34 CO 0.35 0.62 -0.01 0.27 -1.01 0.00 0.00 177.57 177.80 1dgn s ILE 35 N -2.77 4.93 0.09 3.17 -4.36 -1.26 -5.02 121.20 115.97 1dgn s ILE 35 Ca -0.15 0.22 -0.00 0.00 -0.26 0.00 0.00 60.65 60.46 1dgn s ILE 35 Cb 0.01 -3.77 -0.04 0.00 1.25 0.00 0.00 42.46 39.90 1dgn s ILE 35 CO 0.78 -0.53 0.25 -0.44 0.24 0.00 0.00 174.94 175.24 1dgn s SER 36 N -3.45 6.37 0.55 4.36 0.01 -1.26 -4.89 113.70 115.39 1dgn s SER 36 Ca 0.47 0.30 0.46 0.00 1.31 0.00 0.00 55.95 58.49 1dgn s SER 36 Cb -0.10 -1.97 1.68 0.00 0.21 0.00 0.00 66.02 65.83 1dgn s SER 36 CO 0.34 0.13 1.63 -0.61 0.41 0.00 0.00 173.24 175.15 1dgn h GLN 37 N 2.88 0.01 -0.20 12.44 5.75 -1.98 1.18 115.11 135.18 1dgn h GLN 37 Ca -0.46 -0.00 -0.08 0.00 -0.15 0.00 0.00 58.65 57.96 1dgn h GLN 37 Cb 1.17 -0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.71 1dgn h GLN 37 CO 0.74 0.00 -0.20 0.93 -2.65 0.00 0.00 178.83 177.66 1dgn h GLU 38 N 0.01 0.49 -0.16 1.69 4.39 -2.00 -2.63 114.58 116.37 1dgn h GLU 38 Ca 0.84 -0.26 -0.04 0.00 0.34 0.00 0.00 59.36 60.24 1dgn h GLU 38 Cb 3.34 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 31.99 1dgn h GLU 38 CO -0.04 0.83 -0.06 -0.44 -1.16 0.00 0.00 179.01 178.14 1dgn h ASP 39 N 0.17 0.33 -1.01 1.42 3.32 0.94 -2.72 116.42 118.88 1dgn h ASP 39 Ca 0.03 -0.40 0.25 0.00 0.02 0.00 0.00 57.03 56.94 1dgn h ASP 39 Cb 0.74 -0.09 -0.08 0.00 0.22 0.00 0.00 39.33 40.12 1dgn h ASP 39 CO 0.05 0.66 0.66 -0.03 -1.72 0.00 0.00 179.24 178.86 1dgn h MET 40 N 0.01 0.34 -0.52 3.56 4.05 -1.00 0.48 114.93 121.85 1dgn h MET 40 Ca 0.04 -0.02 -0.11 0.00 -0.28 0.00 0.00 59.70 59.33 1dgn h MET 40 Cb 0.52 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.23 1dgn h MET 40 CO 0.02 0.22 -0.11 -0.91 0.23 0.00 0.00 176.91 176.37 1dgn h ASN 41 N 0.35 0.96 -0.57 1.39 -0.26 -1.16 -0.50 115.58 115.79 1dgn h ASN 41 Ca 0.55 -0.31 0.12 0.00 -0.56 0.00 0.00 56.30 56.09 1dgn h ASN 41 Cb 1.48 -0.26 -0.10 0.00 -1.06 0.00 0.00 38.32 38.38 1dgn h ASN 41 CO -0.22 1.08 -0.02 0.50 -1.06 0.00 0.00 177.43 177.70 1dgn h LYS 42 N 0.86 0.09 0.03 0.81 1.63 0.15 0.69 116.57 120.84 1dgn h LYS 42 Ca 0.14 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.93 1dgn h LYS 42 Cb 0.65 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.26 1dgn h LYS 42 CO 0.05 0.06 -0.01 0.28 -3.45 0.00 0.00 179.45 176.37 1dgn h VAL 43 N 0.10 1.39 0.00 2.00 2.07 -1.41 -3.05 116.25 117.35 1dgn h VAL 43 Ca 0.29 -1.43 0.00 0.00 0.82 0.00 0.00 66.70 66.38 1dgn h VAL 43 Cb 0.46 2.33 0.00 0.00 -1.52 0.00 0.00 31.29 32.56 1dgn h VAL 43 CO -0.50 0.36 0.01 -1.14 0.02 0.00 0.00 177.57 176.32 1dgn n ARG 44 N -4.81 0.03 0.11 1.57 0.00 -0.21 -1.76 116.66 111.59 1dgn n ARG 44 Ca -0.09 0.52 0.08 0.00 -0.00 0.00 0.00 57.85 58.36 1dgn n ARG 44 Cb 0.31 -1.61 0.41 0.00 0.00 0.00 0.00 32.46 31.57 1dgn n ARG 44 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1dgn n ASP 45 N -1.66 0.39 -3.55 6.15 2.03 0.24 -4.88 116.55 115.27 1dgn n ASP 45 Ca -0.00 0.68 -0.25 0.00 0.52 0.00 0.00 54.79 55.74 1dgn n ASP 45 Cb 0.02 -0.73 0.01 0.00 -0.72 0.00 0.00 41.12 39.70 1dgn n ASP 45 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1dgn n GLU 46 N -2.02 -1.70 0.00 -0.67 1.02 -0.72 -4.93 120.64 111.61 1dgn n GLU 46 Ca -0.01 1.16 0.00 0.00 -0.02 0.00 0.00 57.16 58.29 1dgn n GLU 46 Cb 0.04 -2.89 0.00 0.00 -0.02 0.00 0.00 31.44 28.57 1dgn n GLU 46 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1dgn n ASN 47 N -1.60 0.00 0.00 1.62 3.02 -1.26 -5.04 115.26 112.00 1dgn n ASN 47 Ca -0.18 0.80 0.00 0.00 -0.03 0.00 0.00 54.58 55.17 1dgn n ASN 47 Cb 0.65 -0.39 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 1dgn n ASN 47 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1dgn n ASP 48 N -1.66 4.13 -4.23 6.41 -0.08 -1.26 -5.07 116.55 114.79 1dgn n ASP 48 Ca 0.00 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 52.93 1dgn n ASP 48 Cb 0.00 0.00 0.07 0.00 2.34 0.00 0.00 41.12 43.53 1dgn n ASP 48 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 1dgn n THR 49 N 0.00 0.24 -0.31 5.18 -1.04 -1.26 -4.42 114.28 112.66 1dgn n THR 49 Ca 0.00 -0.37 0.14 0.00 -2.04 0.00 0.00 64.05 61.78 1dgn n THR 49 Cb 0.00 -0.32 0.33 0.00 -1.82 0.00 0.00 70.33 68.51 1dgn n THR 49 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1dgn h VAL 50 N -1.04 0.43 -1.43 12.58 2.07 -1.97 0.24 116.25 127.13 1dgn h VAL 50 Ca -0.44 -0.13 0.43 0.00 0.82 0.00 0.00 66.70 67.38 1dgn h VAL 50 Cb 1.31 0.03 -0.09 0.00 -1.52 0.00 0.00 31.29 31.02 1dgn h VAL 50 CO 0.31 0.07 0.99 0.24 0.02 0.00 0.00 177.57 179.20 1dgn h MET 51 N 0.37 0.07 0.00 1.57 2.86 -1.87 0.25 114.93 118.19 1dgn h MET 51 Ca 0.58 -0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 58.17 1dgn h MET 51 Cb 1.14 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.78 1dgn h MET 51 CO -0.56 0.05 -0.36 0.22 1.06 0.00 0.00 176.91 177.32 1dgn h ASP 52 N 0.08 0.00 -0.69 1.22 1.82 -0.79 -2.92 116.42 115.14 1dgn h ASP 52 Ca 0.76 -0.46 0.16 0.00 -0.39 0.00 0.00 57.03 57.10 1dgn h ASP 52 Cb 2.69 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 42.66 1dgn h ASP 52 CO -0.18 0.93 0.47 0.11 -1.61 0.00 0.00 179.24 178.97 1dgn h LYS 53 N -1.00 0.24 0.20 0.28 1.57 -1.00 -1.39 116.57 115.47 1dgn h LYS 53 Ca -0.08 -0.01 -0.32 0.00 -1.87 0.00 0.00 60.65 58.37 1dgn h LYS 53 Cb 0.72 -0.05 0.04 0.00 0.08 0.00 0.00 32.23 33.01 1dgn h LYS 53 CO -0.05 0.16 -1.39 0.00 -0.57 0.00 0.00 179.45 177.60 1dgn h ALA 54 N 1.67 -0.11 -0.69 3.86 0.00 -0.71 -2.40 119.26 120.88 1dgn h ALA 54 Ca 0.34 -0.82 0.10 0.00 0.00 0.00 0.00 54.91 54.52 1dgn h ALA 54 Cb 0.97 0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.84 1dgn h ALA 54 CO -0.07 0.69 0.31 -0.09 0.00 0.00 0.00 179.25 180.09 1dgn h ARG 55 N 0.20 0.52 0.04 0.00 2.43 -1.06 -1.60 114.38 114.91 1dgn h ARG 55 Ca -0.23 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 58.77 1dgn h ARG 55 Cb 2.07 -0.12 0.01 0.00 -0.42 0.00 0.00 29.97 31.52 1dgn h ARG 55 CO 0.26 0.34 -0.57 -0.39 -1.51 0.00 0.00 179.97 178.11 1dgn h VAL 56 N 0.53 1.49 -0.17 0.20 -1.51 -1.57 -2.84 116.25 112.37 1dgn h VAL 56 Ca 0.35 -2.18 0.04 0.00 -1.23 0.00 0.00 66.70 63.68 1dgn h VAL 56 Cb 0.40 2.82 -0.07 0.00 -2.13 0.00 0.00 31.29 32.31 1dgn h VAL 56 CO -0.29 0.62 -0.45 0.25 -1.23 0.00 0.00 177.57 176.47 1dgn h LEU 57 N -0.28 -1.43 -1.35 4.19 5.85 -1.13 0.18 115.31 121.34 1dgn h LEU 57 Ca -0.08 0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 1dgn h LEU 57 Cb 1.33 0.58 -0.01 0.00 0.37 0.00 0.00 40.66 42.93 1dgn h LEU 57 CO 0.11 -0.43 -0.08 -0.29 -0.34 0.00 0.00 178.44 177.40 1dgn h ILE 58 N -0.49 1.18 -0.13 4.05 2.10 -1.44 -2.99 117.51 119.80 1dgn h ILE 58 Ca 0.07 -0.77 -0.01 0.00 1.08 0.00 0.00 64.86 65.24 1dgn h ILE 58 Cb 0.64 1.12 -0.01 0.00 -1.09 0.00 0.00 36.82 37.48 1dgn h ILE 58 CO -0.43 0.25 0.06 -0.78 -1.08 0.00 0.00 178.15 176.16 1dgn h ASP 59 N 0.32 0.17 0.04 2.19 3.58 -0.95 -2.92 116.42 118.84 1dgn h ASP 59 Ca 0.07 -0.14 0.02 0.00 0.42 0.00 0.00 57.03 57.40 1dgn h ASP 59 Cb 0.35 -0.04 -0.03 0.00 1.72 0.00 0.00 39.33 41.33 1dgn h ASP 59 CO 0.02 0.26 -0.17 -0.07 -2.88 0.00 0.00 179.24 176.40 1dgn h LEU 60 N 0.06 -0.48 -0.41 2.28 3.38 -0.87 -2.03 115.31 117.24 1dgn h LEU 60 Ca 0.04 0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.15 1dgn h LEU 60 Cb 0.14 0.20 -0.09 0.00 0.09 0.00 0.00 40.66 40.99 1dgn h LEU 60 CO -0.00 -0.24 -0.39 0.58 0.09 0.00 0.00 178.44 178.48 1dgn h VAL 61 N -0.30 0.15 -0.07 1.22 2.07 -1.51 0.33 116.25 118.15 1dgn h VAL 61 Ca 0.04 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.58 1dgn h VAL 61 Cb 0.35 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1dgn h VAL 61 CO -0.14 0.00 0.07 0.74 0.02 0.00 0.00 177.57 178.27 1dgn h THR 62 N -0.29 0.56 -0.31 2.57 2.02 -1.32 -1.89 112.91 114.24 1dgn h THR 62 Ca 0.15 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.17 1dgn h THR 62 Cb 0.57 0.94 -0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1dgn h THR 62 CO -0.57 0.00 -0.48 1.23 0.37 0.00 0.00 175.52 176.08 1dgn h GLY 63 N 0.00 0.91 -2.05 2.16 0.00 0.38 -3.04 103.07 101.43 1dgn h GLY 63 Ca 0.03 -1.00 0.00 0.00 0.00 0.00 0.00 47.33 46.36 1dgn h GLY 63 CO -0.00 0.90 0.00 0.28 0.00 0.00 0.00 176.54 177.72 1dgn n LYS 64 N -4.02 0.94 -0.01 4.80 4.76 -0.71 -4.94 118.16 118.97 1dgn n LYS 64 Ca -0.03 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.41 1dgn n LYS 64 Cb 0.59 -1.03 -0.00 0.00 -1.84 0.00 0.00 35.03 32.75 1dgn n LYS 64 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1dgn n GLY 65 N 0.58 -2.13 0.14 0.72 0.00 -1.15 -4.41 105.19 98.94 1dgn n GLY 65 Ca 0.00 -1.48 0.13 0.00 0.00 0.00 0.00 46.02 44.67 1dgn n GLY 65 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dgn h PRO 66 N -0.01 0.00 -0.16 1.61 0.13 -1.86 -3.14 132.00 128.57 1dgn h PRO 66 Ca -0.00 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.18 1dgn h PRO 66 Cb 0.01 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.13 1dgn h PRO 66 CO 0.00 0.00 0.17 -0.22 -0.23 0.00 0.00 178.00 177.72 1dgn h LYS 67 N 0.00 0.00 0.00 0.86 3.11 -1.93 0.26 116.57 118.86 1dgn h LYS 67 Ca 0.00 0.00 -0.11 0.00 -2.81 0.00 0.00 60.65 57.73 1dgn h LYS 67 Cb 0.60 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.82 1dgn h LYS 67 CO 0.00 0.00 -0.54 1.03 -2.81 0.00 0.00 179.45 177.13 1dgn h SER 68 N 0.00 0.00 -0.32 4.20 0.87 -1.75 -3.31 113.55 113.24 1dgn h SER 68 Ca 0.08 0.00 0.06 0.00 -1.23 0.00 0.00 61.79 60.70 1dgn h SER 68 Cb 0.42 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.33 1dgn h SER 68 CO -0.00 0.54 -0.05 0.00 -0.53 0.00 0.00 176.83 176.80 1dgn h LYS 71 N -0.14 0.00 -0.24 0.00 1.57 -1.65 -2.32 116.57 113.80 1dgn h LYS 71 Ca 0.24 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.84 1dgn h LYS 71 Cb 0.53 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 1dgn h LYS 71 CO -0.66 0.28 -0.59 0.35 -0.57 0.00 0.00 179.45 178.26 1dgn h PHE 72 N 0.00 0.97 -0.05 -1.35 3.04 0.84 -1.30 116.94 119.10 1dgn h PHE 72 Ca -0.00 -0.36 -0.18 0.00 3.98 0.00 0.00 57.97 61.41 1dgn h PHE 72 Cb 0.59 -0.18 -0.01 0.00 2.56 0.00 0.00 35.95 38.92 1dgn h PHE 72 CO 0.00 1.17 -0.75 0.82 -2.02 0.00 0.00 178.31 177.53 1dgn h ILE 73 N 0.58 1.42 -0.07 1.41 2.04 -0.51 -2.09 117.51 120.29 1dgn h ILE 73 Ca 0.00 -2.26 -0.18 0.00 1.00 0.00 0.00 64.86 63.43 1dgn h ILE 73 Cb 1.18 2.20 0.01 0.00 -0.74 0.00 0.00 36.82 39.48 1dgn h ILE 73 CO 0.12 0.67 -0.64 0.11 0.00 0.00 0.00 178.15 178.41 1dgn h LYS 74 N 0.19 0.56 -0.43 2.37 1.57 -1.41 -2.76 116.57 116.66 1dgn h LYS 74 Ca -0.03 -0.51 -0.08 0.00 -1.87 0.00 0.00 60.65 58.16 1dgn h LYS 74 Cb 1.32 0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.74 1dgn h LYS 74 CO 0.12 1.13 -0.06 0.45 -0.57 0.00 0.00 179.45 180.52 1dgn h HIS 75 N 0.17 0.89 -0.08 -1.35 3.86 -1.28 -2.82 115.15 114.54 1dgn h HIS 75 Ca -0.06 -0.18 -0.03 0.00 -1.16 0.00 0.00 60.37 58.94 1dgn h HIS 75 Cb 1.30 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 29.54 1dgn h HIS 75 CO 0.12 0.89 -0.10 1.25 0.86 0.00 0.00 177.93 180.94 1dgn h LEU 76 N 0.63 0.10 0.75 2.43 5.85 -1.44 -2.56 115.31 121.06 1dgn h LEU 76 Ca 0.11 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 1dgn h LEU 76 Cb 0.58 -0.03 0.01 0.00 0.37 0.00 0.00 40.66 41.59 1dgn h LEU 76 CO 0.03 0.23 -0.36 0.00 -0.34 0.00 0.00 178.44 178.00 1dgn n GLU 78 N -5.48 0.16 -0.10 0.00 -0.00 -1.18 -2.45 120.64 111.59 1dgn n GLU 78 Ca -0.14 0.48 -0.22 0.00 -0.00 0.00 0.00 57.16 57.28 1dgn n GLU 78 Cb 0.41 -1.86 -0.12 0.00 -0.00 0.00 0.00 31.44 29.87 1dgn n GLU 78 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1dgn h GLU 79 N 0.00 0.01 -2.37 3.44 5.08 -1.18 -3.45 114.58 116.12 1dgn h GLU 79 Ca 0.00 -0.01 -0.59 0.00 -1.00 0.00 0.00 59.36 57.76 1dgn h GLU 79 Cb 0.24 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 29.11 1dgn h GLU 79 CO 0.00 1.01 -0.96 -3.47 -1.00 0.00 0.00 179.01 174.59 1dgn n ASP 80 N -4.41 -0.06 0.12 1.42 2.03 0.51 -4.96 116.55 111.20 1dgn n ASP 80 Ca -0.32 -2.50 0.19 0.00 0.52 0.00 0.00 54.79 52.68 1dgn n ASP 80 Cb 0.69 -0.58 0.67 0.00 -0.72 0.00 0.00 41.12 41.18 1dgn n ASP 80 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1dgn h PRO 81 N 5.36 0.00 0.00 -0.67 0.11 -1.67 -0.48 132.00 134.65 1dgn h PRO 81 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 1dgn h PRO 81 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1dgn h PRO 81 CO 0.42 0.00 0.00 0.94 -0.21 0.00 0.00 178.00 179.15 1dgn n GLN 82 N -3.36 0.00 0.05 1.05 0.00 -1.26 -2.80 117.38 111.06 1dgn n GLN 82 Ca 0.07 0.34 0.17 0.00 -0.00 0.00 0.00 57.00 57.59 1dgn n GLN 82 Cb 0.73 -1.17 0.67 0.00 0.00 0.00 0.00 30.24 30.47 1dgn n GLN 82 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.06 178.31 1dgn h LEU 83 N 0.00 0.02 -0.73 1.69 5.85 -1.88 0.22 115.31 120.48 1dgn h LEU 83 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1dgn h LEU 83 Cb 0.00 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1dgn h LEU 83 CO 0.00 0.01 0.00 0.00 -0.34 0.00 0.00 178.44 178.11 1dgn n ALA 84 N -2.61 1.32 -0.15 1.25 0.00 -0.22 -2.42 120.51 117.68 1dgn n ALA 84 Ca 0.07 0.09 -0.08 0.00 0.00 0.00 0.00 53.44 53.52 1dgn n ALA 84 Cb 0.48 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1dgn n ALA 84 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1dgn h SER 85 N 0.00 0.60 1.14 0.00 4.64 -0.39 1.54 113.55 121.09 1dgn h SER 85 Ca 0.00 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1dgn h SER 85 Cb 0.15 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1dgn h SER 85 CO 0.00 0.59 -0.34 0.29 -0.87 0.00 0.00 176.83 176.50 1dgn n LYS 86 N -4.62 0.28 -0.56 4.77 5.02 -1.01 -3.62 118.16 118.42 1dgn n LYS 86 Ca 0.01 0.14 0.05 0.00 -2.02 0.00 0.00 58.31 56.50 1dgn n LYS 86 Cb 0.13 -1.74 0.20 0.00 -0.02 0.00 0.00 35.03 33.61 1dgn n LYS 86 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1dgn n MET 87 N -2.18 1.60 -3.02 1.97 2.81 -0.91 -4.76 117.12 112.62 1dgn n MET 87 Ca 0.04 -3.20 -0.19 0.00 -1.81 0.00 0.00 57.70 52.54 1dgn n MET 87 Cb 0.43 -1.63 -0.02 0.00 -0.71 0.00 0.00 33.22 31.29 1dgn n MET 87 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1dgn n GLY 88 N -1.15 3.93 0.34 3.03 0.00 0.52 -4.86 105.19 107.01 1dgn n GLY 88 Ca 0.20 -1.95 0.19 0.00 0.00 0.00 0.00 46.02 44.46 1dgn n GLY 88 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1dgn h LEU 89 N 2.97 -0.29 0.00 0.99 -0.00 -1.82 -3.47 115.31 113.69 1dgn h LEU 89 Ca 0.09 0.28 0.00 0.00 -0.00 0.00 0.00 57.88 58.25 1dgn h LEU 89 Cb 0.88 0.44 0.00 0.00 -0.00 0.00 0.00 40.66 41.99 1dgn h LEU 89 CO 0.59 -0.39 0.00 1.41 -0.00 0.00 0.00 178.44 180.06