#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bnp n SER 2 N 0.00 -6.19 -4.68 6.12 7.64 -1.26 -5.00 113.62 110.25 1bnp n SER 2 Ca 0.00 -0.48 -0.23 0.00 1.01 0.00 0.00 58.87 59.17 1bnp n SER 2 Cb 0.00 -4.84 -0.07 0.00 -1.01 0.00 0.00 64.21 58.29 1bnp n SER 2 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1bnp s LYS 3 N -6.17 2.36 -0.05 1.43 -0.14 -1.26 -5.05 119.74 110.86 1bnp s LYS 3 Ca 0.52 -1.44 -0.01 0.00 -1.36 0.00 0.00 55.97 53.69 1bnp s LYS 3 Cb -0.23 -2.19 -0.03 0.00 -1.68 0.00 0.00 37.83 33.71 1bnp s LYS 3 CO 0.64 0.29 -0.05 0.54 -0.76 0.00 0.00 175.35 176.02 1bnp n ARG 4 N -0.99 0.11 -4.23 1.68 1.74 -1.26 -5.06 116.66 108.65 1bnp n ARG 4 Ca -0.06 0.04 -0.23 0.00 -0.77 0.00 0.00 57.85 56.83 1bnp n ARG 4 Cb 0.60 -0.88 -0.06 0.00 -1.02 0.00 0.00 32.46 31.09 1bnp n ARG 4 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 1bnp s LYS 5 N -2.09 2.46 0.34 5.56 0.00 -1.26 -5.12 119.74 119.62 1bnp s LYS 5 Ca -0.06 -1.34 -0.07 0.00 0.00 0.00 0.00 55.97 54.50 1bnp s LYS 5 Cb 0.02 -2.26 -0.06 0.00 0.00 0.00 0.00 37.83 35.53 1bnp s LYS 5 CO 0.09 0.35 0.64 0.00 0.00 0.00 0.00 175.35 176.44 1bnp s ALA 6 N -2.29 3.52 0.41 0.59 0.00 -1.26 -4.97 121.76 117.76 1bnp s ALA 6 Ca 0.32 -0.43 0.07 0.00 0.00 0.00 0.00 51.96 51.92 1bnp s ALA 6 Cb -0.06 -2.45 0.86 0.00 0.00 0.00 0.00 23.12 21.46 1bnp s ALA 6 CO 0.21 0.13 2.06 -1.35 0.00 0.00 0.00 175.76 176.81 1bnp h PRO 7 N 1.47 0.54 -5.37 0.00 0.11 -2.05 -3.36 132.00 123.34 1bnp h PRO 7 Ca -0.47 -0.03 -0.65 0.00 0.11 0.00 0.00 66.00 64.96 1bnp h PRO 7 Cb 1.19 -0.12 -0.15 0.00 0.11 0.00 0.00 31.00 32.02 1bnp h PRO 7 CO 0.65 0.36 0.36 -0.65 -0.21 0.00 0.00 178.00 178.51 1bnp s GLN 8 N -5.50 3.18 0.08 1.05 -0.21 -1.26 -5.00 119.66 112.00 1bnp s GLN 8 Ca -0.08 -0.70 -0.10 0.00 0.02 0.00 0.00 55.36 54.50 1bnp s GLN 8 Cb 0.17 -4.13 0.00 0.00 1.00 0.00 0.00 33.01 30.05 1bnp s GLN 8 CO 0.73 -1.50 0.22 -2.00 -2.12 0.00 0.00 175.29 170.62 1bnp s GLU 9 N 3.47 0.83 -0.02 2.91 2.12 -1.26 -5.11 118.70 121.65 1bnp s GLU 9 Ca 0.22 -0.84 -0.30 0.00 0.36 0.00 0.00 54.97 54.41 1bnp s GLU 9 Cb -0.17 0.34 -0.08 0.00 0.26 0.00 0.00 34.13 34.49 1bnp s GLU 9 CO 0.13 -0.27 1.95 -0.08 -0.54 0.00 0.00 175.26 176.46 1bnp s THR 10 N -3.52 3.11 -0.59 -1.70 -1.32 -1.26 -4.92 115.64 105.44 1bnp s THR 10 Ca 0.02 0.13 -0.24 0.00 -1.21 0.00 0.00 61.69 60.39 1bnp s THR 10 Cb 0.03 -3.09 0.05 0.00 -1.51 0.00 0.00 72.50 67.97 1bnp s THR 10 CO -0.09 -0.02 0.99 -0.22 -2.21 0.00 0.00 174.62 173.07 1bnp s LEU 11 N 4.97 4.04 0.00 9.08 2.96 -1.26 -5.00 118.68 133.47 1bnp s LEU 11 Ca 0.88 -0.47 0.00 0.00 -0.22 0.00 0.00 54.13 54.31 1bnp s LEU 11 Cb -0.40 -2.74 -0.00 0.00 0.50 0.00 0.00 46.19 43.56 1bnp s LEU 11 CO 0.39 -1.35 0.00 0.59 -1.32 0.00 0.00 176.35 174.66 1bnp n ASN 12 N 7.75 1.80 0.00 3.68 4.13 -1.26 -5.11 115.26 126.25 1bnp n ASN 12 Ca 0.01 -1.05 0.00 0.00 1.68 0.00 0.00 54.58 55.22 1bnp n ASN 12 Cb 0.47 0.01 0.00 0.00 -1.54 0.00 0.00 39.78 38.72 1bnp n ASN 12 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1bnp n GLY 13 N 4.30 -0.05 0.00 7.41 0.00 -1.26 -5.00 105.19 110.59 1bnp n GLY 13 Ca -0.00 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1bnp n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bnp n GLY 14 N 0.08 1.93 0.10 -0.02 0.00 -1.26 -4.91 105.19 101.11 1bnp n GLY 14 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1bnp n GLY 14 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1bnp h ILE 15 N 0.00 0.00 0.00 -0.61 2.04 -1.96 -3.13 117.51 113.85 1bnp h ILE 15 Ca 0.00 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1bnp h ILE 15 Cb 0.00 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1bnp h ILE 15 CO 0.00 0.00 0.06 0.00 0.00 0.00 0.00 178.15 178.21 1bnp h THR 16 N -0.51 0.00 -0.03 -0.27 1.03 -1.93 -1.89 112.91 109.30 1bnp h THR 16 Ca -0.02 0.00 -0.03 0.00 -0.01 0.00 0.00 66.41 66.35 1bnp h THR 16 Cb 0.17 0.82 0.00 0.00 -1.07 0.00 0.00 68.15 68.07 1bnp h THR 16 CO 0.04 0.00 -0.08 0.44 -0.01 0.00 0.00 175.52 175.90 1bnp h ASP 17 N 0.00 0.13 1.12 0.00 5.19 -1.98 -2.05 116.42 118.83 1bnp h ASP 17 Ca 0.00 -0.59 0.00 0.00 -0.62 0.00 0.00 57.03 55.82 1bnp h ASP 17 Cb 0.12 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 39.59 1bnp h ASP 17 CO 0.00 0.70 -0.06 0.23 -3.12 0.00 0.00 179.24 176.99 1bnp n MET 18 N -4.69 0.10 0.04 3.56 2.81 -0.90 -2.62 117.12 115.41 1bnp n MET 18 Ca -0.08 0.07 -0.17 0.00 -1.81 0.00 0.00 57.70 55.71 1bnp n MET 18 Cb 0.35 -1.61 -0.14 0.00 -0.71 0.00 0.00 33.22 31.11 1bnp n MET 18 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1bnp h LEU 19 N 0.00 0.35 -0.62 4.03 3.38 -1.35 -3.00 115.31 118.09 1bnp h LEU 19 Ca 0.00 -0.57 -0.11 0.00 0.09 0.00 0.00 57.88 57.30 1bnp h LEU 19 Cb 0.59 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1bnp h LEU 19 CO 0.00 1.49 -0.51 0.58 0.09 0.00 0.00 178.44 180.09 1bnp h VAL 20 N 0.06 1.07 -0.13 1.22 2.07 -1.39 -2.96 116.25 116.19 1bnp h VAL 20 Ca -0.29 -1.97 -0.20 0.00 0.82 0.00 0.00 66.70 65.07 1bnp h VAL 20 Cb 2.02 2.16 0.00 0.00 -1.52 0.00 0.00 31.29 33.96 1bnp h VAL 20 CO 0.13 0.50 -0.72 -0.08 0.02 0.00 0.00 177.57 177.42 1bnp h GLU 21 N 0.00 0.60 -0.87 1.57 4.81 -1.58 0.01 114.58 119.12 1bnp h GLU 21 Ca -0.01 -0.47 0.08 0.00 -0.13 0.00 0.00 59.36 58.83 1bnp h GLU 21 Cb 1.12 0.09 -0.07 0.00 0.63 0.00 0.00 28.75 30.52 1bnp h GLU 21 CO 0.07 1.09 0.53 1.25 -0.73 0.00 0.00 179.01 181.22 1bnp h LEU 22 N 0.41 0.81 -0.08 1.64 7.12 -1.37 0.11 115.31 123.95 1bnp h LEU 22 Ca -0.03 0.03 -0.06 0.00 0.13 0.00 0.00 57.88 57.95 1bnp h LEU 22 Cb 1.32 -0.14 -0.01 0.00 -0.53 0.00 0.00 40.66 41.30 1bnp h LEU 22 CO 0.14 0.49 -0.27 0.00 -0.13 0.00 0.00 178.44 178.67 1bnp h ALA 23 N 1.44 0.84 -0.00 1.25 0.00 -1.40 -3.12 119.26 118.26 1bnp h ALA 23 Ca 0.40 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1bnp h ALA 23 Cb 0.26 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1bnp h ALA 23 CO -0.20 0.33 0.00 -1.71 0.00 0.00 0.00 179.25 177.67 1bnp n ASN 24 N -3.18 0.12 -0.43 0.00 5.15 0.29 -4.11 115.26 113.10 1bnp n ASN 24 Ca 0.03 -1.14 0.35 0.00 -0.60 0.00 0.00 54.58 53.22 1bnp n ASN 24 Cb 0.63 -0.00 0.64 0.00 -0.53 0.00 0.00 39.78 40.52 1bnp n ASN 24 CO 0.00 0.00 0.00 -0.26 1.40 0.00 0.00 177.26 178.40 1bnp h PHE 25 N 0.18 0.46 -2.72 1.20 0.04 -1.27 -3.44 116.94 111.39 1bnp h PHE 25 Ca 0.00 0.02 -0.37 0.00 2.80 0.00 0.00 57.97 60.42 1bnp h PHE 25 Cb 0.04 -0.12 -0.05 0.00 2.20 0.00 0.00 35.95 38.02 1bnp h PHE 25 CO 0.00 -0.11 -0.44 0.39 -0.60 0.00 0.00 178.31 177.55 1bnp n GLU 26 N -4.57 -1.73 0.10 1.51 1.02 -1.26 -4.55 120.64 111.17 1bnp n GLU 26 Ca 0.34 0.94 0.00 0.00 -0.02 0.00 0.00 57.16 58.43 1bnp n GLU 26 Cb 1.35 -5.52 0.00 0.00 -0.02 0.00 0.00 31.44 27.25 1bnp n GLU 26 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1bnp n LYS 27 N -2.77 0.00 0.04 3.49 4.81 -1.26 -4.76 118.16 117.70 1bnp n LYS 27 Ca -0.21 0.00 0.12 0.00 -0.87 0.00 0.00 58.31 57.35 1bnp n LYS 27 Cb 0.65 0.00 0.16 0.00 0.02 0.00 0.00 35.03 35.86 1bnp n LYS 27 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1bnp n ASN 28 N -2.90 0.63 -2.18 3.14 5.15 -1.26 -4.33 115.26 113.51 1bnp n ASN 28 Ca 0.00 -0.04 -0.01 0.00 -0.60 0.00 0.00 54.58 53.92 1bnp n ASN 28 Cb 0.00 0.32 0.05 0.00 -0.53 0.00 0.00 39.78 39.61 1bnp n ASN 28 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1bnp n VAL 29 N -1.92 0.38 0.00 3.44 0.31 -1.26 -4.87 118.33 114.40 1bnp n VAL 29 Ca 0.04 -1.37 0.00 0.00 -0.01 0.00 0.00 64.34 63.00 1bnp n VAL 29 Cb 0.41 0.99 0.00 0.00 -0.91 0.00 0.00 33.84 34.33 1bnp n VAL 29 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1bnp n SER 30 N -0.59 0.00 -3.71 4.52 2.88 -1.26 -4.39 113.62 111.07 1bnp n SER 30 Ca -0.08 0.11 -0.13 0.00 -1.33 0.00 0.00 58.87 57.43 1bnp n SER 30 Cb 0.87 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 64.24 1bnp n SER 30 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1bnp s GLN 31 N -0.21 0.56 -0.71 -1.46 -2.07 -1.26 -4.71 119.66 109.79 1bnp s GLN 31 Ca 0.00 0.63 -0.01 0.00 -1.82 0.00 0.00 55.36 54.16 1bnp s GLN 31 Cb 0.00 0.27 0.00 0.00 -1.09 0.00 0.00 33.01 32.19 1bnp s GLN 31 CO 0.00 -0.07 0.10 0.00 -1.32 0.00 0.00 175.29 174.00 1bnp n ALA 32 N 2.76 -0.32 -1.99 2.60 0.00 -1.26 -5.02 120.51 117.28 1bnp n ALA 32 Ca -0.14 0.09 -0.23 0.00 0.00 0.00 0.00 53.44 53.16 1bnp n ALA 32 Cb 0.57 -1.49 0.09 0.00 0.00 0.00 0.00 19.45 18.62 1bnp n ALA 32 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bnp s ILE 33 N -2.58 2.23 -0.04 0.00 -1.09 -1.26 -5.01 121.20 113.45 1bnp s ILE 33 Ca 0.05 -0.60 -0.18 0.00 -2.23 0.00 0.00 60.65 57.69 1bnp s ILE 33 Cb -0.02 -2.63 -0.31 0.00 -1.58 0.00 0.00 42.46 37.91 1bnp s ILE 33 CO 0.06 0.00 0.80 0.45 -1.23 0.00 0.00 174.94 175.02 1bnp h HIS 34 N -0.42 0.64 -0.01 3.97 3.86 -1.95 -3.32 115.15 117.92 1bnp h HIS 34 Ca -0.37 -0.47 0.00 0.00 -1.16 0.00 0.00 60.37 58.37 1bnp h HIS 34 Cb 1.27 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.72 1bnp h HIS 34 CO -0.07 1.48 -0.33 1.63 0.86 0.00 0.00 177.93 181.50 1bnp n LYS 35 N -3.92 0.76 0.20 2.45 5.02 -1.26 -3.99 118.16 117.42 1bnp n LYS 35 Ca -0.19 -0.48 0.06 0.00 -2.02 0.00 0.00 58.31 55.68 1bnp n LYS 35 Cb 0.94 -1.49 0.44 0.00 -0.02 0.00 0.00 35.03 34.90 1bnp n LYS 35 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 1bnp h TYR 36 N 1.16 0.00 0.00 2.13 3.20 -1.89 -2.00 116.97 119.57 1bnp h TYR 36 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1bnp h TYR 36 Cb 0.53 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.80 1bnp h TYR 36 CO 0.00 0.31 0.00 -0.91 -1.64 0.00 0.00 178.16 175.92 1bnp h ASN 37 N 0.00 0.00 -0.09 -2.11 2.35 -1.74 -1.64 115.58 112.35 1bnp h ASN 37 Ca -0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1bnp h ASN 37 Cb 0.65 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.02 1bnp h ASN 37 CO 0.04 0.00 0.01 0.00 -1.65 0.00 0.00 177.43 175.83 1bnp h ALA 38 N 2.03 0.12 0.00 -0.83 0.00 -1.61 -2.47 119.26 116.51 1bnp h ALA 38 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1bnp h ALA 38 Cb 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1bnp h ALA 38 CO 0.00 -0.21 -0.77 0.66 0.00 0.00 0.00 179.25 178.93 1bnp n TYR 39 N -4.85 0.28 0.07 0.00 4.01 -1.18 -2.73 117.16 112.77 1bnp n TYR 39 Ca -0.06 0.08 -0.21 0.00 -0.16 0.00 0.00 57.90 57.55 1bnp n TYR 39 Cb 0.18 -0.45 -0.15 0.00 -0.31 0.00 0.00 39.34 38.62 1bnp n TYR 39 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 1bnp h ARG 40 N 0.00 0.36 0.17 -0.72 9.65 -1.30 -1.97 114.38 120.56 1bnp h ARG 40 Ca 0.00 -0.61 -0.31 0.00 -1.10 0.00 0.00 59.98 57.96 1bnp h ARG 40 Cb 0.67 0.23 0.03 0.00 -1.39 0.00 0.00 29.97 29.50 1bnp h ARG 40 CO 0.00 1.29 -1.32 0.87 2.80 0.00 0.00 179.97 183.61 1bnp h LYS 41 N -0.23 0.54 0.19 0.20 1.57 -1.60 -2.79 116.57 114.45 1bnp h LYS 41 Ca -0.20 -0.81 -0.01 0.00 -1.87 0.00 0.00 60.65 57.77 1bnp h LYS 41 Cb 1.80 0.28 0.00 0.00 0.08 0.00 0.00 32.23 34.39 1bnp h LYS 41 CO 0.17 1.37 -0.09 0.00 -0.57 0.00 0.00 179.45 180.34 1bnp h ALA 42 N 0.30 -0.25 -0.13 3.86 0.00 -1.64 -2.65 119.26 118.75 1bnp h ALA 42 Ca -0.20 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.59 1bnp h ALA 42 Cb 2.01 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.89 1bnp h ALA 42 CO 0.25 -0.51 0.11 0.00 0.00 0.00 0.00 179.25 179.10 1bnp h ALA 43 N 0.24 1.91 -0.38 0.00 0.00 -1.47 0.16 119.26 119.73 1bnp h ALA 43 Ca -0.03 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1bnp h ALA 43 Cb 0.39 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1bnp h ALA 43 CO 0.04 -0.17 0.13 1.03 0.00 0.00 0.00 179.25 180.28 1bnp h SER 44 N 0.00 0.53 0.02 0.00 0.87 -1.18 -2.30 113.55 111.49 1bnp h SER 44 Ca 0.06 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1bnp h SER 44 Cb 0.28 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.10 1bnp h SER 44 CO -0.00 0.58 -0.04 0.55 -0.53 0.00 0.00 176.83 177.38 1bnp n VAL 45 N -4.64 0.00 -0.08 2.23 3.14 -0.55 -3.93 118.33 114.49 1bnp n VAL 45 Ca -0.01 -0.25 -0.10 0.00 -2.96 0.00 0.00 64.34 61.03 1bnp n VAL 45 Cb 0.16 0.55 -0.04 0.00 -1.06 0.00 0.00 33.84 33.44 1bnp n VAL 45 CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 1bnp n ILE 46 N 0.11 1.45 -0.24 1.55 -0.00 0.46 -3.23 119.36 119.46 1bnp n ILE 46 Ca 0.18 0.13 -0.06 0.00 -0.00 0.00 0.00 62.75 63.00 1bnp n ILE 46 Cb 0.37 -2.29 0.05 0.00 -0.00 0.00 0.00 39.64 37.77 1bnp n ILE 46 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1bnp h ALA 47 N -0.87 0.87 -0.37 -1.39 0.00 -1.62 -2.11 119.26 113.76 1bnp h ALA 47 Ca -0.11 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 1bnp h ALA 47 Cb 0.77 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1bnp h ALA 47 CO -0.07 0.35 -0.22 1.57 0.00 0.00 0.00 179.25 180.88 1bnp h LYS 48 N 0.93 0.72 -6.76 0.00 2.10 -1.78 -3.42 116.57 108.35 1bnp h LYS 48 Ca 0.24 -0.28 -0.52 0.00 -2.00 0.00 0.00 60.65 58.09 1bnp h LYS 48 Cb -0.01 -0.04 0.05 0.00 -0.90 0.00 0.00 32.23 31.33 1bnp h LYS 48 CO -0.04 0.88 0.65 -0.47 -2.00 0.00 0.00 179.45 178.47 1bnp s TYR 49 N -4.60 3.17 0.49 0.07 5.04 -0.79 -4.84 117.35 115.90 1bnp s TYR 49 Ca -0.09 1.28 0.04 0.00 -2.44 0.00 0.00 57.07 55.87 1bnp s TYR 49 Cb 0.13 -3.64 0.23 0.00 0.35 0.00 0.00 41.96 39.03 1bnp s TYR 49 CO 0.83 -1.91 1.03 -1.35 -1.34 0.00 0.00 175.55 172.80 1bnp h PRO 50 N 4.58 0.00 0.00 4.97 0.11 -1.80 -3.46 132.00 136.40 1bnp h PRO 50 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1bnp h PRO 50 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1bnp h PRO 50 CO 0.73 0.00 0.00 -2.39 -0.21 0.00 0.00 178.00 176.13 1bnp n HIS 51 N -2.24 -0.53 -3.62 0.65 1.44 -1.26 -4.87 115.22 104.81 1bnp n HIS 51 Ca -0.00 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.49 1bnp n HIS 51 Cb 0.79 0.08 0.04 0.00 0.12 0.00 0.00 29.99 31.02 1bnp n HIS 51 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 1bnp n LYS 52 N -0.12 -3.89 -3.40 -1.40 4.81 -1.26 -4.96 118.16 107.94 1bnp n LYS 52 Ca 0.00 0.64 -0.35 0.00 -0.87 0.00 0.00 58.31 57.73 1bnp n LYS 52 Cb 0.00 -5.11 -0.06 0.00 0.02 0.00 0.00 35.03 29.88 1bnp n LYS 52 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 1bnp s ILE 53 N -3.58 4.91 -0.04 3.15 -4.36 -1.26 -4.69 121.20 115.33 1bnp s ILE 53 Ca 0.16 0.71 0.12 0.00 -0.26 0.00 0.00 60.65 61.37 1bnp s ILE 53 Cb -0.04 -3.70 -0.23 0.00 1.25 0.00 0.00 42.46 39.74 1bnp s ILE 53 CO 0.81 0.20 0.68 0.11 0.24 0.00 0.00 174.94 176.97 1bnp h LYS 54 N 3.42 0.01 0.00 0.37 1.57 -1.93 -3.46 116.57 116.55 1bnp h LYS 54 Ca -0.48 -0.02 -0.21 0.00 -1.87 0.00 0.00 60.65 58.06 1bnp h LYS 54 Cb 1.19 0.01 0.01 0.00 0.08 0.00 0.00 32.23 33.51 1bnp h LYS 54 CO 0.66 0.54 -0.05 0.43 -0.57 0.00 0.00 179.45 180.47 1bnp n SER 55 N -3.07 1.06 -0.04 0.86 7.64 -1.26 -4.99 113.62 113.82 1bnp n SER 55 Ca -0.17 -1.69 -0.00 0.00 1.01 0.00 0.00 58.87 58.02 1bnp n SER 55 Cb 1.05 -0.15 -0.10 0.00 -1.01 0.00 0.00 64.21 64.00 1bnp n SER 55 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bnp n GLY 56 N 2.01 -0.61 0.31 0.23 0.00 -1.26 -4.44 105.19 101.43 1bnp n GLY 56 Ca 0.06 -0.25 0.17 0.00 0.00 0.00 0.00 46.02 45.99 1bnp n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bnp h ALA 57 N 0.88 1.40 0.86 4.61 0.00 -1.97 -2.88 119.26 122.16 1bnp h ALA 57 Ca -0.18 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 1bnp h ALA 57 Cb 1.24 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.04 1bnp h ALA 57 CO 0.01 -0.00 -0.41 0.93 0.00 0.00 0.00 179.25 179.78 1bnp h GLU 58 N 0.00 -1.11 -0.02 0.00 5.08 -2.01 -2.21 114.58 114.31 1bnp h GLU 58 Ca 0.00 0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1bnp h GLU 58 Cb 0.00 0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 1bnp h GLU 58 CO -0.00 -0.74 0.11 0.00 -1.00 0.00 0.00 179.01 177.39 1bnp h ALA 59 N -1.17 1.22 -0.16 3.43 0.00 -1.80 -0.98 119.26 119.81 1bnp h ALA 59 Ca -0.12 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.58 1bnp h ALA 59 Cb 0.89 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1bnp h ALA 59 CO 0.19 -0.12 -0.72 0.87 0.00 0.00 0.00 179.25 179.47 1bnp h LYS 60 N 0.00 0.71 0.00 0.00 1.57 -1.31 -3.04 116.57 114.50 1bnp h LYS 60 Ca 0.01 -0.55 -0.06 0.00 -1.87 0.00 0.00 60.65 58.18 1bnp h LYS 60 Cb 0.23 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1bnp h LYS 60 CO -0.00 1.17 -0.29 1.57 -0.57 0.00 0.00 179.45 181.32 1bnp h LYS 61 N 0.50 0.00 -6.00 3.15 2.10 -0.69 -3.43 116.57 112.19 1bnp h LYS 61 Ca -0.03 0.00 -0.67 0.00 -2.00 0.00 0.00 60.65 57.95 1bnp h LYS 61 Cb 1.33 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.65 1bnp h LYS 61 CO 0.14 0.29 1.40 1.28 -2.00 0.00 0.00 179.45 180.57 1bnp n LEU 62 N -3.91 2.25 -4.56 7.07 4.77 -1.15 -4.78 117.00 116.69 1bnp n LEU 62 Ca -0.02 0.44 -0.16 0.00 -0.03 0.00 0.00 56.01 56.24 1bnp n LEU 62 Cb 0.37 -1.28 -0.07 0.00 -2.33 0.00 0.00 43.42 40.12 1bnp n LEU 62 CO 0.36 -0.70 1.26 -2.16 -1.33 0.00 0.00 177.39 174.83 1bnp s PRO 63 N 6.07 1.73 0.00 3.23 0.04 -1.26 -1.92 135.00 142.88 1bnp s PRO 63 Ca 1.08 0.44 0.00 0.00 0.04 0.00 0.00 61.00 62.56 1bnp s PRO 63 Cb -0.83 -4.81 0.00 0.00 0.04 0.00 0.00 34.50 28.90 1bnp s PRO 63 CO 0.49 -4.28 0.00 0.41 0.04 0.00 0.00 177.00 173.66 1bnp n GLY 64 N 6.78 2.70 3.19 0.56 0.00 -1.26 -4.97 105.19 112.19 1bnp n GLY 64 Ca 0.46 -0.33 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1bnp n GLY 64 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bnp s VAL 65 N 0.00 4.90 -0.45 1.61 1.01 -0.81 -4.63 120.40 122.02 1bnp s VAL 65 Ca 0.00 -3.57 0.07 0.00 0.00 0.00 0.00 61.98 58.48 1bnp s VAL 65 Cb 0.00 -4.01 0.18 0.00 0.00 0.00 0.00 36.38 32.55 1bnp s VAL 65 CO 0.00 -1.10 0.64 -0.83 0.00 0.00 0.00 175.10 173.81 1bnp s GLY 66 N 0.52 -1.06 0.00 4.51 0.00 -1.26 -4.21 107.32 105.81 1bnp s GLY 66 Ca 0.27 -0.26 0.00 0.00 0.00 0.00 0.00 44.72 44.73 1bnp s GLY 66 CO -0.10 3.53 0.00 -0.37 0.00 0.00 0.00 173.10 176.16 1bnp n THR 67 N 3.71 0.00 0.00 0.90 5.66 -1.26 -5.01 114.28 118.28 1bnp n THR 67 Ca 0.15 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.15 1bnp n THR 67 Cb 0.55 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.33 1bnp n THR 67 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1bnp n LYS 68 N -0.42 0.00 0.30 1.09 4.81 -1.26 -4.90 118.16 117.78 1bnp n LYS 68 Ca 0.00 0.00 0.17 0.00 -0.87 0.00 0.00 58.31 57.61 1bnp n LYS 68 Cb 0.00 0.00 0.97 0.00 0.02 0.00 0.00 35.03 36.02 1bnp n LYS 68 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 1bnp h ILE 69 N 0.00 0.33 -0.78 3.15 1.08 -1.92 -2.25 117.51 117.11 1bnp h ILE 69 Ca 0.00 -0.13 0.08 0.00 -0.39 0.00 0.00 64.86 64.42 1bnp h ILE 69 Cb 0.00 1.09 -0.05 0.00 -3.07 0.00 0.00 36.82 34.79 1bnp h ILE 69 CO 0.00 0.02 0.51 0.00 -0.69 0.00 0.00 178.15 177.99 1bnp h ALA 70 N 1.98 1.72 -0.10 1.87 0.00 -1.91 0.13 119.26 122.94 1bnp h ALA 70 Ca -0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1bnp h ALA 70 Cb 0.09 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1bnp h ALA 70 CO 0.00 0.14 -0.43 1.49 0.00 0.00 0.00 179.25 180.45 1bnp h GLU 71 N 0.77 0.24 -0.11 0.00 4.81 -1.80 -2.76 114.58 115.73 1bnp h GLU 71 Ca 0.35 -0.12 -0.11 0.00 -0.13 0.00 0.00 59.36 59.35 1bnp h GLU 71 Cb 0.36 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1bnp h GLU 71 CO -0.13 0.63 -0.42 -0.22 -0.73 0.00 0.00 179.01 178.14 1bnp h LYS 72 N 0.20 0.24 0.12 1.92 1.63 -1.09 -1.92 116.57 117.67 1bnp h LYS 72 Ca 0.02 -0.12 -0.01 0.00 -0.85 0.00 0.00 60.65 59.69 1bnp h LYS 72 Cb 0.84 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.47 1bnp h LYS 72 CO 0.07 0.63 -0.06 0.82 -3.45 0.00 0.00 179.45 177.45 1bnp h ILE 73 N 0.20 0.98 0.00 2.00 1.08 -1.09 -2.28 117.51 118.40 1bnp h ILE 73 Ca 0.02 -0.42 -0.02 0.00 -0.39 0.00 0.00 64.86 64.05 1bnp h ILE 73 Cb 0.83 1.24 -0.00 0.00 -3.07 0.00 0.00 36.82 35.82 1bnp h ILE 73 CO 0.07 0.10 -0.11 -0.78 -0.69 0.00 0.00 178.15 176.73 1bnp h ASP 74 N -0.36 0.00 -0.78 1.72 3.58 -1.48 -1.81 116.42 117.29 1bnp h ASP 74 Ca -0.02 0.00 0.01 0.00 0.42 0.00 0.00 57.03 57.44 1bnp h ASP 74 Cb 0.29 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.30 1bnp h ASP 74 CO 0.03 0.11 0.51 -0.08 -2.88 0.00 0.00 179.24 176.94 1bnp h GLU 75 N 0.00 1.02 0.14 0.28 4.81 -0.76 0.83 114.58 120.90 1bnp h GLU 75 Ca -0.00 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1bnp h GLU 75 Cb 0.25 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1bnp h GLU 75 CO 0.01 0.68 -0.07 0.74 -0.73 0.00 0.00 179.01 179.65 1bnp h PHE 76 N 1.05 -0.17 -0.54 0.92 0.04 -1.11 -2.93 116.94 114.21 1bnp h PHE 76 Ca 0.28 -0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.86 1bnp h PHE 76 Cb -0.12 0.06 -0.11 0.00 2.20 0.00 0.00 35.95 37.97 1bnp h PHE 76 CO 0.00 0.11 0.24 1.28 -0.60 0.00 0.00 178.31 179.34 1bnp n LEU 77 N -5.05 4.89 -0.08 1.54 4.77 -0.95 -4.19 117.00 117.94 1bnp n LEU 77 Ca -0.09 -2.54 -0.20 0.00 -0.03 0.00 0.00 56.01 53.15 1bnp n LEU 77 Cb 0.19 -0.68 -0.12 0.00 -2.33 0.00 0.00 43.42 40.48 1bnp n LEU 77 CO 0.33 0.70 -0.38 0.00 -1.33 0.00 0.00 177.39 176.71 1bnp h ALA 78 N 2.24 0.22 0.00 -1.18 0.00 0.88 -3.47 119.26 117.95 1bnp h ALA 78 Ca 0.23 -1.09 0.00 0.00 0.00 0.00 0.00 54.91 54.05 1bnp h ALA 78 Cb 1.90 0.58 0.00 0.00 0.00 0.00 0.00 17.79 20.28 1bnp h ALA 78 CO 0.55 0.64 0.00 2.41 0.00 0.00 0.00 179.25 182.85 1bnp n THR 79 N -4.34 0.28 0.00 0.00 -1.04 -1.26 -5.06 114.28 102.86 1bnp n THR 79 Ca -0.28 0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 1bnp n THR 79 Cb 0.70 -0.83 0.00 0.00 -1.82 0.00 0.00 70.33 68.38 1bnp n THR 79 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1bnp n GLY 80 N 2.78 3.06 3.38 3.41 0.00 -1.26 -5.04 105.19 111.53 1bnp n GLY 80 Ca 0.00 -1.13 -0.43 0.00 0.00 0.00 0.00 46.02 44.46 1bnp n GLY 80 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bnp s LYS 81 N 0.00 2.92 -0.09 1.61 2.20 -1.26 -5.04 119.74 120.08 1bnp s LYS 81 Ca 0.00 -1.29 -0.05 0.00 -0.36 0.00 0.00 55.97 54.27 1bnp s LYS 81 Cb 0.00 -4.04 0.04 0.00 -1.51 0.00 0.00 37.83 32.32 1bnp s LYS 81 CO 0.00 -0.95 0.21 -0.51 -0.36 0.00 0.00 175.35 173.74 1bnp s LEU 82 N 1.61 0.59 -0.07 5.43 1.43 -1.26 -5.02 118.68 121.40 1bnp s LEU 82 Ca 0.04 0.45 0.03 0.00 -1.03 0.00 0.00 54.13 53.61 1bnp s LEU 82 Cb -0.23 0.62 0.08 0.00 0.03 0.00 0.00 46.19 46.69 1bnp s LEU 82 CO 0.07 -0.15 0.64 -2.11 0.23 0.00 0.00 176.35 175.03 1bnp n ARG 83 N 4.09 0.26 -0.02 1.70 1.85 -1.26 -5.05 116.66 118.23 1bnp n ARG 83 Ca -0.24 -0.31 -0.02 0.00 -1.00 0.00 0.00 57.85 56.29 1bnp n ARG 83 Cb 0.53 0.22 -0.01 0.00 -1.05 0.00 0.00 32.46 32.16 1bnp n ARG 83 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1bnp n LYS 84 N -0.30 0.11 0.00 2.89 5.02 -1.26 -4.80 118.16 119.82 1bnp n LYS 84 Ca -0.05 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 1bnp n LYS 84 Cb 0.54 -0.83 0.00 0.00 -0.02 0.00 0.00 35.03 34.72 1bnp n LYS 84 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1bnp n LEU 85 N -2.86 0.30 -2.69 -0.35 7.99 -1.26 -5.00 117.00 113.12 1bnp n LEU 85 Ca -0.02 0.66 -0.01 0.00 -0.01 0.00 0.00 56.01 56.63 1bnp n LEU 85 Cb 0.09 -0.27 -0.01 0.00 -0.11 0.00 0.00 43.42 43.11 1bnp n LEU 85 CO 0.04 -0.27 -0.54 1.21 -1.51 0.00 0.00 177.39 176.31 1bnp n GLU 86 N -1.32 -3.80 0.00 3.23 2.13 -1.26 -5.30 120.64 114.31 1bnp n GLU 86 Ca 0.00 2.98 0.11 0.00 0.66 0.00 0.00 57.16 60.91 1bnp n GLU 86 Cb 0.00 -5.35 0.09 0.00 0.27 0.00 0.00 31.44 26.45 1bnp n GLU 86 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35