#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bno n SER 2 N 0.00 -8.02 -0.05 6.12 2.88 -1.26 -5.00 113.62 108.30 1bno n SER 2 Ca 0.00 1.07 -0.02 0.00 -1.33 0.00 0.00 58.87 58.58 1bno n SER 2 Cb 0.00 -5.38 -0.01 0.00 -0.75 0.00 0.00 64.21 58.07 1bno n SER 2 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1bno h LYS 3 N 2.62 0.00 0.00 -1.46 1.79 -2.07 -3.48 116.57 113.96 1bno h LYS 3 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1bno h LYS 3 Cb 0.42 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.07 1bno h LYS 3 CO 0.14 0.00 0.00 -2.13 -1.08 0.00 0.00 179.45 176.38 1bno n ARG 4 N -4.20 0.00 -2.85 3.15 3.00 -1.26 -5.09 116.66 109.41 1bno n ARG 4 Ca -0.04 0.00 0.02 0.00 -0.00 0.00 0.00 57.85 57.83 1bno n ARG 4 Cb 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 32.46 32.58 1bno n ARG 4 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 1bno s LYS 5 N -1.96 0.23 0.36 -0.14 2.36 -1.26 -5.16 119.74 114.17 1bno s LYS 5 Ca 0.00 -0.05 -0.08 0.00 -2.55 0.00 0.00 55.97 53.29 1bno s LYS 5 Cb 0.00 0.03 -0.06 0.00 -1.05 0.00 0.00 37.83 36.76 1bno s LYS 5 CO 0.00 -0.35 0.67 0.00 1.55 0.00 0.00 175.35 177.22 1bno s ALA 6 N 2.07 3.48 1.28 3.13 0.00 -1.26 -5.07 121.76 125.39 1bno s ALA 6 Ca 0.16 -0.39 -0.16 0.00 0.00 0.00 0.00 51.96 51.57 1bno s ALA 6 Cb 0.02 -2.51 0.33 0.00 0.00 0.00 0.00 23.12 20.96 1bno s ALA 6 CO -0.15 0.09 0.98 -1.25 0.00 0.00 0.00 175.76 175.43 1bno s PRO 7 N -3.76 -1.83 -0.08 0.00 0.04 -1.26 -4.97 135.00 123.15 1bno s PRO 7 Ca 0.48 0.58 -0.00 0.00 0.04 0.00 0.00 61.00 62.09 1bno s PRO 7 Cb -0.10 -1.47 -0.26 0.00 0.04 0.00 0.00 34.50 32.71 1bno s PRO 7 CO 0.31 -4.26 0.54 1.96 0.04 0.00 0.00 177.00 175.59 1bno h GLN 8 N -2.99 0.18 -0.65 4.56 7.50 -2.04 -3.39 115.11 118.28 1bno h GLN 8 Ca -0.56 -0.31 -0.43 0.00 0.50 0.00 0.00 58.65 57.84 1bno h GLN 8 Cb 1.34 0.12 -0.42 0.00 0.05 0.00 0.00 27.48 28.57 1bno h GLN 8 CO 0.43 0.97 -0.93 0.39 -1.50 0.00 0.00 178.83 178.19 1bno n GLU 9 N -3.34 2.88 -0.70 1.46 -0.58 -1.26 -5.11 120.64 113.99 1bno n GLU 9 Ca -0.25 -3.92 0.09 0.00 -0.42 0.00 0.00 57.16 52.67 1bno n GLU 9 Cb 1.05 -2.02 -0.02 0.00 -0.57 0.00 0.00 31.44 29.88 1bno n GLU 9 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1bno n THR 10 N -0.66 0.00 0.00 2.62 -2.24 -1.26 -4.75 114.28 107.99 1bno n THR 10 Ca 0.30 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.08 1bno n THR 10 Cb 0.90 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 1bno n THR 10 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1bno n LEU 11 N 0.00 0.16 0.00 3.22 7.94 -1.26 -4.95 117.00 122.11 1bno n LEU 11 Ca 0.00 0.22 0.00 0.00 -1.11 0.00 0.00 56.01 55.12 1bno n LEU 11 Cb 0.32 -0.45 0.00 0.00 0.53 0.00 0.00 43.42 43.82 1bno n LEU 11 CO 0.00 -0.45 0.00 0.59 -1.11 0.00 0.00 177.39 176.43 1bno n ASN 12 N -2.12 0.00 0.00 1.96 3.02 -1.26 -5.07 115.26 111.79 1bno n ASN 12 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1bno n ASN 12 Cb 0.00 0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.32 1bno n ASN 12 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bno n GLY 13 N -0.07 -0.71 2.37 7.41 0.00 -1.26 -4.81 105.19 108.12 1bno n GLY 13 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1bno n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bno n GLY 14 N 0.00 0.12 0.16 -0.02 0.00 -1.26 -4.73 105.19 99.46 1bno n GLY 14 Ca 0.00 -0.33 -0.05 0.00 0.00 0.00 0.00 46.02 45.64 1bno n GLY 14 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1bno h ILE 15 N -0.76 0.00 0.00 -0.61 2.04 -1.96 -3.17 117.51 113.06 1bno h ILE 15 Ca -0.26 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.04 1bno h ILE 15 Cb 1.18 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1bno h ILE 15 CO 0.27 0.00 0.01 0.00 0.00 0.00 0.00 178.15 178.44 1bno h THR 16 N -0.89 0.00 0.01 -0.27 1.03 -1.92 -1.74 112.91 109.14 1bno h THR 16 Ca -0.03 0.00 -0.00 0.00 -0.01 0.00 0.00 66.41 66.37 1bno h THR 16 Cb 0.25 0.81 0.00 0.00 -1.07 0.00 0.00 68.15 68.14 1bno h THR 16 CO 0.05 0.00 -0.01 0.44 -0.01 0.00 0.00 175.52 176.00 1bno h ASP 17 N 0.00 -0.01 1.73 0.00 5.19 -1.96 -2.19 116.42 119.17 1bno h ASP 17 Ca 0.00 -0.66 0.00 0.00 -0.62 0.00 0.00 57.03 55.75 1bno h ASP 17 Cb 0.03 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.54 1bno h ASP 17 CO 0.00 0.67 0.00 0.24 -3.12 0.00 0.00 179.24 177.03 1bno h MET 18 N -0.71 0.00 0.06 3.56 2.86 -1.44 -2.03 114.93 117.23 1bno h MET 18 Ca -0.00 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.46 1bno h MET 18 Cb 0.68 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.35 1bno h MET 18 CO 0.00 0.00 -0.75 1.25 1.06 0.00 0.00 176.91 178.47 1bno h LEU 19 N 0.00 0.56 -1.35 1.22 6.46 -1.38 -3.04 115.31 117.78 1bno h LEU 19 Ca 0.00 -0.83 -0.01 0.00 -0.12 0.00 0.00 57.88 56.92 1bno h LEU 19 Cb 0.86 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 40.62 1bno h LEU 19 CO 0.00 1.32 -0.06 0.58 -0.62 0.00 0.00 178.44 179.66 1bno h VAL 20 N -0.14 0.16 -0.30 1.05 2.07 -1.39 -2.95 116.25 114.75 1bno h VAL 20 Ca -0.11 -0.68 -0.05 0.00 0.82 0.00 0.00 66.70 66.68 1bno h VAL 20 Cb 1.49 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 32.83 1bno h VAL 20 CO 0.14 0.06 -0.00 -0.08 0.02 0.00 0.00 177.57 177.71 1bno h GLU 21 N 0.00 0.53 -0.53 1.57 4.81 -1.25 -0.57 114.58 119.14 1bno h GLU 21 Ca -0.00 -0.17 -0.03 0.00 -0.13 0.00 0.00 59.36 59.03 1bno h GLU 21 Cb 0.58 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.89 1bno h GLU 21 CO 0.01 0.67 0.21 1.25 -0.73 0.00 0.00 179.01 180.42 1bno h LEU 22 N 0.32 0.69 -1.26 1.64 6.46 -1.46 -0.29 115.31 121.42 1bno h LEU 22 Ca 0.09 -0.09 -0.06 0.00 -0.12 0.00 0.00 57.88 57.70 1bno h LEU 22 Cb 0.44 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.18 1bno h LEU 22 CO 0.02 0.63 -0.27 0.00 -0.62 0.00 0.00 178.44 178.20 1bno h ALA 23 N 1.47 1.12 -0.00 1.25 0.00 -1.40 -2.31 119.26 119.38 1bno h ALA 23 Ca 0.18 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1bno h ALA 23 Cb 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1bno h ALA 23 CO -0.02 0.34 -0.12 -1.71 0.00 0.00 0.00 179.25 177.75 1bno n ASN 24 N -3.58 0.50 -0.33 0.00 5.15 -0.18 -4.27 115.26 112.55 1bno n ASN 24 Ca -0.01 -0.59 0.21 0.00 -0.60 0.00 0.00 54.58 53.60 1bno n ASN 24 Cb 0.41 -0.06 0.40 0.00 -0.53 0.00 0.00 39.78 40.00 1bno n ASN 24 CO 0.00 0.00 0.00 -0.26 1.40 0.00 0.00 177.26 178.40 1bno h PHE 25 N 0.60 0.29 -1.98 1.20 0.04 -0.81 -3.44 116.94 112.85 1bno h PHE 25 Ca 0.00 0.06 -0.31 0.00 2.80 0.00 0.00 57.97 60.52 1bno h PHE 25 Cb 0.37 0.04 -0.09 0.00 2.20 0.00 0.00 35.95 38.46 1bno h PHE 25 CO 0.00 -0.44 -0.31 -1.91 -0.60 0.00 0.00 178.31 175.04 1bno n GLU 26 N -5.39 -1.55 0.00 1.51 2.13 -1.22 -4.58 120.64 111.54 1bno n GLU 26 Ca 0.29 0.84 0.00 0.00 0.66 0.00 0.00 57.16 58.95 1bno n GLU 26 Cb 0.96 -5.22 0.00 0.00 0.27 0.00 0.00 31.44 27.44 1bno n GLU 26 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1bno n LYS 27 N -2.26 0.00 0.16 5.31 5.02 -1.26 -4.75 118.16 120.38 1bno n LYS 27 Ca -0.16 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.16 1bno n LYS 27 Cb 0.54 0.00 0.24 0.00 -0.02 0.00 0.00 35.03 35.78 1bno n LYS 27 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 1bno h ASN 28 N 0.00 0.00 -1.97 4.39 -0.73 -1.97 -3.36 115.58 111.95 1bno h ASN 28 Ca 0.00 0.00 -0.55 0.00 1.87 0.00 0.00 56.30 57.62 1bno h ASN 28 Cb 0.00 0.00 -0.37 0.00 0.27 0.00 0.00 38.32 38.22 1bno h ASN 28 CO 0.00 0.48 -1.05 0.52 -0.37 0.00 0.00 177.43 177.01 1bno n VAL 29 N -3.54 -0.76 0.00 2.57 0.31 -1.26 -5.02 118.33 110.63 1bno n VAL 29 Ca -0.00 -3.76 0.00 0.00 -0.01 0.00 0.00 64.34 60.57 1bno n VAL 29 Cb 0.59 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 31.80 1bno n VAL 29 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1bno n SER 30 N 1.70 0.00 -3.85 4.52 2.88 -1.26 -3.38 113.62 114.23 1bno n SER 30 Ca 0.22 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.64 1bno n SER 30 Cb 0.53 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.86 1bno n SER 30 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 1bno s GLN 31 N 0.00 0.22 -0.45 -1.46 -0.21 -1.26 -4.76 119.66 111.74 1bno s GLN 31 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 55.36 55.37 1bno s GLN 31 Cb 0.00 0.09 0.00 0.00 1.00 0.00 0.00 33.01 34.10 1bno s GLN 31 CO 0.00 -0.04 0.00 0.00 -2.12 0.00 0.00 175.29 173.13 1bno n ALA 32 N 2.60 -0.14 -2.22 6.09 0.00 -1.26 -5.03 120.51 120.54 1bno n ALA 32 Ca -0.15 0.05 -0.23 0.00 0.00 0.00 0.00 53.44 53.10 1bno n ALA 32 Cb 0.58 -0.91 0.02 0.00 0.00 0.00 0.00 19.45 19.14 1bno n ALA 32 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bno s ILE 33 N -2.24 3.71 -0.02 0.00 -1.09 -1.26 -5.02 121.20 115.27 1bno s ILE 33 Ca 0.00 -0.44 -0.20 0.00 -2.23 0.00 0.00 60.65 57.78 1bno s ILE 33 Cb 0.00 -3.39 -0.28 0.00 -1.58 0.00 0.00 42.46 37.21 1bno s ILE 33 CO 0.00 -0.30 1.00 1.12 -1.23 0.00 0.00 174.94 175.53 1bno h HIS 34 N 0.24 0.61 0.00 3.97 2.07 -1.96 -3.32 115.15 116.76 1bno h HIS 34 Ca -0.45 -0.39 0.00 0.00 -2.85 0.00 0.00 60.37 56.68 1bno h HIS 34 Cb 1.26 -0.05 0.00 0.00 2.57 0.00 0.00 27.41 31.19 1bno h HIS 34 CO 0.44 1.26 -0.64 1.63 -3.07 0.00 0.00 177.93 177.55 1bno n LYS 35 N -4.14 0.02 0.28 5.12 5.02 -1.26 -4.04 118.16 119.16 1bno n LYS 35 Ca -0.12 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.30 1bno n LYS 35 Cb 0.77 -1.51 0.80 0.00 -0.02 0.00 0.00 35.03 35.08 1bno n LYS 35 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 1bno h TYR 36 N 0.00 0.00 0.00 2.13 3.20 -1.94 -1.04 116.97 119.31 1bno h TYR 36 Ca 0.00 0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.73 1bno h TYR 36 Cb 0.51 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.76 1bno h TYR 36 CO 0.00 0.07 -0.65 -0.91 -1.64 0.00 0.00 178.16 175.04 1bno h ASN 37 N 0.00 0.00 -0.90 -2.11 4.21 -1.73 -3.14 115.58 111.91 1bno h ASN 37 Ca -0.00 0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.53 1bno h ASN 37 Cb 0.20 0.00 -0.05 0.00 -1.12 0.00 0.00 38.32 37.35 1bno h ASN 37 CO 0.01 0.65 0.60 0.00 -1.29 0.00 0.00 177.43 177.39 1bno h ALA 38 N 1.35 1.40 0.00 -0.83 0.00 -1.42 -1.96 119.26 117.81 1bno h ALA 38 Ca -0.01 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1bno h ALA 38 Cb 1.30 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1bno h ALA 38 CO 0.08 0.54 -0.32 1.88 0.00 0.00 0.00 179.25 181.42 1bno h TYR 39 N 1.17 0.00 -0.18 0.00 0.05 -1.60 -2.42 116.97 114.00 1bno h TYR 39 Ca 0.35 0.00 -0.21 0.00 0.05 0.00 0.00 58.73 58.91 1bno h TYR 39 Cb -0.05 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.70 1bno h TYR 39 CO -0.00 0.17 -0.72 -0.09 -1.05 0.00 0.00 178.16 176.46 1bno h ARG 40 N 0.00 0.81 0.11 4.88 9.65 -1.32 -1.62 114.38 126.89 1bno h ARG 40 Ca -0.01 -0.63 -0.17 0.00 -1.10 0.00 0.00 59.98 58.07 1bno h ARG 40 Cb 1.13 0.12 0.01 0.00 -1.39 0.00 0.00 29.97 29.85 1bno h ARG 40 CO 0.02 1.24 -0.81 0.87 2.80 0.00 0.00 179.97 184.09 1bno h LYS 41 N 0.55 0.23 -0.27 0.20 1.57 -1.50 -2.56 116.57 114.79 1bno h LYS 41 Ca -0.04 -0.39 -0.02 0.00 -1.87 0.00 0.00 60.65 58.32 1bno h LYS 41 Cb 1.35 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.79 1bno h LYS 41 CO 0.15 1.19 0.07 0.00 -0.57 0.00 0.00 179.45 180.29 1bno h ALA 42 N 0.02 1.62 0.00 3.86 0.00 -1.53 -1.40 119.26 121.82 1bno h ALA 42 Ca -0.16 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 1bno h ALA 42 Cb 1.55 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.22 1bno h ALA 42 CO 0.10 0.29 -0.24 0.00 0.00 0.00 0.00 179.25 179.40 1bno h ALA 43 N 1.70 0.87 -0.04 0.00 0.00 -1.38 -1.82 119.26 118.60 1bno h ALA 43 Ca 0.09 -0.11 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 1bno h ALA 43 Cb 0.15 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1bno h ALA 43 CO -0.00 0.15 -0.79 1.03 0.00 0.00 0.00 179.25 179.64 1bno h SER 44 N 0.00 0.36 0.60 0.00 0.87 -0.83 -2.22 113.55 112.34 1bno h SER 44 Ca -0.01 -0.26 -0.22 0.00 -1.23 0.00 0.00 61.79 60.08 1bno h SER 44 Cb 1.09 -0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 62.91 1bno h SER 44 CO 0.01 1.01 -1.55 0.55 -0.53 0.00 0.00 176.83 176.32 1bno n VAL 45 N -3.77 1.37 0.04 2.23 3.14 -0.98 -3.63 118.33 116.74 1bno n VAL 45 Ca -0.04 -0.74 -0.10 0.00 -2.96 0.00 0.00 64.34 60.51 1bno n VAL 45 Cb 0.74 -0.87 -0.07 0.00 -1.06 0.00 0.00 33.84 32.59 1bno n VAL 45 CO 0.00 0.00 0.00 0.40 -6.46 0.00 0.00 176.83 170.77 1bno h ILE 46 N 0.00 0.76 -0.83 1.55 5.03 -1.36 -1.75 117.51 120.91 1bno h ILE 46 Ca -0.22 -1.20 0.11 0.00 -0.12 0.00 0.00 64.86 63.43 1bno h ILE 46 Cb 1.77 1.32 -0.06 0.00 -3.03 0.00 0.00 36.82 36.83 1bno h ILE 46 CO 0.06 0.21 0.54 0.00 -0.68 0.00 0.00 178.15 178.28 1bno h ALA 47 N -0.44 1.76 -0.29 1.87 0.00 -1.59 0.35 119.26 120.92 1bno h ALA 47 Ca -0.02 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 1bno h ALA 47 Cb 0.50 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1bno h ALA 47 CO 0.03 0.06 -0.35 0.87 0.00 0.00 0.00 179.25 179.87 1bno h LYS 48 N 0.75 0.63 -7.09 0.00 1.57 -1.62 -3.44 116.57 107.37 1bno h LYS 48 Ca 0.39 -0.30 -0.55 0.00 -1.87 0.00 0.00 60.65 58.33 1bno h LYS 48 Cb 0.50 -0.01 0.18 0.00 0.08 0.00 0.00 32.23 32.98 1bno h LYS 48 CO -0.16 0.89 0.25 0.98 -0.57 0.00 0.00 179.45 180.84 1bno n TYR 49 N -4.06 1.07 0.17 -1.35 9.36 0.12 -4.83 117.16 117.65 1bno n TYR 49 Ca -0.01 0.40 0.02 0.00 3.32 0.00 0.00 57.90 61.63 1bno n TYR 49 Cb 0.49 -2.11 0.10 0.00 -0.63 0.00 0.00 39.34 37.19 1bno n TYR 49 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 1bno n PRO 50 N -2.55 0.02 -0.31 2.98 -0.02 -1.26 -4.94 135.00 128.92 1bno n PRO 50 Ca 0.13 0.37 0.04 0.00 -2.02 0.00 0.00 63.50 62.02 1bno n PRO 50 Cb 0.50 -1.50 -0.01 0.00 -0.02 0.00 0.00 33.50 32.46 1bno n PRO 50 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1bno n HIS 51 N -1.43 -0.81 -1.86 6.00 8.25 -1.26 -5.03 115.22 119.08 1bno n HIS 51 Ca 0.01 0.42 0.00 0.00 -0.26 0.00 0.00 57.72 57.90 1bno n HIS 51 Cb 0.05 -0.74 0.00 0.00 1.12 0.00 0.00 29.99 30.42 1bno n HIS 51 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1bno n LYS 52 N -2.83 -4.98 -3.23 -0.41 0.00 -1.26 -4.86 118.16 100.59 1bno n LYS 52 Ca -0.01 3.58 -0.02 0.00 0.00 0.00 0.00 58.31 61.85 1bno n LYS 52 Cb 0.15 -3.81 -0.04 0.00 0.00 0.00 0.00 35.03 31.33 1bno n LYS 52 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.40 178.36 1bno s ILE 53 N -0.75 -0.81 0.04 3.15 -4.36 -1.26 -4.91 121.20 112.29 1bno s ILE 53 Ca 0.00 -0.10 -0.31 0.00 -0.26 0.00 0.00 60.65 59.98 1bno s ILE 53 Cb 0.00 -0.96 -0.18 0.00 1.25 0.00 0.00 42.46 42.57 1bno s ILE 53 CO 0.00 -0.11 1.35 0.11 0.24 0.00 0.00 174.94 176.53 1bno h LYS 54 N 8.08 -0.98 -6.86 0.37 1.57 -1.96 -3.43 116.57 113.37 1bno h LYS 54 Ca -0.12 0.07 -0.51 0.00 -1.87 0.00 0.00 60.65 58.22 1bno h LYS 54 Cb 1.16 0.22 0.04 0.00 0.08 0.00 0.00 32.23 33.72 1bno h LYS 54 CO 0.23 -0.63 0.52 -1.12 -0.57 0.00 0.00 179.45 177.88 1bno s SER 55 N -4.37 6.98 0.43 0.86 0.01 -1.26 -4.92 113.70 111.43 1bno s SER 55 Ca -0.16 2.39 0.24 0.00 1.31 0.00 0.00 55.95 59.73 1bno s SER 55 Cb 0.02 -2.63 0.80 0.00 0.21 0.00 0.00 66.02 64.42 1bno s SER 55 CO 0.52 -0.36 1.77 1.23 0.41 0.00 0.00 173.24 176.81 1bno h GLY 56 N 3.43 0.00 1.77 3.44 0.00 -1.99 -3.04 103.07 106.68 1bno h GLY 56 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1bno h GLY 56 CO 0.65 0.00 0.11 0.00 0.00 0.00 0.00 176.54 177.31 1bno h ALA 57 N 1.80 1.17 0.20 3.60 0.00 -1.96 -2.54 119.26 121.53 1bno h ALA 57 Ca -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1bno h ALA 57 Cb 0.83 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1bno h ALA 57 CO 0.03 -0.12 -0.15 0.93 0.00 0.00 0.00 179.25 179.93 1bno h GLU 58 N 0.00 -0.35 -0.04 0.00 5.08 -1.92 -1.10 114.58 116.26 1bno h GLU 58 Ca 0.01 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1bno h GLU 58 Cb 0.23 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1bno h GLU 58 CO -0.00 -0.23 0.09 0.00 -1.00 0.00 0.00 179.01 177.87 1bno h ALA 59 N 0.41 1.34 -0.19 3.43 0.00 -1.70 -1.95 119.26 120.60 1bno h ALA 59 Ca -0.01 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1bno h ALA 59 Cb 0.32 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1bno h ALA 59 CO -0.01 -0.11 -0.05 -0.22 0.00 0.00 0.00 179.25 178.86 1bno h LYS 60 N 0.00 0.37 0.00 0.00 3.64 -1.28 -2.88 116.57 116.42 1bno h LYS 60 Ca 0.02 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.21 1bno h LYS 60 Cb 0.20 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 1bno h LYS 60 CO -0.00 0.63 -0.20 1.57 -2.27 0.00 0.00 179.45 179.18 1bno h LYS 61 N 0.09 0.00 -6.24 1.90 2.10 -1.20 -3.42 116.57 109.80 1bno h LYS 61 Ca 0.05 0.00 -0.57 0.00 -2.00 0.00 0.00 60.65 58.13 1bno h LYS 61 Cb 0.50 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.81 1bno h LYS 61 CO 0.02 0.20 1.22 -0.51 -2.00 0.00 0.00 179.45 178.38 1bno s LEU 62 N -7.37 3.83 0.35 7.07 1.43 -1.09 -4.94 118.68 117.97 1bno s LEU 62 Ca -0.02 1.75 -0.29 0.00 -1.03 0.00 0.00 54.13 54.55 1bno s LEU 62 Cb 0.13 -3.53 -0.11 0.00 0.03 0.00 0.00 46.19 42.71 1bno s LEU 62 CO 0.63 -1.42 1.49 -2.16 0.23 0.00 0.00 176.35 175.12 1bno s PRO 63 N 5.07 4.14 0.00 1.29 0.04 -1.26 -2.21 135.00 142.07 1bno s PRO 63 Ca 0.80 2.53 0.00 0.00 0.04 0.00 0.00 61.00 64.36 1bno s PRO 63 Cb -0.28 -2.99 0.00 0.00 0.04 0.00 0.00 34.50 31.26 1bno s PRO 63 CO 0.32 -0.51 0.00 0.41 0.04 0.00 0.00 177.00 177.26 1bno n GLY 64 N 0.90 3.24 3.22 0.56 0.00 -1.26 -4.80 105.19 107.05 1bno n GLY 64 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 1bno n GLY 64 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bno s VAL 65 N -2.33 1.70 0.00 1.61 1.01 -0.94 -4.46 120.40 116.99 1bno s VAL 65 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.08 1bno s VAL 65 Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 36.38 34.95 1bno s VAL 65 CO 0.00 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.19 1bno n GLY 66 N 2.74 0.12 1.15 4.51 0.00 -1.26 -4.38 105.19 108.07 1bno n GLY 66 Ca -0.16 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1bno n GLY 66 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1bno n THR 67 N 0.00 0.00 0.00 2.61 -1.04 -1.26 -4.96 114.28 109.63 1bno n THR 67 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1bno n THR 67 Cb 0.00 -0.05 0.00 0.00 -1.82 0.00 0.00 70.33 68.46 1bno n THR 67 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1bno n LYS 68 N -2.07 0.00 0.25 -2.82 4.81 -1.26 -4.84 118.16 112.23 1bno n LYS 68 Ca 0.00 0.00 0.15 0.00 -0.87 0.00 0.00 58.31 57.59 1bno n LYS 68 Cb 0.00 -0.12 0.53 0.00 0.02 0.00 0.00 35.03 35.46 1bno n LYS 68 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 1bno h ILE 69 N 0.00 0.00 -0.48 3.15 2.04 -1.95 -3.09 117.51 117.18 1bno h ILE 69 Ca 0.00 -0.62 0.08 0.00 1.00 0.00 0.00 64.86 65.32 1bno h ILE 69 Cb 0.00 1.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 1bno h ILE 69 CO 0.00 0.00 0.33 0.00 0.00 0.00 0.00 178.15 178.48 1bno h ALA 70 N 2.03 2.02 -0.25 1.87 0.00 -1.92 0.35 119.26 123.36 1bno h ALA 70 Ca 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 1bno h ALA 70 Cb 0.64 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1bno h ALA 70 CO 0.00 -0.12 -0.36 1.49 0.00 0.00 0.00 179.25 180.26 1bno h GLU 71 N 0.33 0.56 0.00 0.00 4.81 -1.90 -2.58 114.58 115.80 1bno h GLU 71 Ca 0.22 -0.27 -0.06 0.00 -0.13 0.00 0.00 59.36 59.11 1bno h GLU 71 Cb 0.42 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1bno h GLU 71 CO -0.05 0.84 -0.31 -0.22 -0.73 0.00 0.00 179.01 178.54 1bno h LYS 72 N 0.47 0.00 0.10 1.92 3.64 -1.10 -1.59 116.57 120.01 1bno h LYS 72 Ca 0.05 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1bno h LYS 72 Cb 0.85 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 1bno h LYS 72 CO 0.07 0.31 -0.05 0.82 -2.27 0.00 0.00 179.45 178.33 1bno h ILE 73 N 0.00 1.04 0.00 2.00 1.08 -1.01 -2.23 117.51 118.39 1bno h ILE 73 Ca -0.00 -0.52 -0.03 0.00 -0.39 0.00 0.00 64.86 63.92 1bno h ILE 73 Cb 0.60 1.37 -0.00 0.00 -3.07 0.00 0.00 36.82 35.71 1bno h ILE 73 CO 0.04 0.13 -0.13 -0.78 -0.69 0.00 0.00 178.15 176.72 1bno h ASP 74 N -0.37 0.00 -0.81 1.72 1.82 -1.43 -2.00 116.42 115.35 1bno h ASP 74 Ca -0.01 0.00 0.01 0.00 -0.39 0.00 0.00 57.03 56.64 1bno h ASP 74 Cb 0.31 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 40.28 1bno h ASP 74 CO 0.02 0.13 0.54 -0.08 -1.61 0.00 0.00 179.24 178.24 1bno h GLU 75 N 0.00 1.06 0.17 0.28 4.81 -0.67 0.89 114.58 121.12 1bno h GLU 75 Ca -0.00 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1bno h GLU 75 Cb 0.32 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1bno h GLU 75 CO 0.02 0.70 -0.08 0.74 -0.73 0.00 0.00 179.01 179.66 1bno h PHE 76 N 1.09 -0.21 -0.58 0.92 0.04 -1.13 -2.87 116.94 114.21 1bno h PHE 76 Ca 0.30 -0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.83 1bno h PHE 76 Cb -0.12 0.07 -0.14 0.00 2.20 0.00 0.00 35.95 37.96 1bno h PHE 76 CO -0.00 0.04 0.30 1.28 -0.60 0.00 0.00 178.31 179.32 1bno n LEU 77 N -5.09 5.08 0.03 1.54 4.77 -0.90 -4.21 117.00 118.21 1bno n LEU 77 Ca -0.09 -2.66 -0.16 0.00 -0.03 0.00 0.00 56.01 53.07 1bno n LEU 77 Cb 0.19 -0.69 -0.14 0.00 -2.33 0.00 0.00 43.42 40.44 1bno n LEU 77 CO 0.33 0.75 -0.52 0.00 -1.33 0.00 0.00 177.39 176.62 1bno h ALA 78 N 2.01 0.45 -0.83 -1.18 0.00 0.10 -3.34 119.26 116.46 1bno h ALA 78 Ca 0.29 -1.28 -0.45 0.00 0.00 0.00 0.00 54.91 53.46 1bno h ALA 78 Cb 2.01 0.46 -0.26 0.00 0.00 0.00 0.00 17.79 20.00 1bno h ALA 78 CO 0.61 1.30 0.46 2.41 0.00 0.00 0.00 179.25 184.04 1bno n THR 79 N -3.36 3.07 -1.98 0.00 -1.04 -1.26 -4.37 114.28 105.34 1bno n THR 79 Ca -0.21 -2.25 0.03 0.00 -2.04 0.00 0.00 64.05 59.58 1bno n THR 79 Cb 1.05 -0.50 0.13 0.00 -1.82 0.00 0.00 70.33 69.19 1bno n THR 79 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1bno n GLY 80 N -1.12 3.73 2.22 3.41 0.00 -1.26 -4.79 105.19 107.39 1bno n GLY 80 Ca 0.53 -1.24 -0.28 0.00 0.00 0.00 0.00 46.02 45.04 1bno n GLY 80 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bno n LYS 81 N -0.54 2.38 -0.99 1.61 4.76 -1.26 -4.99 118.16 119.13 1bno n LYS 81 Ca 0.16 -2.96 -0.29 0.00 -2.87 0.00 0.00 58.31 52.34 1bno n LYS 81 Cb 0.87 -2.16 0.18 0.00 -1.84 0.00 0.00 35.03 32.07 1bno n LYS 81 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1bno s LEU 82 N -3.35 1.84 0.00 -0.35 1.02 -1.26 -5.03 118.68 111.55 1bno s LEU 82 Ca 0.57 1.51 -0.16 0.00 0.02 0.00 0.00 54.13 56.07 1bno s LEU 82 Cb 0.47 -3.75 0.22 0.00 0.02 0.00 0.00 46.19 43.15 1bno s LEU 82 CO 0.05 -3.17 1.30 0.54 0.02 0.00 0.00 176.35 175.09 1bno n ARG 83 N -4.23 -1.29 -1.03 1.70 1.74 -1.26 -5.01 116.66 107.28 1bno n ARG 83 Ca 0.06 -2.01 0.03 0.00 -0.77 0.00 0.00 57.85 55.16 1bno n ARG 83 Cb 0.55 -1.34 0.14 0.00 -1.02 0.00 0.00 32.46 30.79 1bno n ARG 83 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1bno n LYS 84 N -3.76 1.31 -2.54 5.56 4.81 -1.26 -5.05 118.16 117.23 1bno n LYS 84 Ca 0.16 -3.02 -0.04 0.00 -0.87 0.00 0.00 58.31 54.54 1bno n LYS 84 Cb 0.56 -1.23 -0.04 0.00 0.02 0.00 0.00 35.03 34.35 1bno n LYS 84 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1bno n LEU 85 N -0.63 -6.29 -4.73 3.14 4.32 -1.26 -4.93 117.00 106.62 1bno n LEU 85 Ca 0.17 2.49 -0.39 0.00 -0.02 0.00 0.00 56.01 58.26 1bno n LEU 85 Cb 0.84 -3.29 -0.05 0.00 -1.62 0.00 0.00 43.42 39.30 1bno n LEU 85 CO -0.00 -3.78 0.29 -1.61 -1.22 0.00 0.00 177.39 171.07 1bno s GLU 86 N -0.64 4.36 0.00 3.23 2.02 -1.26 -5.35 118.70 121.06 1bno s GLU 86 Ca -0.21 0.70 0.00 0.00 0.02 0.00 0.00 54.97 55.47 1bno s GLU 86 Cb 0.01 -3.41 0.00 0.00 0.10 0.00 0.00 34.13 30.84 1bno s GLU 86 CO 0.58 0.20 0.00 1.17 0.02 0.00 0.00 175.26 177.22