#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 1.92 -1.44 6.12 2.88 -1.26 -5.10 113.62 116.74 1bnp n SER 2 Ca 0.00 0.33 0.19 0.00 -1.33 0.00 0.00 58.87 58.06 1bnp n SER 2 Cb 0.00 -0.75 -0.05 0.00 -0.75 0.00 0.00 64.21 62.66 1bnp n SER 2 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1bnp n LYS 3 N -4.38 -2.92 -1.22 -1.46 5.02 -1.26 -4.09 118.16 107.84 1bnp n LYS 3 Ca -0.23 1.97 -0.27 0.00 -2.02 0.00 0.00 58.31 57.75 1bnp n LYS 3 Cb 0.59 -3.56 0.13 0.00 -0.02 0.00 0.00 35.03 32.18 1bnp n LYS 3 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1bnp n ARG 4 N -4.22 2.37 -3.84 1.97 1.74 -1.26 -4.86 116.66 108.55 1bnp n ARG 4 Ca 0.00 -2.98 -0.25 0.00 -0.77 0.00 0.00 57.85 53.85 1bnp n ARG 4 Cb 0.67 -2.17 -0.17 0.00 -1.02 0.00 0.00 32.46 29.77 1bnp n ARG 4 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1bnp s LYS 5 N -3.36 1.04 0.59 5.56 1.02 -1.26 -5.14 119.74 118.19 1bnp s LYS 5 Ca 0.58 -0.06 -0.14 0.00 0.02 0.00 0.00 55.97 56.36 1bnp s LYS 5 Cb 0.47 -1.25 -0.04 0.00 -0.52 0.00 0.00 37.83 36.48 1bnp s LYS 5 CO 0.06 -0.28 1.03 0.00 -0.92 0.00 0.00 175.35 175.24 1bnp s ALA 6 N 1.82 2.88 1.00 5.17 0.00 -1.26 -5.04 121.76 126.34 1bnp s ALA 6 Ca 0.05 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.22 1bnp s ALA 6 Cb -0.12 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.83 1bnp s ALA 6 CO -0.06 -0.69 0.00 -0.35 0.00 0.00 0.00 175.76 174.66 1bnp n PRO 7 N -2.17 -0.42 -0.61 0.00 -0.04 -1.26 -4.96 135.00 125.53 1bnp n PRO 7 Ca 0.07 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.24 1bnp n PRO 7 Cb 0.53 0.00 0.26 0.00 -0.04 0.00 0.00 33.50 34.26 1bnp n PRO 7 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1bnp s GLN 8 N -1.47 -1.77 -0.02 0.54 0.74 -1.26 -5.06 119.66 111.36 1bnp s GLN 8 Ca 0.00 0.35 -0.30 0.00 0.05 0.00 0.00 55.36 55.46 1bnp s GLN 8 Cb 0.00 -1.49 0.11 0.00 1.10 0.00 0.00 33.01 32.73 1bnp s GLN 8 CO 0.00 -4.16 1.16 -1.83 -0.55 0.00 0.00 175.29 169.91 1bnp s GLU 9 N -4.92 0.59 0.96 1.67 -1.05 -1.26 -5.17 118.70 109.53 1bnp s GLU 9 Ca 0.69 -0.30 -0.14 0.00 -0.15 0.00 0.00 54.97 55.07 1bnp s GLU 9 Cb -0.17 0.22 0.17 0.00 -0.44 0.00 0.00 34.13 33.91 1bnp s GLU 9 CO 0.60 -0.27 1.15 -0.08 0.95 0.00 0.00 175.26 177.61 1bnp s THR 10 N -2.67 1.95 0.53 1.83 -1.32 -1.26 -4.97 115.64 109.72 1bnp s THR 10 Ca 0.12 0.00 -0.22 0.00 -1.21 0.00 0.00 61.69 60.37 1bnp s THR 10 Cb 0.02 -2.73 -0.05 0.00 -1.51 0.00 0.00 72.50 68.23 1bnp s THR 10 CO -0.03 0.00 1.38 -1.48 -2.21 0.00 0.00 174.62 172.28 1bnp s LEU 11 N -6.17 3.89 -0.02 9.08 0.05 -1.26 -5.01 118.68 119.25 1bnp s LEU 11 Ca 0.66 2.81 0.02 0.00 0.05 0.00 0.00 54.13 57.67 1bnp s LEU 11 Cb -0.13 -4.21 -0.03 0.00 -2.05 0.00 0.00 46.19 39.76 1bnp s LEU 11 CO 0.54 -1.52 -0.05 0.54 -0.55 0.00 0.00 176.35 175.31 1bnp s ASN 12 N -0.86 4.80 0.00 1.48 2.20 -1.26 -5.00 114.94 116.30 1bnp s ASN 12 Ca 0.70 -0.06 0.00 0.00 -0.94 0.00 0.00 52.86 52.56 1bnp s ASN 12 Cb -0.41 -1.19 0.00 0.00 -2.00 0.00 0.00 41.25 37.64 1bnp s ASN 12 CO 0.50 0.31 0.00 0.61 -2.94 0.00 0.00 177.10 175.58 1bnp n GLY 13 N 1.74 1.56 0.00 0.45 0.00 -1.00 -4.99 105.19 102.95 1bnp n GLY 13 Ca -0.16 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.16 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 1.55 1.72 0.03 -0.02 0.00 -1.26 -4.96 105.19 102.25 1bnp n GLY 14 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1bnp n GLY 14 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1bnp n ILE 15 N -0.58 0.52 0.08 -0.61 5.41 -1.26 -3.59 119.36 119.33 1bnp n ILE 15 Ca 0.00 0.40 0.21 0.00 1.00 0.00 0.00 62.75 64.35 1bnp n ILE 15 Cb 0.00 -1.83 0.73 0.00 -0.71 0.00 0.00 39.64 37.84 1bnp n ILE 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1bnp h THR 16 N -0.37 0.34 -0.02 1.39 1.03 -1.92 0.10 112.91 113.48 1bnp h THR 16 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 66.41 66.19 1bnp h THR 16 Cb 0.20 0.61 0.02 0.00 -1.07 0.00 0.00 68.15 67.91 1bnp h THR 16 CO 0.00 0.00 -0.82 -0.78 -0.01 0.00 0.00 175.52 173.91 1bnp h ASP 17 N 0.00 0.75 1.10 0.00 3.58 -1.99 -2.17 116.42 117.69 1bnp h ASP 17 Ca 0.20 -0.73 -0.00 0.00 0.42 0.00 0.00 57.03 56.92 1bnp h ASP 17 Cb 1.16 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 41.98 1bnp h ASP 17 CO -0.00 1.39 -0.01 -0.03 -2.88 0.00 0.00 179.24 177.70 1bnp h MET 18 N 0.19 0.00 0.13 0.28 4.05 -0.89 -2.10 114.93 116.59 1bnp h MET 18 Ca -0.10 0.00 -0.31 0.00 -0.28 0.00 0.00 59.70 59.01 1bnp h MET 18 Cb 1.50 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.29 1bnp h MET 18 CO 0.16 0.01 -1.52 -0.07 0.23 0.00 0.00 176.91 175.72 1bnp h LEU 19 N 0.00 0.42 -1.23 3.39 4.07 -1.25 -3.03 115.31 117.68 1bnp h LEU 19 Ca -0.00 -0.57 -0.07 0.00 0.08 0.00 0.00 57.88 57.31 1bnp h LEU 19 Cb 0.57 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 42.16 1bnp h LEU 19 CO 0.00 1.47 -0.34 0.58 -1.08 0.00 0.00 178.44 179.07 1bnp h VAL 20 N 0.07 1.02 -0.20 1.22 2.07 -1.15 -2.44 116.25 116.84 1bnp h VAL 20 Ca -0.24 -1.28 -0.18 0.00 0.82 0.00 0.00 66.70 65.82 1bnp h VAL 20 Cb 2.02 1.74 -0.00 0.00 -1.52 0.00 0.00 31.29 33.53 1bnp h VAL 20 CO 0.17 0.34 -0.60 -0.08 0.02 0.00 0.00 177.57 177.42 1bnp h GLU 21 N 0.00 0.67 -0.57 1.57 4.81 -1.41 -0.69 114.58 118.96 1bnp h GLU 21 Ca -0.00 -0.45 0.08 0.00 -0.13 0.00 0.00 59.36 58.86 1bnp h GLU 21 Cb 0.71 0.06 -0.07 0.00 0.63 0.00 0.00 28.75 30.09 1bnp h GLU 21 CO 0.04 1.07 0.22 1.25 -0.73 0.00 0.00 179.01 180.87 1bnp h LEU 22 N 0.50 0.23 -0.80 1.64 7.12 -1.32 0.16 115.31 122.85 1bnp h LEU 22 Ca -0.00 0.07 -0.08 0.00 0.13 0.00 0.00 57.88 57.99 1bnp h LEU 22 Cb 1.17 0.04 -0.01 0.00 -0.53 0.00 0.00 40.66 41.33 1bnp h LEU 22 CO 0.12 0.15 -0.39 0.00 -0.13 0.00 0.00 178.44 178.18 1bnp h ALA 23 N 1.38 0.94 0.00 1.25 0.00 -1.37 -2.83 119.26 118.63 1bnp h ALA 23 Ca 0.28 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1bnp h ALA 23 Cb 0.32 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1bnp h ALA 23 CO -0.27 0.49 0.00 -1.71 0.00 0.00 0.00 179.25 177.76 1bnp n ASN 24 N -3.48 0.38 -0.55 0.00 5.15 0.52 -3.31 115.26 113.97 1bnp n ASN 24 Ca 0.00 0.62 0.45 0.00 -0.60 0.00 0.00 54.58 55.05 1bnp n ASN 24 Cb 0.54 -0.69 0.79 0.00 -0.53 0.00 0.00 39.78 39.89 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 0.00 0.04 -5.10 1.20 -1.00 -1.19 -3.44 116.94 107.45 1bnp h PHE 25 Ca 0.00 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.73 1bnp h PHE 25 Cb 0.22 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 39.74 1bnp h PHE 25 CO 0.00 -0.01 -0.07 -0.85 -1.61 0.00 0.00 178.31 175.77 1bnp n GLU 26 N -4.08 -2.84 0.08 1.51 0.28 -1.21 -4.27 120.64 110.11 1bnp n GLU 26 Ca 0.37 0.03 0.00 0.00 -0.16 0.00 0.00 57.16 57.40 1bnp n GLU 26 Cb 1.69 -4.54 0.00 0.00 1.43 0.00 0.00 31.44 30.02 1bnp n GLU 26 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1bnp n LYS 27 N -2.61 0.00 -0.31 3.44 3.00 -1.26 -4.86 118.16 115.55 1bnp n LYS 27 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.37 1bnp n LYS 27 Cb 0.50 0.00 0.20 0.00 0.00 0.00 0.00 35.03 35.73 1bnp n LYS 27 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1bnp n ASN 28 N -2.83 2.71 0.06 3.14 4.13 -1.26 -4.67 115.26 116.54 1bnp n ASN 28 Ca 0.00 -2.19 0.00 0.00 1.68 0.00 0.00 54.58 54.07 1bnp n ASN 28 Cb 0.00 -0.39 0.00 0.00 -1.54 0.00 0.00 39.78 37.85 1bnp n ASN 28 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 1bnp n VAL 29 N 0.57 0.00 -1.53 2.41 0.31 -1.26 -4.99 118.33 113.84 1bnp n VAL 29 Ca 0.14 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 64.07 1bnp n VAL 29 Cb 0.50 -0.06 -0.06 0.00 -0.91 0.00 0.00 33.84 33.31 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 -2.79 1.93 0.00 4.52 2.88 -1.26 -3.96 113.62 114.94 1bnp n SER 30 Ca 0.00 -0.17 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 1bnp n SER 30 Cb 0.00 -1.39 0.00 0.00 -0.75 0.00 0.00 64.21 62.07 1bnp n SER 30 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1bnp n GLN 31 N 8.76 0.00 0.00 -1.46 7.27 -1.26 -4.33 117.38 126.35 1bnp n GLN 31 Ca 0.43 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.50 1bnp n GLN 31 Cb 0.38 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.03 1bnp n GLN 31 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1bnp n ALA 32 N -1.39 0.00 -2.34 1.69 0.00 -1.25 -5.16 120.51 112.05 1bnp n ALA 32 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 1bnp n ALA 32 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.46 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 0.00 4.45 -0.02 0.00 1.01 -1.26 -5.01 121.20 120.36 1bnp s ILE 33 Ca 0.00 -0.20 -0.22 0.00 0.00 0.00 0.00 60.65 60.23 1bnp s ILE 33 Cb 0.00 -3.67 -0.24 0.00 0.01 0.00 0.00 42.46 38.56 1bnp s ILE 33 CO 0.00 -0.56 1.06 1.12 0.00 0.00 0.00 174.94 176.56 1bnp h HIS 34 N 0.32 0.46 0.00 3.97 2.07 -2.01 -3.09 115.15 116.87 1bnp h HIS 34 Ca -0.47 -0.25 -0.03 0.00 -2.85 0.00 0.00 60.37 56.77 1bnp h HIS 34 Cb 1.23 -0.05 -0.00 0.00 2.57 0.00 0.00 27.41 31.16 1bnp h HIS 34 CO 0.51 1.07 -0.12 1.57 -3.07 0.00 0.00 177.93 177.89 1bnp h LYS 35 N -0.28 0.00 -0.18 5.12 2.10 -1.98 -2.88 116.57 118.46 1bnp h LYS 35 Ca -0.06 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.59 1bnp h LYS 35 Cb 1.21 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.53 1bnp h LYS 35 CO 0.09 0.12 0.10 -0.92 -2.00 0.00 0.00 179.45 176.85 1bnp h TYR 36 N 0.00 0.24 0.00 0.07 3.20 -1.84 -1.16 116.97 117.48 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 0.48 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.67 1bnp h TYR 36 CO 0.00 0.22 0.00 0.27 -1.64 0.00 0.00 178.16 177.01 1bnp n ASN 37 N -4.92 0.23 -0.33 -2.11 6.94 -1.09 -3.12 115.26 110.87 1bnp n ASN 37 Ca -0.04 0.56 0.03 0.00 -0.02 0.00 0.00 54.58 55.11 1bnp n ASN 37 Cb 0.06 -0.61 0.18 0.00 -2.36 0.00 0.00 39.78 37.06 1bnp n ASN 37 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1bnp h ALA 38 N 2.43 1.29 -0.00 -2.53 0.00 -1.16 -1.58 119.26 117.71 1bnp h ALA 38 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1bnp h ALA 38 Cb 0.30 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1bnp h ALA 38 CO 0.00 0.22 -0.45 0.66 0.00 0.00 0.00 179.25 179.68 1bnp n TYR 39 N -4.65 0.00 0.08 0.00 4.01 -1.18 -2.91 117.16 112.52 1bnp n TYR 39 Ca 0.15 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.67 1bnp n TYR 39 Cb 0.26 -0.18 -0.15 0.00 -0.31 0.00 0.00 39.34 38.95 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 0.46 0.39 0.14 -0.72 9.65 -1.40 -1.90 114.38 120.99 1bnp h ARG 40 Ca 0.00 -0.66 -0.29 0.00 -1.10 0.00 0.00 59.98 57.94 1bnp h ARG 40 Cb 0.51 0.24 0.03 0.00 -1.39 0.00 0.00 29.97 29.36 1bnp h ARG 40 CO 0.00 1.31 -1.20 -0.22 2.80 0.00 0.00 179.97 182.66 1bnp h LYS 41 N -0.19 0.57 -0.47 0.20 1.63 -1.60 -2.80 116.57 113.89 1bnp h LYS 41 Ca -0.18 -0.80 -0.04 0.00 -0.85 0.00 0.00 60.65 58.79 1bnp h LYS 41 Cb 1.82 0.27 -0.02 0.00 -0.60 0.00 0.00 32.23 33.70 1bnp h LYS 41 CO 0.19 1.36 0.15 0.00 -3.45 0.00 0.00 179.45 177.71 1bnp h ALA 42 N 0.24 0.62 0.00 5.00 0.00 -1.65 -2.20 119.26 121.26 1bnp h ALA 42 Ca -0.19 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1bnp h ALA 42 Cb 1.89 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 1bnp h ALA 42 CO 0.23 0.27 -0.19 0.00 0.00 0.00 0.00 179.25 179.56 1bnp h ALA 43 N 1.00 1.42 -0.41 0.00 0.00 -1.42 0.13 119.26 120.00 1bnp h ALA 43 Ca 0.15 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1bnp h ALA 43 Cb 0.27 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1bnp h ALA 43 CO -0.00 0.24 -0.23 1.03 0.00 0.00 0.00 179.25 180.29 1bnp h SER 44 N 0.00 0.91 0.29 0.00 0.87 -1.12 -2.27 113.55 112.22 1bnp h SER 44 Ca -0.00 -0.42 0.00 0.00 -1.23 0.00 0.00 61.79 60.14 1bnp h SER 44 Cb 0.41 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.12 1bnp h SER 44 CO 0.03 1.12 -0.35 0.55 -0.53 0.00 0.00 176.83 177.65 1bnp n VAL 45 N -4.19 0.00 -0.09 2.23 3.14 -0.96 -3.82 118.33 114.64 1bnp n VAL 45 Ca -0.01 -0.09 -0.12 0.00 -2.96 0.00 0.00 64.34 61.15 1bnp n VAL 45 Cb 0.45 0.41 -0.05 0.00 -1.06 0.00 0.00 33.84 33.59 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 -0.88 1.47 -0.22 1.55 -0.00 0.42 -3.18 119.36 118.52 1bnp n ILE 46 Ca 0.10 0.10 0.10 0.00 -0.00 0.00 0.00 62.75 63.05 1bnp n ILE 46 Cb 0.35 -2.25 0.38 0.00 -0.00 0.00 0.00 39.64 38.12 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 -0.85 1.81 -0.37 -1.39 0.00 -1.61 0.30 119.26 117.16 1bnp h ALA 47 Ca -0.15 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.63 1bnp h ALA 47 Cb 0.86 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1bnp h ALA 47 CO -0.09 0.01 -0.29 0.87 0.00 0.00 0.00 179.25 179.75 1bnp h LYS 48 N 0.69 0.78 -7.23 0.00 6.56 -1.75 -3.43 116.57 112.19 1bnp h LYS 48 Ca 0.38 -0.35 -0.48 0.00 -1.06 0.00 0.00 60.65 59.14 1bnp h LYS 48 Cb 0.54 -0.02 0.20 0.00 -0.57 0.00 0.00 32.23 32.38 1bnp h LYS 48 CO -0.15 0.97 0.14 -0.47 -2.06 0.00 0.00 179.45 177.87 1bnp s TYR 49 N -4.50 1.61 -0.72 -1.35 6.14 0.10 -4.84 117.35 113.80 1bnp s TYR 49 Ca -0.09 1.45 0.15 0.00 0.64 0.00 0.00 57.07 59.22 1bnp s TYR 49 Cb 0.12 -3.20 0.67 0.00 0.42 0.00 0.00 41.96 39.97 1bnp s TYR 49 CO 0.84 -3.21 1.46 -0.35 0.64 0.00 0.00 175.55 174.93 1bnp n PRO 50 N -4.48 0.08 -3.27 4.97 -0.05 -1.26 -4.91 135.00 126.07 1bnp n PRO 50 Ca 0.07 0.42 -0.25 0.00 -0.05 0.00 0.00 63.50 63.70 1bnp n PRO 50 Cb 0.53 -1.68 0.03 0.00 -0.05 0.00 0.00 33.50 32.33 1bnp n PRO 50 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 175.50 173.06 1bnp n HIS 51 N -1.83 -2.63 -2.54 0.54 1.44 -1.25 -4.72 115.22 104.23 1bnp n HIS 51 Ca 0.01 1.10 -0.01 0.00 -2.01 0.00 0.00 57.72 56.81 1bnp n HIS 51 Cb 0.12 -2.37 -0.00 0.00 0.12 0.00 0.00 29.99 27.87 1bnp n HIS 51 CO 0.00 0.00 0.00 0.36 -2.81 0.00 0.00 176.34 173.89 1bnp n LYS 52 N 0.02 0.06 -2.94 -1.40 2.85 -1.26 -2.37 118.16 113.13 1bnp n LYS 52 Ca -0.02 -0.16 -0.41 0.00 -1.05 0.00 0.00 58.31 56.67 1bnp n LYS 52 Cb 0.57 0.02 -0.04 0.00 -0.65 0.00 0.00 35.03 34.92 1bnp n LYS 52 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 177.40 178.31 1bnp s ILE 53 N 0.01 4.90 -0.10 0.58 -5.25 -1.26 -4.81 121.20 115.27 1bnp s ILE 53 Ca 0.01 1.52 0.16 0.00 -0.99 0.00 0.00 60.65 61.34 1bnp s ILE 53 Cb 0.02 -4.09 -0.16 0.00 2.95 0.00 0.00 42.46 41.18 1bnp s ILE 53 CO -0.01 0.03 0.77 0.29 -1.79 0.00 0.00 174.94 174.24 1bnp n LYS 54 N 5.32 0.62 0.00 0.37 4.01 -1.26 -4.57 118.16 122.65 1bnp n LYS 54 Ca 0.03 0.25 0.00 0.00 -0.51 0.00 0.00 58.31 58.08 1bnp n LYS 54 Cb 0.49 -1.80 0.00 0.00 -0.51 0.00 0.00 35.03 33.20 1bnp n LYS 54 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1bnp n SER 55 N -2.94 0.00 0.00 4.39 3.41 -1.26 -4.74 113.62 112.48 1bnp n SER 55 Ca -0.12 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 1bnp n SER 55 Cb 0.90 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.77 1bnp n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bnp n GLY 56 N 1.18 1.28 0.29 5.00 0.00 -1.26 -4.90 105.19 106.78 1bnp n GLY 56 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 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 0.00 1.13 -0.11 4.61 0.00 -1.95 -2.39 119.26 120.55 1bnp h ALA 57 Ca 0.00 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.90 1bnp h ALA 57 Cb 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1bnp h ALA 57 CO 0.00 0.06 0.09 0.93 0.00 0.00 0.00 179.25 180.33 1bnp h GLU 58 N 0.00 0.00 -0.75 0.00 5.08 -1.98 -1.05 114.58 115.87 1bnp h GLU 58 Ca -0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1bnp h GLU 58 Cb 0.26 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 1bnp h GLU 58 CO 0.01 0.00 0.29 0.00 -1.00 0.00 0.00 179.01 178.31 1bnp h ALA 59 N 1.93 1.09 -0.18 3.43 0.00 -1.78 -2.07 119.26 121.68 1bnp h ALA 59 Ca 0.05 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 1bnp h ALA 59 Cb 0.24 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1bnp h ALA 59 CO -0.00 0.64 -0.23 -0.22 0.00 0.00 0.00 179.25 179.45 1bnp h LYS 60 N 1.10 0.31 -0.37 0.00 3.64 -1.37 -2.81 116.57 117.08 1bnp h LYS 60 Ca 0.25 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1bnp h LYS 60 Cb 0.22 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1bnp h LYS 60 CO -0.02 0.53 0.24 -0.22 -2.27 0.00 0.00 179.45 177.72 1bnp h LYS 61 N 0.29 0.49 -5.99 1.90 1.63 -1.22 -3.41 116.57 110.26 1bnp h LYS 61 Ca 0.05 -0.03 -0.62 0.00 -0.85 0.00 0.00 60.65 59.20 1bnp h LYS 61 Cb 0.56 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 32.08 1bnp h LYS 61 CO 0.04 0.33 1.46 1.28 -3.45 0.00 0.00 179.45 179.11 1bnp n LEU 62 N -4.82 2.85 -4.77 5.20 4.77 -1.06 -4.90 117.00 114.26 1bnp n LEU 62 Ca -0.00 0.29 -0.41 0.00 -0.03 0.00 0.00 56.01 55.86 1bnp n LEU 62 Cb 0.03 -1.45 -0.02 0.00 -2.33 0.00 0.00 43.42 39.65 1bnp n LEU 62 CO 0.35 -0.69 1.02 -2.16 -1.33 0.00 0.00 177.39 174.57 1bnp s PRO 63 N 6.27 4.30 0.00 3.23 0.04 -1.26 -2.69 135.00 144.89 1bnp s PRO 63 Ca 1.04 2.29 0.00 0.00 0.04 0.00 0.00 61.00 64.37 1bnp s PRO 63 Cb -0.53 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 30.95 1bnp s PRO 63 CO 0.41 -0.28 0.00 0.41 0.04 0.00 0.00 177.00 177.57 1bnp n GLY 64 N 0.91 2.86 3.02 0.56 0.00 -1.26 -4.98 105.19 106.31 1bnp n GLY 64 Ca 0.01 -0.37 -0.25 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.71 1.15 0.00 1.61 1.01 -1.09 -4.92 120.40 116.44 1bnp s VAL 65 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1bnp s VAL 65 Cb 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 36.38 35.33 1bnp s VAL 65 CO 0.00 0.36 0.00 0.61 0.00 0.00 0.00 175.10 176.07 1bnp n GLY 66 N 3.85 0.12 0.06 4.51 0.00 -1.26 -4.38 105.19 108.08 1bnp n GLY 66 Ca -0.23 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1bnp n GLY 66 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1bnp n THR 67 N 0.00 0.00 0.00 2.61 5.66 -1.26 -4.85 114.28 116.44 1bnp n THR 67 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1bnp n THR 67 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1bnp n THR 67 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1bnp n LYS 68 N -0.92 0.00 0.29 1.09 4.76 -1.26 -4.78 118.16 117.35 1bnp n LYS 68 Ca 0.00 0.00 0.18 0.00 -2.87 0.00 0.00 58.31 55.62 1bnp n LYS 68 Cb 0.00 -0.39 0.82 0.00 -1.84 0.00 0.00 35.03 33.62 1bnp n LYS 68 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 1bnp h ILE 69 N 0.00 0.09 -0.89 -0.18 2.04 -1.95 -2.81 117.51 113.82 1bnp h ILE 69 Ca 0.00 -0.42 0.02 0.00 1.00 0.00 0.00 64.86 65.46 1bnp h ILE 69 Cb 0.34 1.38 -0.05 0.00 -0.74 0.00 0.00 36.82 37.75 1bnp h ILE 69 CO 0.00 0.02 0.59 0.00 0.00 0.00 0.00 178.15 178.76 1bnp h ALA 70 N 1.97 1.40 -0.15 1.87 0.00 -1.94 -0.70 119.26 121.72 1bnp h ALA 70 Ca -0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1bnp h ALA 70 Cb 0.38 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1bnp h ALA 70 CO 0.00 0.53 -0.04 1.49 0.00 0.00 0.00 179.25 181.24 1bnp h GLU 71 N 1.16 0.21 -0.22 0.00 4.57 -1.83 -2.09 114.58 116.38 1bnp h GLU 71 Ca 0.34 -0.03 -0.19 0.00 -1.18 0.00 0.00 59.36 58.30 1bnp h GLU 71 Cb -0.06 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.49 1bnp h GLU 71 CO -0.09 0.27 -0.60 0.87 -1.18 0.00 0.00 179.01 178.28 1bnp h LYS 72 N 0.21 0.74 -0.38 1.92 1.57 -1.28 -1.40 116.57 117.95 1bnp h LYS 72 Ca 0.05 -0.50 0.06 0.00 -1.87 0.00 0.00 60.65 58.39 1bnp h LYS 72 Cb 0.21 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1bnp h LYS 72 CO 0.01 1.12 0.26 0.82 -0.57 0.00 0.00 179.45 181.09 1bnp h ILE 73 N 0.55 0.94 0.00 1.86 1.08 -0.79 0.20 117.51 121.36 1bnp h ILE 73 Ca -0.00 -0.09 -0.13 0.00 -0.39 0.00 0.00 64.86 64.26 1bnp h ILE 73 Cb 1.19 0.66 -0.02 0.00 -3.07 0.00 0.00 36.82 35.58 1bnp h ILE 73 CO 0.12 0.05 -1.02 -0.78 -0.69 0.00 0.00 178.15 175.83 1bnp h ASP 74 N 0.26 0.00 -0.80 1.72 3.58 -1.32 -2.90 116.42 116.95 1bnp h ASP 74 Ca 0.17 0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.67 1bnp h ASP 74 Cb 0.34 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.35 1bnp h ASP 74 CO -0.03 0.48 0.53 -0.08 -2.88 0.00 0.00 179.24 177.25 1bnp h GLU 75 N 0.00 0.90 0.11 0.28 4.57 0.19 0.82 114.58 121.46 1bnp h GLU 75 Ca -0.09 -0.05 -0.35 0.00 -1.18 0.00 0.00 59.36 57.68 1bnp h GLU 75 Cb 1.44 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 29.81 1bnp h GLU 75 CO 0.05 0.60 -1.94 0.74 -1.18 0.00 0.00 179.01 177.27 1bnp h PHE 76 N 0.93 0.43 -0.55 0.92 0.04 -1.63 -3.35 116.94 113.73 1bnp h PHE 76 Ca 0.33 -0.31 -0.24 0.00 2.80 0.00 0.00 57.97 60.55 1bnp h PHE 76 Cb 0.13 -0.02 -0.14 0.00 2.20 0.00 0.00 35.95 38.12 1bnp h PHE 76 CO -0.00 1.67 0.31 1.28 -0.60 0.00 0.00 178.31 180.97 1bnp n LEU 77 N -3.43 4.97 -0.10 1.54 7.99 -1.02 -4.30 117.00 122.66 1bnp n LEU 77 Ca -0.29 -2.60 -0.22 0.00 -0.01 0.00 0.00 56.01 52.89 1bnp n LEU 77 Cb 1.05 -0.69 -0.12 0.00 -0.11 0.00 0.00 43.42 43.56 1bnp n LEU 77 CO 0.44 0.75 -0.49 0.00 -1.51 0.00 0.00 177.39 176.58 1bnp h ALA 78 N 1.84 0.26 0.00 -1.18 0.00 0.53 -3.41 119.26 117.30 1bnp h ALA 78 Ca 0.30 -1.19 0.00 0.00 0.00 0.00 0.00 54.91 54.02 1bnp h ALA 78 Cb 1.98 0.72 0.00 0.00 0.00 0.00 0.00 17.79 20.49 1bnp h ALA 78 CO 0.59 0.68 0.00 2.41 0.00 0.00 0.00 179.25 182.93 1bnp n THR 79 N -4.44 0.00 0.00 0.00 -1.04 -1.26 -5.03 114.28 102.51 1bnp n THR 79 Ca -0.31 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.70 1bnp n THR 79 Cb 0.67 -0.01 0.00 0.00 -1.82 0.00 0.00 70.33 69.18 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 -1.46 0.00 3.66 3.41 0.00 -1.26 -4.80 105.19 104.74 1bnp n GLY 80 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1bnp n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bnp s LYS 81 N 0.00 4.15 1.29 1.61 1.02 -1.26 -5.07 119.74 121.47 1bnp s LYS 81 Ca 0.00 0.15 -0.22 0.00 0.02 0.00 0.00 55.97 55.93 1bnp s LYS 81 Cb 0.00 -3.55 0.33 0.00 -0.52 0.00 0.00 37.83 34.09 1bnp s LYS 81 CO 0.00 -0.06 0.90 1.28 -0.92 0.00 0.00 175.35 176.54 1bnp n LEU 82 N 4.57 0.00 -2.15 3.17 4.77 -1.26 -4.82 117.00 121.27 1bnp n LEU 82 Ca -0.09 -0.93 -0.27 0.00 -0.03 0.00 0.00 56.01 54.69 1bnp n LEU 82 Cb 0.51 -0.93 0.03 0.00 -2.33 0.00 0.00 43.42 40.70 1bnp n LEU 82 CO 0.39 -2.49 0.53 -2.11 -1.33 0.00 0.00 177.39 172.38 1bnp n ARG 83 N -5.20 3.36 -0.90 3.23 1.85 -1.26 -4.65 116.66 113.09 1bnp n ARG 83 Ca 0.13 -3.96 -0.03 0.00 -1.00 0.00 0.00 57.85 52.99 1bnp n ARG 83 Cb 0.56 -2.28 0.18 0.00 -1.05 0.00 0.00 32.46 29.86 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 -0.74 1.99 -0.02 2.89 5.02 -1.26 -4.78 118.16 121.27 1bnp n LYS 84 Ca 0.49 -3.38 -0.00 0.00 -2.02 0.00 0.00 58.31 53.39 1bnp n LYS 84 Cb 0.85 -1.81 -0.00 0.00 -0.02 0.00 0.00 35.03 34.05 1bnp n LYS 84 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1bnp h LEU 85 N 1.19 0.00 -7.42 -0.35 -0.00 -2.00 -3.48 115.31 103.24 1bnp h LEU 85 Ca 0.16 0.00 -0.11 0.00 -0.00 0.00 0.00 57.88 57.93 1bnp h LEU 85 Cb 1.34 0.00 -0.20 0.00 -0.00 0.00 0.00 40.66 41.79 1bnp h LEU 85 CO 0.31 0.19 -0.20 -1.83 -0.00 0.00 0.00 178.44 176.91 1bnp s GLU 86 N -1.21 0.72 0.00 1.13 -1.05 -1.26 -5.27 118.70 111.76 1bnp s GLU 86 Ca -0.00 -0.08 0.00 0.00 -0.15 0.00 0.00 54.97 54.74 1bnp s GLU 86 Cb 0.00 0.33 0.00 0.00 -0.44 0.00 0.00 34.13 34.02 1bnp s GLU 86 CO 0.00 -0.20 0.00 1.63 0.95 0.00 0.00 175.26 177.64