#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 -6.22 -4.70 6.12 7.64 -1.26 -4.96 113.62 110.24 1bnp n SER 2 Ca 0.00 -0.35 -0.38 0.00 1.01 0.00 0.00 58.87 59.15 1bnp n SER 2 Cb 0.00 -4.98 -0.07 0.00 -1.01 0.00 0.00 64.21 58.16 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 -5.87 4.26 -0.11 1.43 1.02 -1.26 -5.06 119.74 114.16 1bnp s LYS 3 Ca 0.38 0.28 -0.01 0.00 0.02 0.00 0.00 55.97 56.64 1bnp s LYS 3 Cb -0.17 -3.47 0.03 0.00 -0.52 0.00 0.00 37.83 33.70 1bnp s LYS 3 CO 0.47 0.10 -0.03 1.03 -0.92 0.00 0.00 175.35 176.01 1bnp s ARG 4 N 0.84 1.01 0.54 1.68 0.52 -1.26 -5.08 118.95 117.20 1bnp s ARG 4 Ca 0.21 -0.14 0.00 0.00 -0.52 0.00 0.00 55.73 55.28 1bnp s ARG 4 Cb -0.14 -1.42 0.00 0.00 0.52 0.00 0.00 34.95 33.91 1bnp s ARG 4 CO 0.08 -0.34 0.00 1.63 0.02 0.00 0.00 175.30 176.68 1bnp n LYS 5 N 5.04 -3.24 -3.25 3.54 5.02 -1.26 -4.84 118.16 119.16 1bnp n LYS 5 Ca -0.10 2.51 -0.31 0.00 -2.02 0.00 0.00 58.31 58.40 1bnp n LYS 5 Cb 0.49 -3.85 -0.04 0.00 -0.02 0.00 0.00 35.03 31.62 1bnp n LYS 5 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bnp s ALA 6 N -3.69 3.52 -0.39 7.82 0.00 -1.26 -4.98 121.76 122.79 1bnp s ALA 6 Ca 0.00 -0.33 -0.27 0.00 0.00 0.00 0.00 51.96 51.36 1bnp s ALA 6 Cb 0.00 -2.47 -0.06 0.00 0.00 0.00 0.00 23.12 20.59 1bnp s ALA 6 CO 0.00 0.30 2.26 -1.25 0.00 0.00 0.00 175.76 177.07 1bnp s PRO 7 N -3.28 2.59 -0.16 0.00 0.04 -1.26 -4.81 135.00 128.11 1bnp s PRO 7 Ca 0.48 1.58 -0.15 0.00 0.04 0.00 0.00 61.00 62.94 1bnp s PRO 7 Cb -0.11 -4.47 -0.23 0.00 0.04 0.00 0.00 34.50 29.74 1bnp s PRO 7 CO 0.26 -2.73 0.31 1.96 0.04 0.00 0.00 177.00 176.84 1bnp h GLN 8 N 17.20 0.13 -5.11 4.56 4.20 -1.98 -3.43 115.11 130.67 1bnp h GLN 8 Ca -0.31 -0.22 -0.67 0.00 0.06 0.00 0.00 58.65 57.52 1bnp h GLN 8 Cb 1.24 0.08 -0.17 0.00 0.30 0.00 0.00 27.48 28.94 1bnp h GLN 8 CO 1.08 1.10 0.27 -1.21 -0.67 0.00 0.00 178.83 179.41 1bnp s GLU 9 N -2.45 3.12 -0.23 1.46 2.02 -1.26 -5.01 118.70 116.35 1bnp s GLU 9 Ca -0.25 -0.94 -0.03 0.00 0.02 0.00 0.00 54.97 53.77 1bnp s GLU 9 Cb 0.06 -4.18 0.01 0.00 0.10 0.00 0.00 34.13 30.11 1bnp s GLU 9 CO 0.68 -1.52 -0.07 0.95 0.02 0.00 0.00 175.26 175.32 1bnp s THR 10 N 3.20 3.03 0.05 3.63 -4.23 -1.26 -5.00 115.64 115.06 1bnp s THR 10 Ca 0.18 -0.75 -0.24 0.00 -1.18 0.00 0.00 61.69 59.70 1bnp s THR 10 Cb -0.19 -2.43 -0.17 0.00 1.34 0.00 0.00 72.50 71.05 1bnp s THR 10 CO 0.10 0.35 1.58 -0.07 -0.54 0.00 0.00 174.62 176.05 1bnp h LEU 11 N 8.06 -0.04 0.00 4.79 4.07 -1.99 -3.44 115.31 126.76 1bnp h LEU 11 Ca -0.39 -0.15 0.00 0.00 0.08 0.00 0.00 57.88 57.43 1bnp h LEU 11 Cb 1.14 0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.89 1bnp h LEU 11 CO 0.60 0.12 0.00 0.59 -1.08 0.00 0.00 178.44 178.67 1bnp n ASN 12 N -5.04 0.00 -2.87 -0.43 4.13 -1.26 -5.08 115.26 104.71 1bnp n ASN 12 Ca -0.08 0.00 -0.05 0.00 1.68 0.00 0.00 54.58 56.13 1bnp n ASN 12 Cb 0.11 0.00 0.01 0.00 -1.54 0.00 0.00 39.78 38.36 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 4.04 -1.27 2.11 7.41 0.00 -1.26 -4.98 105.19 111.24 1bnp n GLY 13 Ca 0.00 0.98 0.02 0.00 0.00 0.00 0.00 46.02 47.02 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 -0.75 1.36 0.01 -0.02 0.00 -1.26 -4.89 105.19 99.63 1bnp n GLY 14 Ca 0.08 -0.91 -0.00 0.00 0.00 0.00 0.00 46.02 45.19 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 6.27 0.00 -0.06 -0.61 2.04 -1.96 -3.05 117.51 120.13 1bnp h ILE 15 Ca -0.20 -0.26 0.02 0.00 1.00 0.00 0.00 64.86 65.41 1bnp h ILE 15 Cb 1.60 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1bnp h ILE 15 CO 0.12 0.00 0.18 0.00 0.00 0.00 0.00 178.15 178.45 1bnp h THR 16 N -0.26 0.16 0.02 -0.27 1.03 -1.90 -1.67 112.91 110.01 1bnp h THR 16 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 66.41 66.40 1bnp h THR 16 Cb 0.02 0.83 0.00 0.00 -1.07 0.00 0.00 68.15 67.93 1bnp h THR 16 CO 0.00 0.00 -0.01 -0.78 -0.01 0.00 0.00 175.52 174.72 1bnp h ASP 17 N 0.00 -0.02 -0.01 0.00 3.58 -1.92 -2.89 116.42 115.16 1bnp h ASP 17 Ca 0.03 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.48 1bnp h ASP 17 Cb 0.39 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.45 1bnp h ASP 17 CO -0.00 0.19 0.07 -0.03 -2.88 0.00 0.00 179.24 176.60 1bnp h MET 18 N -0.43 0.00 0.11 0.28 4.05 -1.45 0.20 114.93 117.70 1bnp h MET 18 Ca -0.00 0.00 -0.28 0.00 -0.28 0.00 0.00 59.70 59.14 1bnp h MET 18 Cb 0.02 0.00 0.02 0.00 -0.80 0.00 0.00 31.60 30.83 1bnp h MET 18 CO 0.00 0.00 -1.21 1.25 0.23 0.00 0.00 176.91 177.19 1bnp h LEU 19 N 0.00 0.67 -0.79 3.39 6.46 -1.42 -2.99 115.31 120.64 1bnp h LEU 19 Ca 0.00 -0.64 0.00 0.00 -0.12 0.00 0.00 57.88 57.12 1bnp h LEU 19 Cb 0.15 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 39.87 1bnp h LEU 19 CO -0.00 1.47 0.00 0.58 -0.62 0.00 0.00 178.44 179.87 1bnp h VAL 20 N 0.19 0.00 0.12 1.05 2.07 -0.77 -2.99 116.25 115.92 1bnp h VAL 20 Ca -0.16 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 1bnp h VAL 20 Cb 1.89 1.49 0.00 0.00 -1.52 0.00 0.00 31.29 33.15 1bnp h VAL 20 CO 0.22 0.00 -0.06 -0.33 0.02 0.00 0.00 177.57 177.42 1bnp h GLU 21 N 0.00 -0.16 0.00 1.57 4.39 -1.13 -1.23 114.58 118.02 1bnp h GLU 21 Ca 0.00 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 1bnp h GLU 21 Cb 0.61 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.30 1bnp h GLU 21 CO 0.00 0.29 -0.09 1.25 -1.16 0.00 0.00 179.01 179.30 1bnp h LEU 22 N -0.70 0.00 -0.64 1.33 6.46 -1.54 -0.03 115.31 120.19 1bnp h LEU 22 Ca -0.02 0.00 -0.14 0.00 -0.12 0.00 0.00 57.88 57.60 1bnp h LEU 22 Cb 0.52 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.43 1bnp h LEU 22 CO 0.03 0.09 -0.68 0.00 -0.62 0.00 0.00 178.44 177.26 1bnp h ALA 23 N 1.91 0.87 0.00 1.25 0.00 -1.39 -2.49 119.26 119.41 1bnp h ALA 23 Ca -0.00 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1bnp h ALA 23 Cb 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1bnp h ALA 23 CO 0.01 0.84 0.00 -1.71 0.00 0.00 0.00 179.25 178.39 1bnp n ASN 24 N -3.74 0.00 -0.33 0.00 4.05 -0.07 -4.06 115.26 111.11 1bnp n ASN 24 Ca -0.01 0.18 0.08 0.00 0.45 0.00 0.00 54.58 55.28 1bnp n ASN 24 Cb 0.67 -0.38 0.18 0.00 1.23 0.00 0.00 39.78 41.47 1bnp n ASN 24 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 1bnp n PHE 25 N -1.38 0.42 -2.05 1.20 3.72 -0.94 -4.74 117.46 113.68 1bnp n PHE 25 Ca 0.09 1.13 -0.11 0.00 -0.05 0.00 0.00 57.45 58.51 1bnp n PHE 25 Cb 0.24 -1.09 -0.02 0.00 -0.94 0.00 0.00 39.48 37.67 1bnp n PHE 25 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1bnp n GLU 26 N -5.46 -1.95 0.00 -1.08 2.13 -1.26 -4.37 120.64 108.65 1bnp n GLU 26 Ca 0.17 0.56 0.00 0.00 0.66 0.00 0.00 57.16 58.55 1bnp n GLU 26 Cb 0.54 -5.01 0.00 0.00 0.27 0.00 0.00 31.44 27.24 1bnp n GLU 26 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1bnp n LYS 27 N -2.40 0.00 0.19 5.31 4.76 -1.26 -4.70 118.16 120.07 1bnp n LYS 27 Ca -0.12 0.00 0.06 0.00 -2.87 0.00 0.00 58.31 55.37 1bnp n LYS 27 Cb 0.51 0.00 0.52 0.00 -1.84 0.00 0.00 35.03 34.22 1bnp n LYS 27 CO 0.00 0.00 0.00 -0.97 -1.37 0.00 0.00 177.40 175.06 1bnp h ASN 28 N 0.00 0.09 0.03 4.39 -0.73 -1.97 -2.56 115.58 114.83 1bnp h ASN 28 Ca 0.00 -0.01 -0.12 0.00 1.87 0.00 0.00 56.30 58.04 1bnp h ASN 28 Cb 0.00 -0.02 -0.02 0.00 0.27 0.00 0.00 38.32 38.54 1bnp h ASN 28 CO 0.00 0.17 -2.09 0.52 -0.37 0.00 0.00 177.43 175.66 1bnp n VAL 29 N -4.40 0.48 -0.51 2.57 0.31 -1.26 -4.96 118.33 110.55 1bnp n VAL 29 Ca -0.02 -0.62 -0.30 0.00 -0.01 0.00 0.00 64.34 63.39 1bnp n VAL 29 Cb 0.18 -0.17 0.28 0.00 -0.91 0.00 0.00 33.84 33.21 1bnp n VAL 29 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1bnp n SER 30 N -2.44 -3.43 -2.00 4.52 3.41 -0.97 -3.49 113.62 109.23 1bnp n SER 30 Ca -0.13 -0.97 -0.17 0.00 -0.26 0.00 0.00 58.87 57.33 1bnp n SER 30 Cb 0.76 -0.98 -0.04 0.00 -0.26 0.00 0.00 64.21 63.69 1bnp n SER 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bnp n GLN 31 N -5.43 -1.67 -2.66 4.33 1.13 -1.26 -4.79 117.38 107.03 1bnp n GLN 31 Ca 0.14 0.93 -0.03 0.00 -1.94 0.00 0.00 57.00 56.10 1bnp n GLN 31 Cb 0.59 -5.43 0.05 0.00 0.11 0.00 0.00 30.24 25.56 1bnp n GLN 31 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1bnp n ALA 32 N -0.69 -3.97 1.58 -1.58 0.00 -1.23 -5.01 120.51 109.61 1bnp n ALA 32 Ca -0.19 0.12 0.13 0.00 0.00 0.00 0.00 53.44 53.50 1bnp n ALA 32 Cb 0.62 -3.50 0.76 0.00 0.00 0.00 0.00 19.45 17.34 1bnp n ALA 32 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1bnp n ILE 33 N 2.34 0.04 0.08 0.00 0.13 -1.26 -2.74 119.36 117.94 1bnp n ILE 33 Ca 0.09 0.01 -0.07 0.00 -1.10 0.00 0.00 62.75 61.68 1bnp n ILE 33 Cb 0.67 -0.59 0.06 0.00 -0.84 0.00 0.00 39.64 38.94 1bnp n ILE 33 CO 0.00 0.00 0.00 0.45 2.80 0.00 0.00 176.55 179.80 1bnp h HIS 34 N 0.00 0.34 0.06 9.51 3.86 -1.95 -2.52 115.15 124.45 1bnp h HIS 34 Ca 0.00 -0.15 -0.35 0.00 -1.16 0.00 0.00 60.37 58.70 1bnp h HIS 34 Cb 0.05 -0.05 -0.04 0.00 1.06 0.00 0.00 27.41 28.42 1bnp h HIS 34 CO 0.00 0.88 -2.06 1.63 0.86 0.00 0.00 177.93 179.24 1bnp n LYS 35 N -3.80 0.70 0.13 2.45 5.02 -1.17 -4.10 118.16 117.39 1bnp n LYS 35 Ca -0.03 0.22 -0.13 0.00 -2.02 0.00 0.00 58.31 56.35 1bnp n LYS 35 Cb 0.69 -1.68 -0.06 0.00 -0.02 0.00 0.00 35.03 33.97 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 0.03 -0.73 -0.03 2.13 5.03 -1.55 -0.91 116.97 120.95 1bnp h TYR 36 Ca -0.43 0.01 0.01 0.00 2.58 0.00 0.00 58.73 60.90 1bnp h TYR 36 Cb 2.03 0.30 -0.00 0.00 1.55 0.00 0.00 36.73 40.61 1bnp h TYR 36 CO 0.04 -0.38 0.12 -2.95 -1.32 0.00 0.00 178.16 173.68 1bnp h ASN 37 N -0.50 0.00 -0.64 -2.11 7.08 -1.65 -1.54 115.58 116.21 1bnp h ASN 37 Ca 0.02 0.00 -0.01 0.00 -3.08 0.00 0.00 56.30 53.23 1bnp h ASN 37 Cb 0.51 0.00 -0.03 0.00 -2.08 0.00 0.00 38.32 36.72 1bnp h ASN 37 CO -0.14 0.00 0.35 0.00 -2.08 0.00 0.00 177.43 175.57 1bnp h ALA 38 N 1.78 0.83 0.00 4.14 0.00 -1.31 -2.41 119.26 122.28 1bnp h ALA 38 Ca 0.01 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 1bnp h ALA 38 Cb 0.26 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1bnp h ALA 38 CO -0.00 0.34 -1.16 1.88 0.00 0.00 0.00 179.25 180.32 1bnp h TYR 39 N 0.88 0.00 -0.63 0.00 0.05 -1.32 -3.03 116.97 112.92 1bnp h TYR 39 Ca 0.23 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.99 1bnp h TYR 39 Cb 0.04 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.75 1bnp h TYR 39 CO -0.01 0.70 0.31 -0.09 -1.05 0.00 0.00 178.16 178.02 1bnp h ARG 40 N 0.00 0.90 0.03 4.88 1.12 -1.23 -2.21 114.38 117.87 1bnp h ARG 40 Ca -0.12 -0.13 -0.24 0.00 -1.11 0.00 0.00 59.98 58.39 1bnp h ARG 40 Cb 1.64 -0.16 0.00 0.00 -0.01 0.00 0.00 29.97 31.44 1bnp h ARG 40 CO 0.07 0.72 -1.01 -0.22 -3.11 0.00 0.00 179.97 176.42 1bnp h LYS 41 N 0.86 0.37 0.75 0.20 1.63 -1.55 -3.05 116.57 115.79 1bnp h LYS 41 Ca 0.22 -0.44 -0.03 0.00 -0.85 0.00 0.00 60.65 59.54 1bnp h LYS 41 Cb 0.11 0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 31.87 1bnp h LYS 41 CO -0.03 1.12 -0.44 0.00 -3.45 0.00 0.00 179.45 176.65 1bnp h ALA 42 N 0.71 -1.15 -0.53 5.00 0.00 -1.37 -2.38 119.26 119.55 1bnp h ALA 42 Ca -0.09 -0.23 0.09 0.00 0.00 0.00 0.00 54.91 54.68 1bnp h ALA 42 Cb 1.66 0.54 -0.03 0.00 0.00 0.00 0.00 17.79 19.96 1bnp h ALA 42 CO 0.17 -1.16 0.36 0.00 0.00 0.00 0.00 179.25 178.62 1bnp h ALA 43 N -0.96 2.06 -0.65 0.00 0.00 -1.52 -0.99 119.26 117.20 1bnp h ALA 43 Ca -0.10 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.86 1bnp h ALA 43 Cb 0.89 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 1bnp h ALA 43 CO 0.11 -0.18 0.43 1.03 0.00 0.00 0.00 179.25 180.64 1bnp h SER 44 N 0.33 0.58 0.62 0.00 0.87 -1.31 -1.67 113.55 112.96 1bnp h SER 44 Ca 0.24 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 1bnp h SER 44 Cb 0.52 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.36 1bnp h SER 44 CO -0.06 0.38 -0.72 0.55 -0.53 0.00 0.00 176.83 176.45 1bnp n VAL 45 N -4.48 0.19 -0.10 2.23 3.14 -0.41 -4.07 118.33 114.84 1bnp n VAL 45 Ca 0.09 -0.18 -0.19 0.00 -2.96 0.00 0.00 64.34 61.10 1bnp n VAL 45 Cb 0.23 0.10 -0.10 0.00 -1.06 0.00 0.00 33.84 33.01 1bnp n VAL 45 CO 0.00 0.00 0.00 0.40 -6.46 0.00 0.00 176.83 170.77 1bnp h ILE 46 N 0.00 0.75 -0.12 1.55 1.08 -0.95 -3.28 117.51 116.54 1bnp h ILE 46 Ca 0.00 -1.98 0.04 0.00 -0.39 0.00 0.00 64.86 62.53 1bnp h ILE 46 Cb 0.67 1.84 -0.00 0.00 -3.07 0.00 0.00 36.82 36.25 1bnp h ILE 46 CO 0.00 0.26 0.13 0.00 -0.69 0.00 0.00 178.15 177.84 1bnp h ALA 47 N -0.58 1.78 0.02 1.87 0.00 -1.62 0.01 119.26 120.72 1bnp h ALA 47 Ca -0.30 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.41 1bnp h ALA 47 Cb 1.17 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1bnp h ALA 47 CO -0.18 -0.19 -0.96 1.57 0.00 0.00 0.00 179.25 179.49 1bnp h LYS 48 N 0.00 0.06 -6.26 0.00 2.10 -1.73 -3.45 116.57 107.28 1bnp h LYS 48 Ca 0.06 -0.08 -0.46 0.00 -2.00 0.00 0.00 60.65 58.17 1bnp h LYS 48 Cb 0.31 0.03 -0.00 0.00 -0.90 0.00 0.00 32.23 31.67 1bnp h LYS 48 CO -0.00 0.97 -0.38 1.52 -2.00 0.00 0.00 179.45 179.56 1bnp s TYR 49 N -2.89 3.37 0.59 0.07 1.13 -0.01 -4.96 117.35 114.64 1bnp s TYR 49 Ca -0.00 -0.03 0.06 0.00 -1.41 0.00 0.00 57.07 55.69 1bnp s TYR 49 Cb 0.10 -1.72 0.20 0.00 -1.10 0.00 0.00 41.96 39.44 1bnp s TYR 49 CO 0.82 0.28 0.98 -2.30 -2.51 0.00 0.00 175.55 172.82 1bnp n PRO 50 N -1.52 0.02 0.00 -3.49 -0.02 -1.26 -4.86 135.00 123.88 1bnp n PRO 50 Ca -0.06 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 1bnp n PRO 50 Cb 0.57 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1bnp n PRO 50 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 1bnp n HIS 51 N -2.50 -0.27 -3.22 6.00 1.44 -1.25 -4.90 115.22 110.51 1bnp n HIS 51 Ca 0.05 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.63 1bnp n HIS 51 Cb 1.03 0.06 0.01 0.00 0.12 0.00 0.00 29.99 31.21 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 0.00 -1.76 -4.09 -1.40 0.00 -1.26 -4.97 118.16 104.68 1bnp n LYS 52 Ca 0.00 1.51 -0.35 0.00 0.00 0.00 0.00 58.31 59.48 1bnp n LYS 52 Cb 0.00 -4.44 -0.13 0.00 0.00 0.00 0.00 35.03 30.46 1bnp n LYS 52 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.40 178.36 1bnp s ILE 53 N -2.64 3.77 -0.11 3.15 -5.25 -1.26 -4.84 121.20 114.02 1bnp s ILE 53 Ca 0.13 -0.37 0.16 0.00 -0.99 0.00 0.00 60.65 59.58 1bnp s ILE 53 Cb -0.03 -2.70 -0.16 0.00 2.95 0.00 0.00 42.46 42.52 1bnp s ILE 53 CO 0.81 0.43 0.76 1.17 -1.79 0.00 0.00 174.94 176.32 1bnp n LYS 54 N 4.31 0.63 0.00 0.37 0.00 -1.26 -4.63 118.16 117.57 1bnp n LYS 54 Ca -0.17 0.22 0.00 0.00 0.00 0.00 0.00 58.31 58.36 1bnp n LYS 54 Cb 0.52 -1.79 0.00 0.00 0.00 0.00 0.00 35.03 33.75 1bnp n LYS 54 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1bnp n SER 55 N -2.91 0.00 0.00 3.14 7.64 -1.26 -5.04 113.62 115.19 1bnp n SER 55 Ca -0.12 0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.78 1bnp n SER 55 Cb 0.89 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.09 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 2.39 3.67 0.30 0.23 0.00 -1.26 -4.95 105.19 105.56 1bnp n GLY 56 Ca 0.00 -0.53 0.20 0.00 0.00 0.00 0.00 46.02 45.69 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 1.00 0.05 4.61 0.00 -1.98 -2.79 119.26 120.15 1bnp h ALA 57 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1bnp h ALA 57 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1bnp h ALA 57 CO 0.00 0.00 -0.10 0.93 0.00 0.00 0.00 179.25 180.08 1bnp h GLU 58 N 0.00 -0.18 -0.09 0.00 5.08 -1.98 -1.01 114.58 116.39 1bnp h GLU 58 Ca 0.00 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1bnp h GLU 58 Cb 0.03 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 1bnp h GLU 58 CO 0.00 -0.12 0.14 0.00 -1.00 0.00 0.00 179.01 178.03 1bnp h ALA 59 N 0.74 1.56 -0.25 3.43 0.00 -1.83 -1.67 119.26 121.24 1bnp h ALA 59 Ca 0.02 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1bnp h ALA 59 Cb 0.21 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1bnp h ALA 59 CO -0.06 -0.19 0.02 -0.22 0.00 0.00 0.00 179.25 178.80 1bnp h LYS 60 N 0.00 0.42 -0.13 0.00 3.64 -1.30 -2.75 116.57 116.46 1bnp h LYS 60 Ca 0.04 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 1bnp h LYS 60 Cb 0.32 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 1bnp h LYS 60 CO -0.00 0.58 -0.07 1.57 -2.27 0.00 0.00 179.45 179.25 1bnp h LYS 61 N 0.21 0.19 -6.09 1.90 2.10 -1.18 -3.41 116.57 110.29 1bnp h LYS 61 Ca 0.07 -0.03 -0.58 0.00 -2.00 0.00 0.00 60.65 58.11 1bnp h LYS 61 Cb 0.37 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.67 1bnp h LYS 61 CO 0.01 0.28 1.42 -0.51 -2.00 0.00 0.00 179.45 178.65 1bnp s LEU 62 N -8.88 3.66 0.09 7.07 1.43 -1.04 -4.89 118.68 116.12 1bnp s LEU 62 Ca -0.05 2.01 -0.31 0.00 -1.03 0.00 0.00 54.13 54.74 1bnp s LEU 62 Cb 0.16 -3.52 -0.10 0.00 0.03 0.00 0.00 46.19 42.77 1bnp s LEU 62 CO 0.72 -1.75 1.81 -2.16 0.23 0.00 0.00 176.35 175.19 1bnp s PRO 63 N 5.89 4.15 0.00 1.29 0.04 -1.26 -2.34 135.00 142.77 1bnp s PRO 63 Ca 0.96 2.53 0.00 0.00 0.04 0.00 0.00 61.00 64.53 1bnp s PRO 63 Cb -0.34 -3.69 0.00 0.00 0.04 0.00 0.00 34.50 30.51 1bnp s PRO 63 CO 0.36 -0.84 0.00 0.41 0.04 0.00 0.00 177.00 176.97 1bnp n GLY 64 N 4.23 2.16 2.84 0.56 0.00 -1.26 -4.86 105.19 108.86 1bnp n GLY 64 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.05 1.59 -0.32 1.61 1.01 -0.99 -4.53 120.40 116.73 1bnp s VAL 65 Ca 0.00 -2.10 0.03 0.00 0.00 0.00 0.00 61.98 59.91 1bnp s VAL 65 Cb 0.00 -2.17 0.12 0.00 0.00 0.00 0.00 36.38 34.34 1bnp s VAL 65 CO 0.00 -0.70 1.10 0.61 0.00 0.00 0.00 175.10 176.10 1bnp n GLY 66 N 4.26 -0.31 2.11 4.51 0.00 -1.26 -3.99 105.19 110.52 1bnp n GLY 66 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1bnp n GLY 66 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1bnp n THR 67 N -0.53 0.00 0.00 2.61 -1.04 -1.26 -4.97 114.28 109.09 1bnp n THR 67 Ca -0.22 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.79 1bnp n THR 67 Cb 0.68 -0.10 0.00 0.00 -1.82 0.00 0.00 70.33 69.09 1bnp n THR 67 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1bnp n LYS 68 N -3.06 0.00 0.21 -2.82 4.81 -1.26 -4.80 118.16 111.24 1bnp n LYS 68 Ca 0.00 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.49 1bnp n LYS 68 Cb 0.00 -0.40 0.45 0.00 0.02 0.00 0.00 35.03 35.10 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 1.11 -0.31 3.15 5.03 -1.93 -2.22 117.51 122.34 1bnp h ILE 69 Ca 0.00 -1.00 0.01 0.00 -0.12 0.00 0.00 64.86 63.75 1bnp h ILE 69 Cb 0.29 1.55 -0.02 0.00 -3.03 0.00 0.00 36.82 35.62 1bnp h ILE 69 CO 0.00 0.28 0.21 0.00 -0.68 0.00 0.00 178.15 177.96 1bnp h ALA 70 N 1.72 1.79 -0.19 1.87 0.00 -1.87 -0.17 119.26 122.41 1bnp h ALA 70 Ca -0.00 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1bnp h ALA 70 Cb 0.53 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1bnp h ALA 70 CO 0.04 0.19 -0.46 1.49 0.00 0.00 0.00 179.25 180.51 1bnp h GLU 71 N 0.41 0.49 0.00 0.00 4.81 -1.71 -2.48 114.58 116.11 1bnp h GLU 71 Ca 0.12 -0.27 -0.03 0.00 -0.13 0.00 0.00 59.36 59.05 1bnp h GLU 71 Cb -0.03 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.36 1bnp h GLU 71 CO -0.03 0.85 -0.13 0.87 -0.73 0.00 0.00 179.01 179.84 1bnp h LYS 72 N 0.40 0.00 -0.18 1.92 1.79 -1.00 -1.95 116.57 117.54 1bnp h LYS 72 Ca 0.03 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.46 1bnp h LYS 72 Cb 0.96 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.60 1bnp h LYS 72 CO 0.08 0.13 -0.01 0.82 -1.08 0.00 0.00 179.45 179.40 1bnp h ILE 73 N 0.00 1.26 0.00 1.86 1.08 -0.96 -1.59 117.51 119.16 1bnp h ILE 73 Ca -0.00 -0.88 0.00 0.00 -0.39 0.00 0.00 64.86 63.59 1bnp h ILE 73 Cb 0.25 1.49 0.00 0.00 -3.07 0.00 0.00 36.82 35.48 1bnp h ILE 73 CO 0.02 0.27 0.00 0.44 -0.69 0.00 0.00 178.15 178.18 1bnp h ASP 74 N 0.07 0.00 0.64 1.72 3.32 -1.27 -1.24 116.42 119.66 1bnp h ASP 74 Ca 0.05 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.83 1bnp h ASP 74 Cb 0.40 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 1bnp h ASP 74 CO 0.01 0.00 -1.37 -0.33 -1.72 0.00 0.00 179.24 175.83 1bnp h GLU 75 N 0.00 0.13 -0.82 3.56 5.08 -0.79 -1.21 114.58 120.53 1bnp h GLU 75 Ca 0.00 -0.23 0.01 0.00 -1.00 0.00 0.00 59.36 58.15 1bnp h GLU 75 Cb 0.09 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 1bnp h GLU 75 CO 0.00 0.98 0.54 0.74 -1.00 0.00 0.00 179.01 180.27 1bnp h PHE 76 N 0.04 1.02 0.01 4.33 0.04 -0.67 -2.67 116.94 119.04 1bnp h PHE 76 Ca -0.17 0.02 -0.30 0.00 2.80 0.00 0.00 57.97 60.32 1bnp h PHE 76 Cb 1.94 -0.34 -0.05 0.00 2.20 0.00 0.00 35.95 39.69 1bnp h PHE 76 CO 0.03 0.63 -1.79 1.28 -0.60 0.00 0.00 178.31 177.87 1bnp n LEU 77 N -4.42 0.97 -2.39 1.54 4.77 -1.20 -4.14 117.00 112.14 1bnp n LEU 77 Ca 0.09 0.36 -0.26 0.00 -0.03 0.00 0.00 56.01 56.17 1bnp n LEU 77 Cb 0.04 0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.19 1bnp n LEU 77 CO 0.36 0.44 1.49 0.00 -1.33 0.00 0.00 177.39 178.35 1bnp n ALA 78 N -2.61 6.15 -0.25 -1.18 0.00 -0.46 -4.54 120.51 117.63 1bnp n ALA 78 Ca -0.20 -2.87 0.00 0.00 0.00 0.00 0.00 53.44 50.38 1bnp n ALA 78 Cb 1.06 -1.93 0.23 0.00 0.00 0.00 0.00 19.45 18.81 1bnp n ALA 78 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1bnp n THR 79 N 0.49 1.89 -1.01 0.00 5.66 -1.07 -4.20 114.28 116.04 1bnp n THR 79 Ca 0.46 -0.96 -0.12 0.00 -3.05 0.00 0.00 64.05 60.38 1bnp n THR 79 Cb 0.53 -0.42 0.25 0.00 -1.55 0.00 0.00 70.33 69.14 1bnp n THR 79 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1bnp n GLY 80 N 0.20 3.86 2.71 1.09 0.00 -1.26 -4.40 105.19 107.39 1bnp n GLY 80 Ca 0.22 -0.98 -0.08 0.00 0.00 0.00 0.00 46.02 45.18 1bnp n GLY 80 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bnp n LYS 81 N -0.48 1.11 -3.91 1.61 5.02 -1.26 -5.12 118.16 115.13 1bnp n LYS 81 Ca 0.46 -1.85 -0.35 0.00 -2.02 0.00 0.00 58.31 54.55 1bnp n LYS 81 Cb 1.46 -0.46 -0.11 0.00 -0.02 0.00 0.00 35.03 35.90 1bnp n LYS 81 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1bnp s LEU 82 N -2.78 3.64 0.00 -0.35 2.96 -1.26 -5.00 118.68 115.89 1bnp s LEU 82 Ca 0.22 -0.05 0.00 0.00 -0.22 0.00 0.00 54.13 54.08 1bnp s LEU 82 Cb 0.35 -1.95 0.00 0.00 0.50 0.00 0.00 46.19 45.09 1bnp s LEU 82 CO -0.07 0.08 0.00 0.54 -1.32 0.00 0.00 176.35 175.57 1bnp n ARG 83 N 4.18 -1.24 -3.29 1.98 5.12 -1.26 -4.72 116.66 117.44 1bnp n ARG 83 Ca -0.16 0.81 -0.25 0.00 -1.93 0.00 0.00 57.85 56.33 1bnp n ARG 83 Cb 0.52 -1.51 -0.08 0.00 -1.16 0.00 0.00 32.46 30.23 1bnp n ARG 83 CO 0.00 0.00 0.00 0.36 -1.93 0.00 0.00 177.63 176.06 1bnp n LYS 84 N -2.84 0.34 -0.12 5.56 2.85 -1.26 -4.94 118.16 117.75 1bnp n LYS 84 Ca 0.00 -3.09 -0.19 0.00 -1.05 0.00 0.00 58.31 53.98 1bnp n LYS 84 Cb 0.28 -1.54 -0.12 0.00 -0.65 0.00 0.00 35.03 33.00 1bnp n LYS 84 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1bnp n LEU 85 N 2.47 2.89 -3.41 -5.58 4.32 -1.26 -5.02 117.00 111.41 1bnp n LEU 85 Ca 0.27 -0.08 -0.17 0.00 -0.02 0.00 0.00 56.01 56.01 1bnp n LEU 85 Cb 0.50 -0.93 0.08 0.00 -1.62 0.00 0.00 43.42 41.45 1bnp n LEU 85 CO 0.10 0.91 0.06 -0.62 -1.22 0.00 0.00 177.39 176.62 1bnp n GLU 86 N -3.34 -4.82 -0.50 3.23 -0.58 -1.26 -5.31 120.64 108.06 1bnp n GLU 86 Ca -0.45 0.82 0.00 0.00 -0.42 0.00 0.00 57.16 57.11 1bnp n GLU 86 Cb 0.99 -5.73 0.00 0.00 -0.57 0.00 0.00 31.44 26.13 1bnp n GLU 86 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28