#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bq0 s LYS 2 N 0.00 1.04 -0.07 0.00 1.02 -1.26 -5.10 119.74 115.36 1bq0 s LYS 2 Ca 0.00 -1.56 0.02 0.00 0.02 0.00 0.00 55.97 54.45 1bq0 s LYS 2 Cb 0.00 -2.26 -0.03 0.00 -0.52 0.00 0.00 37.83 35.02 1bq0 s LYS 2 CO 0.00 -1.06 -0.11 -0.65 -0.92 0.00 0.00 175.35 172.62 1bq0 s GLN 3 N 1.00 2.79 1.24 1.68 -0.21 -1.26 -5.12 119.66 119.79 1bq0 s GLN 3 Ca 0.13 -0.63 -0.21 0.00 0.02 0.00 0.00 55.36 54.68 1bq0 s GLN 3 Cb -0.21 -2.53 0.31 0.00 1.00 0.00 0.00 33.01 31.59 1bq0 s GLN 3 CO -0.12 0.56 1.03 -3.47 -2.12 0.00 0.00 175.29 171.16 1bq0 n ASP 4 N 2.52 -2.45 -0.91 5.90 2.03 -1.26 -4.96 116.55 117.43 1bq0 n ASP 4 Ca -0.18 -1.10 0.07 0.00 0.52 0.00 0.00 54.79 54.11 1bq0 n ASP 4 Cb 0.53 -0.98 0.23 0.00 -0.72 0.00 0.00 41.12 40.18 1bq0 n ASP 4 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bq0 n TYR 5 N -4.98 0.83 0.03 -0.67 0.18 -1.26 -4.35 117.16 106.93 1bq0 n TYR 5 Ca 0.15 -0.66 -0.12 0.00 1.88 0.00 0.00 57.90 59.15 1bq0 n TYR 5 Cb 0.58 -0.17 -0.14 0.00 -0.38 0.00 0.00 39.34 39.23 1bq0 n TYR 5 CO 0.00 0.00 0.00 -0.92 -2.08 0.00 0.00 176.86 173.86 1bq0 h TYR 6 N 2.33 0.18 0.00 -3.48 5.03 -1.93 -3.30 116.97 115.80 1bq0 h TYR 6 Ca 0.00 -0.13 -0.02 0.00 2.58 0.00 0.00 58.73 61.15 1bq0 h TYR 6 Cb 1.13 -0.01 -0.00 0.00 1.55 0.00 0.00 36.73 39.40 1bq0 h TYR 6 CO 0.43 1.18 -0.80 0.93 -1.32 0.00 0.00 178.16 178.58 1bq0 h GLU 7 N 0.03 0.00 0.00 1.82 4.39 -1.83 -3.27 114.58 115.72 1bq0 h GLU 7 Ca -0.21 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.48 1bq0 h GLU 7 Cb 1.96 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 30.61 1bq0 h GLU 7 CO 0.12 0.06 -0.01 0.82 -1.16 0.00 0.00 179.01 178.84 1bq0 h ILE 8 N 0.00 0.09 -0.50 3.13 5.03 -1.76 -0.85 117.51 122.65 1bq0 h ILE 8 Ca -0.02 -0.17 0.00 0.00 -0.12 0.00 0.00 64.86 64.55 1bq0 h ILE 8 Cb 1.09 1.15 0.00 0.00 -3.03 0.00 0.00 36.82 36.03 1bq0 h ILE 8 CO 0.01 0.01 0.00 0.18 -0.68 0.00 0.00 178.15 177.67 1bq0 n LEU 9 N -3.19 4.93 -2.19 1.44 4.77 -1.24 -4.88 117.00 116.64 1bq0 n LEU 9 Ca -0.02 -2.50 -0.20 0.00 -0.03 0.00 0.00 56.01 53.26 1bq0 n LEU 9 Cb 0.14 -0.64 -0.03 0.00 -2.33 0.00 0.00 43.42 40.56 1bq0 n LEU 9 CO 0.23 0.59 -0.24 0.61 -1.33 0.00 0.00 177.39 177.26 1bq0 n GLY 10 N 0.61 0.12 4.01 -0.72 0.00 -0.33 -4.58 105.19 104.31 1bq0 n GLY 10 Ca 0.24 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.06 1bq0 n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bq0 s VAL 11 N -2.90 2.50 -2.22 1.61 1.01 -1.23 -4.98 120.40 114.18 1bq0 s VAL 11 Ca 0.00 -0.87 0.28 0.00 0.00 0.00 0.00 61.98 61.38 1bq0 s VAL 11 Cb 0.00 -2.62 0.68 0.00 0.00 0.00 0.00 36.38 34.43 1bq0 s VAL 11 CO 0.00 0.00 1.91 -1.54 0.00 0.00 0.00 175.10 175.47 1bq0 n SER 12 N -2.24 0.77 -0.60 3.32 3.41 -1.26 -4.65 113.62 112.36 1bq0 n SER 12 Ca 0.12 -1.32 -0.04 0.00 -0.26 0.00 0.00 58.87 57.37 1bq0 n SER 12 Cb 0.60 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.52 1bq0 n SER 12 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1bq0 n LYS 13 N -0.37 -1.61 0.00 4.33 2.85 -1.26 -4.45 118.16 117.64 1bq0 n LYS 13 Ca 0.20 0.35 0.00 0.00 -1.05 0.00 0.00 58.31 57.81 1bq0 n LYS 13 Cb 0.22 -4.07 0.00 0.00 -0.65 0.00 0.00 35.03 30.53 1bq0 n LYS 13 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1bq0 n THR 14 N -1.18 0.14 -0.36 0.58 -2.24 -1.26 -5.04 114.28 104.92 1bq0 n THR 14 Ca -0.04 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1bq0 n THR 14 Cb 0.24 1.28 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 1bq0 n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bq0 n ALA 15 N -0.07 0.00 -2.04 6.98 0.00 -1.26 -5.13 120.51 118.99 1bq0 n ALA 15 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1bq0 n ALA 15 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.64 1bq0 n ALA 15 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1bq0 n GLU 16 N 0.00 0.00 0.04 0.00 1.02 -1.26 -4.98 120.64 115.46 1bq0 n GLU 16 Ca 0.00 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.26 1bq0 n GLU 16 Cb 0.00 0.00 0.20 0.00 -0.02 0.00 0.00 31.44 31.62 1bq0 n GLU 16 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 1bq0 n GLU 17 N 0.00 0.20 0.13 3.49 0.28 -1.26 -3.24 120.64 120.25 1bq0 n GLU 17 Ca 0.00 0.05 -0.01 0.00 -0.16 0.00 0.00 57.16 57.04 1bq0 n GLU 17 Cb 0.00 -1.62 0.18 0.00 1.43 0.00 0.00 31.44 31.42 1bq0 n GLU 17 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 177.13 177.04 1bq0 h ARG 18 N 0.00 0.03 0.00 3.44 -0.00 -1.99 -2.72 114.38 113.14 1bq0 h ARG 18 Ca 0.00 -0.02 -0.37 0.00 -0.00 0.00 0.00 59.98 59.59 1bq0 h ARG 18 Cb 0.67 0.00 -0.07 0.00 -0.00 0.00 0.00 29.97 30.57 1bq0 h ARG 18 CO 0.00 0.62 -2.40 -1.91 -0.00 0.00 0.00 179.97 176.28 1bq0 n GLU 19 N -3.83 0.66 0.23 0.08 2.13 -1.25 -3.64 120.64 115.01 1bq0 n GLU 19 Ca -0.01 0.12 0.16 0.00 0.66 0.00 0.00 57.16 58.08 1bq0 n GLU 19 Cb 0.60 -1.50 0.81 0.00 0.27 0.00 0.00 31.44 31.63 1bq0 n GLU 19 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 1bq0 h ILE 20 N 0.00 0.00 0.14 6.31 5.03 -1.65 2.71 117.51 130.05 1bq0 h ILE 20 Ca -0.55 -0.04 -0.35 0.00 -0.12 0.00 0.00 64.86 63.80 1bq0 h ILE 20 Cb 1.91 0.73 -0.01 0.00 -3.03 0.00 0.00 36.82 36.43 1bq0 h ILE 20 CO -0.07 0.00 -1.85 0.08 -0.68 0.00 0.00 178.15 175.64 1bq0 h ARG 21 N 0.00 0.29 0.00 2.37 0.11 -1.62 -0.62 114.38 114.91 1bq0 h ARG 21 Ca 0.00 -0.50 -0.21 0.00 0.10 0.00 0.00 59.98 59.37 1bq0 h ARG 21 Cb 0.04 0.19 -0.03 0.00 1.11 0.00 0.00 29.97 31.28 1bq0 h ARG 21 CO 0.00 1.19 -1.21 -0.22 0.10 0.00 0.00 179.97 179.83 1bq0 h LYS 22 N 0.08 0.00 0.11 0.08 3.64 -1.35 -2.98 116.57 116.15 1bq0 h LYS 22 Ca -0.37 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.01 1bq0 h LYS 22 Cb 2.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.88 1bq0 h LYS 22 CO 0.13 0.63 -0.05 0.00 -2.27 0.00 0.00 179.45 177.88 1bq0 h ALA 23 N 1.16 -0.15 -0.88 5.00 0.00 0.46 1.56 119.26 126.41 1bq0 h ALA 23 Ca -0.12 -0.19 0.20 0.00 0.00 0.00 0.00 54.91 54.80 1bq0 h ALA 23 Cb 1.75 0.06 -0.12 0.00 0.00 0.00 0.00 17.79 19.48 1bq0 h ALA 23 CO 0.09 -0.17 0.41 -0.92 0.00 0.00 0.00 179.25 178.66 1bq0 h TYR 24 N -0.98 0.69 0.06 0.00 3.20 -1.21 1.28 116.97 120.01 1bq0 h TYR 24 Ca -0.02 0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.79 1bq0 h TYR 24 Cb 0.42 -0.17 0.01 0.00 1.54 0.00 0.00 36.73 38.54 1bq0 h TYR 24 CO 0.08 0.02 -0.46 -0.22 -1.64 0.00 0.00 178.16 175.93 1bq0 h LYS 25 N 0.46 0.20 -0.89 1.82 3.64 -1.56 -1.34 116.57 118.90 1bq0 h LYS 25 Ca 0.53 -0.30 0.01 0.00 -1.27 0.00 0.00 60.65 59.62 1bq0 h LYS 25 Cb 0.96 0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.84 1bq0 h LYS 25 CO -0.48 1.10 0.59 -0.09 -2.27 0.00 0.00 179.45 178.30 1bq0 h ARG 26 N -0.54 1.17 0.00 1.90 2.43 0.35 -1.10 114.38 118.59 1bq0 h ARG 26 Ca -0.08 -0.07 -0.15 0.00 -0.81 0.00 0.00 59.98 58.87 1bq0 h ARG 26 Cb 1.31 -0.26 -0.02 0.00 -0.42 0.00 0.00 29.97 30.57 1bq0 h ARG 26 CO 0.09 0.78 -0.73 1.25 -1.51 0.00 0.00 179.97 179.85 1bq0 h LEU 27 N 1.21 0.00 -0.88 3.80 7.12 0.15 -3.11 115.31 123.60 1bq0 h LEU 27 Ca 0.33 0.00 -0.10 0.00 0.13 0.00 0.00 57.88 58.24 1bq0 h LEU 27 Cb -0.14 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 39.98 1bq0 h LEU 27 CO -0.07 0.73 -0.46 0.00 -0.13 0.00 0.00 178.44 178.51 1bq0 h ALA 28 N 1.27 0.99 -0.83 1.25 0.00 -0.65 -2.96 119.26 118.33 1bq0 h ALA 28 Ca -0.01 -0.41 0.21 0.00 0.00 0.00 0.00 54.91 54.70 1bq0 h ALA 28 Cb 1.41 -0.07 -0.13 0.00 0.00 0.00 0.00 17.79 18.99 1bq0 h ALA 28 CO 0.09 0.57 0.18 1.98 0.00 0.00 0.00 179.25 182.08 1bq0 h MET 29 N 0.00 0.20 0.00 0.00 1.85 -1.15 4.22 114.93 120.05 1bq0 h MET 29 Ca -0.00 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 59.07 1bq0 h MET 29 Cb 0.96 -0.04 0.00 0.00 0.43 0.00 0.00 31.60 32.95 1bq0 h MET 29 CO 0.06 0.13 0.22 0.87 -0.40 0.00 0.00 176.91 177.79 1bq0 h LYS 30 N 0.20 0.00 0.00 0.39 1.57 -1.69 -2.33 116.57 114.72 1bq0 h LYS 30 Ca 0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 1bq0 h LYS 30 Cb 0.96 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.27 1bq0 h LYS 30 CO -0.63 0.00 -0.34 0.66 -0.57 0.00 0.00 179.45 178.57 1bq0 n TYR 31 N -2.49 0.00 -0.90 -1.35 4.01 1.04 -5.06 117.16 112.40 1bq0 n TYR 31 Ca -0.02 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.47 1bq0 n TYR 31 Cb 0.25 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.31 1bq0 n TYR 31 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1bq0 n HIS 32 N -0.77 -1.30 0.00 -0.72 8.25 1.16 -4.36 115.22 117.48 1bq0 n HIS 32 Ca 0.00 0.66 0.00 0.00 -0.26 0.00 0.00 57.72 58.12 1bq0 n HIS 32 Cb 0.00 -1.38 0.00 0.00 1.12 0.00 0.00 29.99 29.73 1bq0 n HIS 32 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1bq0 n PRO 33 N 2.19 1.98 0.00 -0.41 -0.04 -1.26 -2.95 135.00 134.51 1bq0 n PRO 33 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1bq0 n PRO 33 Cb 0.49 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.95 1bq0 n PRO 33 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1bq0 n ASP 34 N 0.00 0.00 -0.04 3.54 -0.08 -1.26 -2.87 116.55 115.84 1bq0 n ASP 34 Ca 0.00 0.00 -0.06 0.00 -1.51 0.00 0.00 54.79 53.22 1bq0 n ASP 34 Cb 0.00 0.00 -0.14 0.00 2.34 0.00 0.00 41.12 43.32 1bq0 n ASP 34 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1bq0 n ARG 35 N 0.00 0.65 0.06 -0.67 1.85 -1.25 -4.17 116.66 113.13 1bq0 n ARG 35 Ca 0.00 0.14 0.03 0.00 -1.00 0.00 0.00 57.85 57.02 1bq0 n ARG 35 Cb 0.00 -1.68 -0.05 0.00 -1.05 0.00 0.00 32.46 29.68 1bq0 n ARG 35 CO 0.00 0.00 0.00 -0.91 -0.01 0.00 0.00 177.63 176.71 1bq0 h ASN 36 N 0.00 0.00 -3.58 2.89 4.21 -1.41 -3.49 115.58 114.21 1bq0 h ASN 36 Ca -0.34 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.15 1bq0 h ASN 36 Cb 1.94 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 39.16 1bq0 h ASN 36 CO 0.05 0.41 -0.08 0.00 -1.29 0.00 0.00 177.43 176.53 1bq0 n GLN 37 N -2.85 -0.40 0.00 0.81 6.02 -1.26 -3.68 117.38 116.02 1bq0 n GLN 37 Ca -0.06 0.54 0.00 0.00 -0.01 0.00 0.00 57.00 57.47 1bq0 n GLN 37 Cb 0.75 -2.53 0.00 0.00 1.02 0.00 0.00 30.24 29.48 1bq0 n GLN 37 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1bq0 n GLY 38 N -1.28 0.90 0.00 1.08 0.00 -1.26 -4.39 105.19 100.24 1bq0 n GLY 38 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1bq0 n GLY 38 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1bq0 n ASP 39 N 2.15 0.00 0.00 1.61 -0.08 -1.24 -4.39 116.55 114.60 1bq0 n ASP 39 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1bq0 n ASP 39 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1bq0 n ASP 39 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1bq0 n LYS 40 N 0.00 0.00 0.00 -0.67 5.02 -1.26 -2.54 118.16 118.71 1bq0 n LYS 40 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 1bq0 n LYS 40 Cb 0.00 0.00 0.44 0.00 -0.02 0.00 0.00 35.03 35.45 1bq0 n LYS 40 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1bq0 n GLU 41 N 0.00 0.55 0.01 1.97 2.13 -1.26 -3.60 120.64 120.44 1bq0 n GLU 41 Ca 0.00 -0.27 -0.07 0.00 0.66 0.00 0.00 57.16 57.48 1bq0 n GLU 41 Cb 0.00 -1.49 -0.12 0.00 0.27 0.00 0.00 31.44 30.09 1bq0 n GLU 41 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1bq0 h ALA 42 N 3.46 0.67 -0.96 4.31 0.00 -1.78 -3.26 119.26 121.70 1bq0 h ALA 42 Ca 0.00 -1.24 0.26 0.00 0.00 0.00 0.00 54.91 53.93 1bq0 h ALA 42 Cb 0.46 0.31 -0.13 0.00 0.00 0.00 0.00 17.79 18.42 1bq0 h ALA 42 CO 0.00 1.41 0.50 1.49 0.00 0.00 0.00 179.25 182.65 1bq0 h GLU 43 N 0.00 0.42 0.00 0.00 4.81 -1.82 0.93 114.58 118.91 1bq0 h GLU 43 Ca -0.20 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.00 1bq0 h GLU 43 Cb 1.89 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 31.18 1bq0 h GLU 43 CO 0.09 0.28 -0.59 0.00 -0.73 0.00 0.00 179.01 178.05 1bq0 h ALA 44 N 1.76 0.62 0.00 2.92 0.00 -1.79 -3.30 119.26 119.47 1bq0 h ALA 44 Ca 0.64 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 55.38 1bq0 h ALA 44 Cb 1.29 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 1bq0 h ALA 44 CO -0.54 0.00 -1.04 -0.22 0.00 0.00 0.00 179.25 177.45 1bq0 h LYS 45 N 0.00 0.00 -0.35 0.00 3.64 0.55 -3.05 116.57 117.36 1bq0 h LYS 45 Ca 0.00 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 1bq0 h LYS 45 Cb 0.78 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.58 1bq0 h LYS 45 CO 0.00 0.54 -0.01 0.74 -2.27 0.00 0.00 179.45 178.45 1bq0 h PHE 46 N 0.00 0.57 0.00 1.91 -1.00 -0.14 0.65 116.94 118.93 1bq0 h PHE 46 Ca -0.09 -0.06 0.00 0.00 2.81 0.00 0.00 57.97 60.63 1bq0 h PHE 46 Cb 1.60 -0.16 0.00 0.00 3.61 0.00 0.00 35.95 41.00 1bq0 h PHE 46 CO 0.00 0.56 0.00 0.36 -1.61 0.00 0.00 178.31 177.62 1bq0 n LYS 47 N -4.27 0.06 -0.01 1.51 2.85 -1.20 0.29 118.16 117.40 1bq0 n LYS 47 Ca 0.02 0.12 -0.15 0.00 -1.05 0.00 0.00 58.31 57.24 1bq0 n LYS 47 Cb 0.26 -1.50 -0.14 0.00 -0.65 0.00 0.00 35.03 33.00 1bq0 n LYS 47 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1bq0 n GLU 48 N -1.46 0.70 -0.05 -1.58 -0.58 0.21 -3.76 120.64 114.12 1bq0 n GLU 48 Ca 0.06 0.27 -0.09 0.00 -0.42 0.00 0.00 57.16 56.98 1bq0 n GLU 48 Cb 0.23 -1.74 -0.04 0.00 -0.57 0.00 0.00 31.44 29.33 1bq0 n GLU 48 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1bq0 n ILE 49 N -3.27 0.54 0.22 -3.67 -0.00 0.14 -3.92 119.36 109.39 1bq0 n ILE 49 Ca -0.26 -0.17 0.09 0.00 -0.00 0.00 0.00 62.75 62.42 1bq0 n ILE 49 Cb 1.05 -1.28 0.45 0.00 -0.00 0.00 0.00 39.64 39.87 1bq0 n ILE 49 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.55 177.05 1bq0 h LYS 50 N -0.20 0.00 0.04 0.38 3.11 0.42 2.40 116.57 122.73 1bq0 h LYS 50 Ca -0.23 0.00 -0.31 0.00 -2.81 0.00 0.00 60.65 57.30 1bq0 h LYS 50 Cb 1.26 0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 32.46 1bq0 h LYS 50 CO -0.10 0.24 -1.74 1.49 -2.81 0.00 0.00 179.45 176.53 1bq0 h GLU 51 N 0.00 0.09 0.03 1.90 4.57 -0.76 -3.05 114.58 117.36 1bq0 h GLU 51 Ca -0.00 -0.16 -0.23 0.00 -1.18 0.00 0.00 59.36 57.79 1bq0 h GLU 51 Cb 0.75 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.37 1bq0 h GLU 51 CO 0.03 0.75 -1.24 0.00 -1.18 0.00 0.00 179.01 177.38 1bq0 h ALA 52 N 0.71 0.25 0.00 2.92 0.00 -1.63 -3.35 119.26 118.16 1bq0 h ALA 52 Ca -0.31 -1.15 0.00 0.00 0.00 0.00 0.00 54.91 53.45 1bq0 h ALA 52 Cb 2.01 0.64 0.00 0.00 0.00 0.00 0.00 17.79 20.44 1bq0 h ALA 52 CO 0.09 0.72 0.00 2.48 0.00 0.00 0.00 179.25 182.54 1bq0 n TYR 53 N -4.29 0.00 0.15 0.00 4.11 0.81 -3.05 117.16 114.88 1bq0 n TYR 53 Ca -0.29 0.00 0.07 0.00 -0.00 0.00 0.00 57.90 57.68 1bq0 n TYR 53 Cb 0.73 0.00 0.06 0.00 -0.00 0.00 0.00 39.34 40.12 1bq0 n TYR 53 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.86 178.35 1bq0 h GLU 54 N 0.00 0.00 -0.92 -3.48 4.81 -1.54 -3.27 114.58 110.18 1bq0 h GLU 54 Ca 0.00 0.00 -0.53 0.00 -0.13 0.00 0.00 59.36 58.70 1bq0 h GLU 54 Cb 0.00 0.00 -0.29 0.00 0.63 0.00 0.00 28.75 29.09 1bq0 h GLU 54 CO 0.00 0.21 0.60 1.33 -0.73 0.00 0.00 179.01 180.42 1bq0 n VAL 55 N -3.04 3.25 0.10 0.32 0.24 -1.17 -3.58 118.33 114.46 1bq0 n VAL 55 Ca 0.01 -2.39 0.01 0.00 -2.04 0.00 0.00 64.34 59.92 1bq0 n VAL 55 Cb 0.65 -0.69 -0.01 0.00 -1.47 0.00 0.00 33.84 32.32 1bq0 n VAL 55 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1bq0 n LEU 56 N -1.06 0.21 -0.11 1.34 7.99 -1.23 -3.62 117.00 120.51 1bq0 n LEU 56 Ca 0.58 -0.55 0.00 0.00 -0.01 0.00 0.00 56.01 56.03 1bq0 n LEU 56 Cb 1.28 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 44.59 1bq0 n LEU 56 CO 0.62 0.05 0.22 1.07 -1.51 0.00 0.00 177.39 177.83 1bq0 n THR 57 N -0.93 0.00 -1.07 -5.08 5.66 -1.26 -4.74 114.28 106.86 1bq0 n THR 57 Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 1bq0 n THR 57 Cb 0.04 0.73 0.00 0.00 -1.55 0.00 0.00 70.33 69.55 1bq0 n THR 57 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1bq0 n ASP 58 N 0.00 0.00 0.00 1.09 2.03 -1.23 -5.04 116.55 113.40 1bq0 n ASP 58 Ca 0.00 -0.22 0.00 0.00 0.52 0.00 0.00 54.79 55.09 1bq0 n ASP 58 Cb 0.54 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.94 1bq0 n ASP 58 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1bq0 n SER 59 N -0.65 0.00 0.07 1.67 3.41 -1.26 -4.24 113.62 112.63 1bq0 n SER 59 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.53 1bq0 n SER 59 Cb 0.00 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 63.99 1bq0 n SER 59 CO 0.00 0.00 0.00 0.06 -0.16 0.00 0.00 175.04 174.94 1bq0 h GLN 60 N 0.00 0.28 0.00 4.33 3.07 -1.97 -3.46 115.11 117.37 1bq0 h GLN 60 Ca 0.00 -0.25 0.00 0.00 0.09 0.00 0.00 58.65 58.49 1bq0 h GLN 60 Cb 0.00 0.06 0.00 0.00 0.08 0.00 0.00 27.48 27.62 1bq0 h GLN 60 CO 0.00 0.91 0.00 1.63 0.09 0.00 0.00 178.83 181.46 1bq0 n LYS 61 N -3.78 0.00 0.00 0.06 5.02 -1.26 -2.96 118.16 115.24 1bq0 n LYS 61 Ca -0.04 0.00 0.15 0.00 -2.02 0.00 0.00 58.31 56.40 1bq0 n LYS 61 Cb 0.72 0.00 0.77 0.00 -0.02 0.00 0.00 35.03 36.50 1bq0 n LYS 61 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1bq0 n ARG 62 N 0.00 1.04 -0.01 1.97 1.74 -1.24 -2.39 116.66 117.78 1bq0 n ARG 62 Ca 0.00 -0.27 0.05 0.00 -0.77 0.00 0.00 57.85 56.86 1bq0 n ARG 62 Cb 0.00 -1.49 -0.09 0.00 -1.02 0.00 0.00 32.46 29.86 1bq0 n ARG 62 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1bq0 n ALA 63 N -0.75 2.38 -0.10 7.54 0.00 -1.16 -3.91 120.51 124.53 1bq0 n ALA 63 Ca 0.20 -0.29 -0.17 0.00 0.00 0.00 0.00 53.44 53.18 1bq0 n ALA 63 Cb 0.21 -0.37 -0.09 0.00 0.00 0.00 0.00 19.45 19.21 1bq0 n ALA 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bq0 n ALA 64 N -1.92 0.69 0.15 0.00 0.00 -1.21 -4.17 120.51 114.05 1bq0 n ALA 64 Ca -0.03 -0.47 0.04 0.00 0.00 0.00 0.00 53.44 52.97 1bq0 n ALA 64 Cb 0.32 -0.39 0.04 0.00 0.00 0.00 0.00 19.45 19.43 1bq0 n ALA 64 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1bq0 h TYR 65 N -1.00 0.00 0.00 0.00 0.05 -1.74 -2.19 116.97 112.08 1bq0 h TYR 65 Ca -0.25 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.51 1bq0 h TYR 65 Cb 1.08 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.81 1bq0 h TYR 65 CO 0.00 0.44 -0.08 0.38 -1.05 0.00 0.00 178.16 177.85 1bq0 h ASP 66 N 0.00 0.00 0.00 3.88 2.03 -1.71 -2.96 116.42 117.66 1bq0 h ASP 66 Ca -0.01 0.00 -0.33 0.00 -0.73 0.00 0.00 57.03 55.96 1bq0 h ASP 66 Cb 1.34 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 39.78 1bq0 h ASP 66 CO 0.06 0.08 -2.25 0.00 -1.03 0.00 0.00 179.24 176.10 1bq0 n GLN 67 N -3.69 0.96 -2.79 4.15 10.64 -1.19 -5.00 117.38 120.47 1bq0 n GLN 67 Ca -0.02 0.02 -0.21 0.00 -1.83 0.00 0.00 57.00 54.96 1bq0 n GLN 67 Cb 0.19 -1.46 0.07 0.00 -0.86 0.00 0.00 30.24 28.18 1bq0 n GLN 67 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 1bq0 s TYR 68 N -2.44 1.95 0.00 2.61 2.02 -0.83 -5.04 117.35 115.62 1bq0 s TYR 68 Ca -0.14 -0.38 0.00 0.00 -0.37 0.00 0.00 57.07 56.19 1bq0 s TYR 68 Cb 0.06 -2.63 0.00 0.00 -0.40 0.00 0.00 41.96 38.99 1bq0 s TYR 68 CO 0.69 -1.20 0.00 0.41 -1.57 0.00 0.00 175.55 173.88 1bq0 n GLY 69 N -2.43 0.00 2.77 0.71 0.00 -1.26 -4.74 105.19 100.24 1bq0 n GLY 69 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 1bq0 n GLY 69 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1bq0 s HIS 70 N -1.40 -0.69 -0.94 1.61 2.46 -1.26 -4.90 115.29 110.17 1bq0 s HIS 70 Ca 0.00 -0.84 0.00 0.00 0.47 0.00 0.00 55.06 54.69 1bq0 s HIS 70 Cb 0.00 -0.15 0.00 0.00 -0.13 0.00 0.00 32.58 32.30 1bq0 s HIS 70 CO 0.00 -1.08 0.00 0.00 -2.47 0.00 0.00 174.74 171.19 1bq0 n ALA 71 N 3.61 -0.70 -0.32 1.58 0.00 -1.26 -4.80 120.51 118.62 1bq0 n ALA 71 Ca 0.17 0.10 -0.08 0.00 0.00 0.00 0.00 53.44 53.62 1bq0 n ALA 71 Cb 0.51 -1.32 -0.08 0.00 0.00 0.00 0.00 19.45 18.56 1bq0 n ALA 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bq0 n ALA 72 N -1.83 -0.49 -2.41 0.00 0.00 -1.26 -3.13 120.51 111.38 1bq0 n ALA 72 Ca -0.12 0.65 0.01 0.00 0.00 0.00 0.00 53.44 53.97 1bq0 n ALA 72 Cb 0.55 -0.04 0.06 0.00 0.00 0.00 0.00 19.45 20.02 1bq0 n ALA 72 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1bq0 n PHE 73 N -4.79 0.61 0.01 0.00 3.72 -1.26 -4.81 117.46 110.95 1bq0 n PHE 73 Ca 0.02 -1.28 -0.02 0.00 -0.05 0.00 0.00 57.45 56.12 1bq0 n PHE 73 Cb 0.20 -0.21 -0.10 0.00 -0.94 0.00 0.00 39.48 38.43 1bq0 n PHE 73 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1bq0 n GLU 74 N -0.18 0.63 -3.69 -1.08 2.13 -1.18 -5.00 120.64 112.27 1bq0 n GLU 74 Ca 0.12 0.21 -0.22 0.00 0.66 0.00 0.00 57.16 57.93 1bq0 n GLU 74 Cb 0.96 -1.78 0.00 0.00 0.27 0.00 0.00 31.44 30.89 1bq0 n GLU 74 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1bq0 n GLN 75 N -2.89 -1.42 0.00 5.31 -0.06 -1.26 -4.75 117.38 112.31 1bq0 n GLN 75 Ca -0.12 0.83 0.00 0.00 -2.00 0.00 0.00 57.00 55.71 1bq0 n GLN 75 Cb 0.89 -2.94 0.00 0.00 -4.06 0.00 0.00 30.24 24.13 1bq0 n GLN 75 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1bq0 n GLY 76 N -1.70 2.42 0.00 1.69 0.00 -1.26 -5.22 105.19 101.11 1bq0 n GLY 76 Ca -0.25 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.61 1bq0 n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93