#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bq0 n LYS 2 N 0.00 -2.11 -4.55 0.00 4.81 -1.26 -5.02 118.16 110.03 1bq0 n LYS 2 Ca 0.00 1.89 -0.33 0.00 -0.87 0.00 0.00 58.31 59.00 1bq0 n LYS 2 Cb 0.00 -4.00 -0.13 0.00 0.02 0.00 0.00 35.03 30.92 1bq0 n LYS 2 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 1bq0 s GLN 3 N -1.36 3.51 0.00 1.64 1.11 -1.26 -5.10 119.66 118.20 1bq0 s GLN 3 Ca 0.05 -0.58 0.00 0.00 0.01 0.00 0.00 55.36 54.84 1bq0 s GLN 3 Cb -0.01 -2.79 0.00 0.00 -1.01 0.00 0.00 33.01 29.20 1bq0 s GLN 3 CO 0.52 0.26 0.00 -3.47 0.01 0.00 0.00 175.29 172.61 1bq0 n ASP 4 N 3.44 -1.21 -0.23 5.90 2.03 -1.26 -4.93 116.55 120.29 1bq0 n ASP 4 Ca -0.18 0.00 0.09 0.00 0.52 0.00 0.00 54.79 55.22 1bq0 n ASP 4 Cb 0.53 0.00 0.16 0.00 -0.72 0.00 0.00 41.12 41.09 1bq0 n ASP 4 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1bq0 n TYR 5 N -2.52 0.03 -0.09 -0.67 4.02 -1.26 -4.57 117.16 112.11 1bq0 n TYR 5 Ca 0.00 -1.13 -0.17 0.00 -0.01 0.00 0.00 57.90 56.59 1bq0 n TYR 5 Cb 0.00 -0.18 -0.10 0.00 -0.02 0.00 0.00 39.34 39.04 1bq0 n TYR 5 CO 0.00 0.00 0.00 0.10 -1.01 0.00 0.00 176.86 175.95 1bq0 h TYR 6 N 0.30 0.00 0.00 -0.72 -0.00 -1.91 -3.34 116.97 111.29 1bq0 h TYR 6 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 58.73 58.68 1bq0 h TYR 6 Cb 1.02 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.74 1bq0 h TYR 6 CO 0.21 1.12 -0.23 0.93 -0.00 0.00 0.00 178.16 180.19 1bq0 h GLU 7 N -1.00 0.00 -1.21 0.10 4.39 -1.88 -2.43 114.58 112.56 1bq0 h GLU 7 Ca -0.20 0.00 0.35 0.00 0.34 0.00 0.00 59.36 59.84 1bq0 h GLU 7 Cb 1.07 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.67 1bq0 h GLU 7 CO -0.12 0.23 1.04 0.82 -1.16 0.00 0.00 179.01 179.81 1bq0 h ILE 8 N 0.00 0.18 -0.62 3.13 5.03 -1.81 2.29 117.51 125.72 1bq0 h ILE 8 Ca -0.00 0.00 -0.22 0.00 -0.12 0.00 0.00 64.86 64.52 1bq0 h ILE 8 Cb 0.49 0.23 -0.13 0.00 -3.03 0.00 0.00 36.82 34.38 1bq0 h ILE 8 CO 0.03 0.00 0.21 0.18 -0.68 0.00 0.00 178.15 177.89 1bq0 n LEU 9 N -3.76 5.41 -3.54 1.44 4.77 -0.91 -4.96 117.00 115.45 1bq0 n LEU 9 Ca 0.26 -3.37 -0.16 0.00 -0.03 0.00 0.00 56.01 52.71 1bq0 n LEU 9 Cb 1.42 -0.70 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 1bq0 n LEU 9 CO 0.34 0.92 -0.04 0.61 -1.33 0.00 0.00 177.39 177.89 1bq0 n GLY 10 N -0.58 -1.29 0.00 -0.72 0.00 0.77 -4.66 105.19 98.72 1bq0 n GLY 10 Ca 0.39 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.97 1bq0 n GLY 10 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1bq0 n VAL 11 N -2.35 0.00 -0.67 1.61 0.31 -1.25 -4.88 118.33 111.09 1bq0 n VAL 11 Ca -0.21 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1bq0 n VAL 11 Cb 0.63 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.56 1bq0 n VAL 11 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1bq0 n SER 12 N 0.00 0.00 0.00 4.52 7.64 -1.26 -4.84 113.62 119.68 1bq0 n SER 12 Ca 0.00 -0.36 0.00 0.00 1.01 0.00 0.00 58.87 59.52 1bq0 n SER 12 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1bq0 n SER 12 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1bq0 n LYS 13 N 0.00 0.00 0.08 1.43 2.85 -1.26 -4.53 118.16 116.74 1bq0 n LYS 13 Ca 0.00 0.00 0.12 0.00 -1.05 0.00 0.00 58.31 57.38 1bq0 n LYS 13 Cb 0.09 -0.28 0.12 0.00 -0.65 0.00 0.00 35.03 34.31 1bq0 n LYS 13 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1bq0 h THR 14 N 0.00 0.00 -0.32 0.58 1.35 -1.95 -3.46 112.91 109.11 1bq0 h THR 14 Ca 0.00 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 65.18 1bq0 h THR 14 Cb 0.00 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 67.68 1bq0 h THR 14 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1bq0 n ALA 15 N -1.96 0.00 -2.00 6.62 0.00 -1.26 -5.05 120.51 116.86 1bq0 n ALA 15 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1bq0 n ALA 15 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 -0.64 0.00 -0.03 0.00 -0.58 -1.26 -4.83 120.64 113.30 1bq0 n GLU 16 Ca 0.00 0.00 -0.22 0.00 -0.42 0.00 0.00 57.16 56.52 1bq0 n GLU 16 Cb 0.00 0.00 -0.13 0.00 -0.57 0.00 0.00 31.44 30.74 1bq0 n GLU 16 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1bq0 n GLU 17 N 0.00 0.71 -0.28 3.49 -0.58 -1.26 -3.67 120.64 119.04 1bq0 n GLU 17 Ca 0.00 0.33 0.14 0.00 -0.42 0.00 0.00 57.16 57.20 1bq0 n GLU 17 Cb 0.00 -1.70 0.27 0.00 -0.57 0.00 0.00 31.44 29.44 1bq0 n GLU 17 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 1bq0 n ARG 18 N -3.70 -0.06 -0.12 3.49 -4.01 -1.26 0.25 116.66 111.25 1bq0 n ARG 18 Ca -0.33 1.21 -0.24 0.00 -1.04 0.00 0.00 57.85 57.45 1bq0 n ARG 18 Cb 0.96 -1.96 -0.10 0.00 -3.04 0.00 0.00 32.46 28.33 1bq0 n ARG 18 CO 0.00 0.00 0.00 -1.91 -3.04 0.00 0.00 177.63 172.68 1bq0 n GLU 19 N -5.13 0.57 0.06 2.89 2.13 -1.26 -3.37 120.64 116.53 1bq0 n GLU 19 Ca 0.21 0.41 0.20 0.00 0.66 0.00 0.00 57.16 58.63 1bq0 n GLU 19 Cb 0.68 -1.61 0.62 0.00 0.27 0.00 0.00 31.44 31.40 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 -1.00 0.18 0.00 6.31 5.03 -1.48 3.30 117.51 129.85 1bq0 h ILE 20 Ca -0.47 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.27 1bq0 h ILE 20 Cb 1.38 0.43 0.00 0.00 -3.03 0.00 0.00 36.82 35.60 1bq0 h ILE 20 CO -0.28 0.00 -0.56 -2.11 -0.68 0.00 0.00 178.15 174.52 1bq0 n ARG 21 N -3.37 0.17 -0.02 2.37 1.85 0.69 -1.36 116.66 116.99 1bq0 n ARG 21 Ca 0.10 0.05 0.01 0.00 -1.00 0.00 0.00 57.85 57.00 1bq0 n ARG 21 Cb 0.86 -1.60 -0.08 0.00 -1.05 0.00 0.00 32.46 30.59 1bq0 n ARG 21 CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 177.63 178.79 1bq0 n LYS 22 N -1.84 1.29 -0.08 2.89 4.81 0.72 -4.39 118.16 121.56 1bq0 n LYS 22 Ca 0.04 -0.05 -0.19 0.00 -0.87 0.00 0.00 58.31 57.24 1bq0 n LYS 22 Cb 0.39 -1.24 -0.12 0.00 0.02 0.00 0.00 35.03 34.08 1bq0 n LYS 22 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1bq0 h ALA 23 N 0.71 0.17 -0.93 3.14 0.00 0.49 1.00 119.26 123.84 1bq0 h ALA 23 Ca -0.12 -0.98 0.28 0.00 0.00 0.00 0.00 54.91 54.09 1bq0 h ALA 23 Cb 0.97 0.48 -0.15 0.00 0.00 0.00 0.00 17.79 19.09 1bq0 h ALA 23 CO 0.01 0.50 0.32 -0.92 0.00 0.00 0.00 179.25 179.16 1bq0 h TYR 24 N -0.92 0.49 0.16 0.00 5.03 -1.33 1.90 116.97 122.30 1bq0 h TYR 24 Ca -0.24 0.05 -0.36 0.00 2.58 0.00 0.00 58.73 60.77 1bq0 h TYR 24 Cb 1.26 -0.06 -0.00 0.00 1.55 0.00 0.00 36.73 39.48 1bq0 h TYR 24 CO 0.16 -0.25 -1.84 -0.22 -1.32 0.00 0.00 178.16 174.69 1bq0 h LYS 25 N 0.20 0.34 0.00 1.82 3.64 -1.77 -2.17 116.57 118.63 1bq0 h LYS 25 Ca 0.63 -0.58 -0.03 0.00 -1.27 0.00 0.00 60.65 59.40 1bq0 h LYS 25 Cb 1.36 0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 33.39 1bq0 h LYS 25 CO -0.68 1.26 -0.14 -0.09 -2.27 0.00 0.00 179.45 177.53 1bq0 h ARG 26 N 0.09 0.00 0.00 1.90 9.65 0.12 -2.40 114.38 123.74 1bq0 h ARG 26 Ca -0.37 0.00 -0.18 0.00 -1.10 0.00 0.00 59.98 58.33 1bq0 h ARG 26 Cb 2.07 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 30.62 1bq0 h ARG 26 CO 0.14 0.14 -1.86 -0.11 2.80 0.00 0.00 179.97 181.08 1bq0 n LEU 27 N -3.41 0.37 0.16 3.80 -0.00 0.63 -4.12 117.00 114.41 1bq0 n LEU 27 Ca -0.01 0.16 0.03 0.00 -0.00 0.00 0.00 56.01 56.19 1bq0 n LEU 27 Cb 0.32 0.18 0.20 0.00 -0.00 0.00 0.00 43.42 44.12 1bq0 n LEU 27 CO 0.30 0.21 0.56 0.00 -0.00 0.00 0.00 177.39 178.46 1bq0 h ALA 28 N 1.46 0.85 -0.86 1.96 0.00 -1.17 -3.07 119.26 118.43 1bq0 h ALA 28 Ca -0.24 -0.45 0.22 0.00 0.00 0.00 0.00 54.91 54.44 1bq0 h ALA 28 Cb 1.62 -0.08 -0.13 0.00 0.00 0.00 0.00 17.79 19.20 1bq0 h ALA 28 CO 0.03 0.62 0.25 1.98 0.00 0.00 0.00 179.25 182.12 1bq0 h MET 29 N 0.00 0.24 0.00 0.00 1.85 -1.59 4.01 114.93 119.44 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 1.13 -0.05 0.00 0.00 0.43 0.00 0.00 31.60 33.10 1bq0 h MET 29 CO 0.06 0.16 0.11 0.87 -0.40 0.00 0.00 176.91 177.71 1bq0 h LYS 30 N 0.25 0.00 0.00 0.39 6.56 -1.77 -2.76 116.57 119.24 1bq0 h LYS 30 Ca 0.53 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.12 1bq0 h LYS 30 Cb 1.03 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.69 1bq0 h LYS 30 CO -0.61 0.00 -0.46 0.66 -2.06 0.00 0.00 179.45 176.98 1bq0 n TYR 31 N -2.30 0.00 -0.64 -1.35 4.01 1.04 -5.05 117.16 112.87 1bq0 n TYR 31 Ca -0.01 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.52 1bq0 n TYR 31 Cb 0.14 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.18 1bq0 n TYR 31 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 1bq0 n HIS 32 N -0.78 -1.71 0.00 -0.72 -0.00 1.09 -4.48 115.22 108.62 1bq0 n HIS 32 Ca 0.00 0.20 0.00 0.00 0.46 0.00 0.00 57.72 58.38 1bq0 n HIS 32 Cb 0.00 -0.87 0.00 0.00 -0.12 0.00 0.00 29.99 29.00 1bq0 n HIS 32 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1bq0 n PRO 33 N 0.87 1.84 0.00 1.57 -0.04 -1.26 -3.09 135.00 134.90 1bq0 n PRO 33 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 1bq0 n PRO 33 Cb 0.25 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.71 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 -2.63 116.55 116.15 1bq0 n ASP 34 Ca 0.00 0.00 -0.03 0.00 -1.51 0.00 0.00 54.79 53.25 1bq0 n ASP 34 Cb 0.00 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.37 1bq0 n ASP 34 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 1bq0 h ARG 35 N 0.00 0.00 0.00 -0.67 0.11 -1.92 -3.31 114.38 108.59 1bq0 h ARG 35 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1bq0 h ARG 35 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1bq0 h ARG 35 CO 0.00 0.50 -1.10 0.09 0.10 0.00 0.00 179.97 179.56 1bq0 n ASN 36 N -3.07 0.65 -2.75 0.08 4.13 -1.08 -5.00 115.26 108.22 1bq0 n ASN 36 Ca -0.08 -0.45 -0.03 0.00 1.68 0.00 0.00 54.58 55.69 1bq0 n ASN 36 Cb 0.90 0.97 0.00 0.00 -1.54 0.00 0.00 39.78 40.12 1bq0 n ASN 36 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1bq0 n GLN 37 N -1.80 -1.50 0.00 3.52 1.13 -1.25 -2.97 117.38 114.51 1bq0 n GLN 37 Ca 0.02 1.57 0.00 0.00 -1.94 0.00 0.00 57.00 56.66 1bq0 n GLN 37 Cb 0.41 -5.09 0.00 0.00 0.11 0.00 0.00 30.24 25.66 1bq0 n GLN 37 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1bq0 n GLY 38 N -1.09 0.71 0.00 1.08 0.00 -1.26 -4.09 105.19 100.54 1bq0 n GLY 38 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1bq0 n GLY 38 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bq0 n ASP 39 N 1.76 0.00 0.00 1.61 8.00 -1.16 -4.29 116.55 122.48 1bq0 n ASP 39 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1bq0 n ASP 39 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1bq0 n ASP 39 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1bq0 n LYS 40 N -0.17 0.00 0.02 -1.24 4.76 -1.22 -1.03 118.16 119.28 1bq0 n LYS 40 Ca 0.00 0.00 0.11 0.00 -2.87 0.00 0.00 58.31 55.55 1bq0 n LYS 40 Cb 0.00 0.00 -0.01 0.00 -1.84 0.00 0.00 35.03 33.18 1bq0 n LYS 40 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1bq0 n GLU 41 N 0.00 0.28 0.00 1.97 1.02 -1.26 -3.64 120.64 119.01 1bq0 n GLU 41 Ca 0.00 -0.02 0.13 0.00 -0.02 0.00 0.00 57.16 57.24 1bq0 n GLU 41 Cb 0.00 -1.57 0.34 0.00 -0.02 0.00 0.00 31.44 30.19 1bq0 n GLU 41 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bq0 n ALA 42 N -1.82 3.26 -0.24 0.62 0.00 -0.20 -3.70 120.51 118.44 1bq0 n ALA 42 Ca 0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 53.44 53.12 1bq0 n ALA 42 Cb 0.43 -1.19 0.09 0.00 0.00 0.00 0.00 19.45 18.78 1bq0 n ALA 42 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1bq0 h GLU 43 N 0.16 0.73 0.00 0.00 4.57 -1.74 3.26 114.58 121.56 1bq0 h GLU 43 Ca 0.00 -0.04 -0.06 0.00 -1.18 0.00 0.00 59.36 58.08 1bq0 h GLU 43 Cb 0.49 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.91 1bq0 h GLU 43 CO 0.00 0.48 -0.99 0.00 -1.18 0.00 0.00 179.01 177.33 1bq0 h ALA 44 N 1.33 0.61 0.12 2.92 0.00 -1.82 -3.29 119.26 119.13 1bq0 h ALA 44 Ca 0.29 -0.29 -0.34 0.00 0.00 0.00 0.00 54.91 54.57 1bq0 h ALA 44 Cb 0.12 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1bq0 h ALA 44 CO -0.15 0.32 -1.85 -0.22 0.00 0.00 0.00 179.25 177.35 1bq0 h LYS 45 N 0.00 0.26 -0.85 0.00 1.63 -1.49 -2.55 116.57 113.57 1bq0 h LYS 45 Ca -0.05 -0.44 0.20 0.00 -0.85 0.00 0.00 60.65 59.51 1bq0 h LYS 45 Cb 1.20 0.16 -0.06 0.00 -0.60 0.00 0.00 32.23 32.94 1bq0 h LYS 45 CO 0.02 1.21 0.58 0.35 -3.45 0.00 0.00 179.45 178.16 1bq0 h PHE 46 N -0.05 0.42 -0.02 1.91 3.57 0.59 2.79 116.94 126.15 1bq0 h PHE 46 Ca -0.40 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.09 1bq0 h PHE 46 Cb 1.95 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 40.57 1bq0 h PHE 46 CO 0.09 0.12 -0.08 1.57 -2.23 0.00 0.00 178.31 177.78 1bq0 h LYS 47 N 0.33 0.08 -0.05 1.11 2.10 -1.65 2.39 116.57 120.87 1bq0 h LYS 47 Ca 0.43 -0.07 0.02 0.00 -2.00 0.00 0.00 60.65 59.03 1bq0 h LYS 47 Cb 1.18 0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1bq0 h LYS 47 CO -0.13 0.72 0.32 0.93 -2.00 0.00 0.00 179.45 179.29 1bq0 h GLU 48 N -0.53 0.00 0.00 0.07 4.39 0.14 3.40 114.58 122.05 1bq0 h GLU 48 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1bq0 h GLU 48 Cb 0.73 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 1bq0 h GLU 48 CO 0.02 0.00 0.00 -0.89 -1.16 0.00 0.00 179.01 176.98 1bq0 n ILE 49 N -3.02 0.00 0.40 3.13 2.08 0.85 -3.51 119.36 119.29 1bq0 n ILE 49 Ca -0.01 0.46 0.12 0.00 0.56 0.00 0.00 62.75 63.89 1bq0 n ILE 49 Cb 0.39 -1.43 0.27 0.00 -0.75 0.00 0.00 39.64 38.12 1bq0 n ILE 49 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 1bq0 h LYS 50 N 0.00 0.00 0.01 0.38 3.64 0.42 0.20 116.57 121.22 1bq0 h LYS 50 Ca 0.00 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.09 1bq0 h LYS 50 Cb 0.00 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.77 1bq0 h LYS 50 CO 0.00 0.00 -1.65 1.49 -2.27 0.00 0.00 179.45 177.02 1bq0 h GLU 51 N 0.00 0.02 0.00 1.90 4.57 0.60 -3.04 114.58 118.63 1bq0 h GLU 51 Ca 0.00 -0.04 -0.10 0.00 -1.18 0.00 0.00 59.36 58.04 1bq0 h GLU 51 Cb 0.88 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.47 1bq0 h GLU 51 CO 0.00 0.60 -0.76 0.00 -1.18 0.00 0.00 179.01 177.67 1bq0 h ALA 52 N 0.93 0.12 0.00 2.92 0.00 0.22 -3.36 119.26 120.09 1bq0 h ALA 52 Ca -0.26 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 53.87 1bq0 h ALA 52 Cb 1.99 0.53 0.00 0.00 0.00 0.00 0.00 17.79 20.31 1bq0 h ALA 52 CO 0.09 0.52 0.00 2.48 0.00 0.00 0.00 179.25 182.33 1bq0 n TYR 53 N -4.55 0.00 0.12 0.00 4.11 0.71 -3.07 117.16 114.49 1bq0 n TYR 53 Ca -0.18 0.00 -0.01 0.00 -0.00 0.00 0.00 57.90 57.72 1bq0 n TYR 53 Cb 0.44 0.00 0.08 0.00 -0.00 0.00 0.00 39.34 39.86 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 -0.50 -3.48 4.81 -1.64 -3.17 114.58 110.60 1bq0 h GLU 54 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1bq0 h GLU 54 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1bq0 h GLU 54 CO 0.00 0.66 0.00 1.33 -0.73 0.00 0.00 179.01 180.27 1bq0 n VAL 55 N -3.46 1.12 1.83 0.32 0.24 -1.17 -4.35 118.33 112.86 1bq0 n VAL 55 Ca 0.00 -1.06 0.12 0.00 -2.04 0.00 0.00 64.34 61.37 1bq0 n VAL 55 Cb 0.73 0.44 0.66 0.00 -1.47 0.00 0.00 33.84 34.19 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 0.90 0.41 -0.13 1.34 7.99 -1.20 -3.16 117.00 123.16 1bq0 n LEU 56 Ca 0.18 -0.16 0.06 0.00 -0.01 0.00 0.00 56.01 56.08 1bq0 n LEU 56 Cb 0.55 -0.01 0.09 0.00 -0.11 0.00 0.00 43.42 43.93 1bq0 n LEU 56 CO 0.12 0.08 0.49 1.07 -1.51 0.00 0.00 177.39 177.65 1bq0 n THR 57 N -0.59 1.36 -3.78 -5.08 5.66 -1.26 -4.27 114.28 106.32 1bq0 n THR 57 Ca 0.18 -1.60 -0.13 0.00 -3.05 0.00 0.00 64.05 59.45 1bq0 n THR 57 Cb 0.15 0.05 -0.14 0.00 -1.55 0.00 0.00 70.33 68.84 1bq0 n THR 57 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1bq0 s ASP 58 N -2.15 -0.08 -0.02 1.09 2.15 -1.19 -5.02 116.67 111.45 1bq0 s ASP 58 Ca 0.20 0.22 -0.23 0.00 0.43 0.00 0.00 52.55 53.17 1bq0 s ASP 58 Cb 0.18 0.15 -0.22 0.00 -0.30 0.00 0.00 42.92 42.72 1bq0 s ASP 58 CO 0.02 -0.10 1.10 0.77 -0.17 0.00 0.00 175.17 176.78 1bq0 h SER 59 N 6.80 0.32 -0.82 -0.34 4.64 -1.95 -2.59 113.55 119.61 1bq0 h SER 59 Ca -0.37 -0.72 0.13 0.00 -0.47 0.00 0.00 61.79 60.36 1bq0 h SER 59 Cb 1.16 -0.10 -0.06 0.00 -0.31 0.00 0.00 62.40 63.09 1bq0 h SER 59 CO 0.44 1.00 0.54 0.06 -0.87 0.00 0.00 176.83 178.00 1bq0 h GLN 60 N -0.33 0.59 0.24 4.77 3.07 -1.97 -1.79 115.11 119.69 1bq0 h GLN 60 Ca -0.03 -0.04 -0.01 0.00 0.09 0.00 0.00 58.65 58.66 1bq0 h GLN 60 Cb 1.03 -0.13 0.00 0.00 0.08 0.00 0.00 27.48 28.46 1bq0 h GLN 60 CO 0.06 0.39 -0.11 0.87 0.09 0.00 0.00 178.83 180.13 1bq0 h LYS 61 N 0.61 -0.31 -0.98 0.06 1.57 -1.86 0.77 116.57 116.43 1bq0 h LYS 61 Ca 0.40 0.02 0.28 0.00 -1.87 0.00 0.00 60.65 59.49 1bq0 h LYS 61 Cb 0.69 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 33.03 1bq0 h LYS 61 CO -0.16 0.05 0.92 0.00 -0.57 0.00 0.00 179.45 179.68 1bq0 h ARG 62 N -0.74 0.00 0.01 3.15 3.08 -0.93 3.10 114.38 122.05 1bq0 h ARG 62 Ca -0.03 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.70 1bq0 h ARG 62 Cb 0.50 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.49 1bq0 h ARG 62 CO 0.05 0.00 -1.87 0.00 -1.07 0.00 0.00 179.97 177.08 1bq0 n ALA 63 N -2.47 1.46 -0.06 0.04 0.00 -0.86 -2.49 120.51 116.13 1bq0 n ALA 63 Ca 0.21 -0.87 -0.04 0.00 0.00 0.00 0.00 53.44 52.74 1bq0 n ALA 63 Cb 1.24 -0.70 -0.04 0.00 0.00 0.00 0.00 19.45 19.95 1bq0 n ALA 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bq0 h ALA 64 N 0.93 0.01 0.00 0.00 0.00 1.03 -3.30 119.26 117.92 1bq0 h ALA 64 Ca -0.35 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.35 1bq0 h ALA 64 Cb 2.06 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.90 1bq0 h ALA 64 CO 0.07 0.05 -0.12 -0.92 0.00 0.00 0.00 179.25 178.32 1bq0 h TYR 65 N -1.00 0.00 -0.95 0.00 3.20 0.43 -2.18 116.97 116.47 1bq0 h TYR 65 Ca -0.01 0.00 0.26 0.00 3.14 0.00 0.00 58.73 62.12 1bq0 h TYR 65 Cb 0.32 0.00 -0.17 0.00 1.54 0.00 0.00 36.73 38.42 1bq0 h TYR 65 CO 0.06 0.12 0.07 0.38 -1.64 0.00 0.00 178.16 177.15 1bq0 h ASP 66 N 0.00 -0.38 0.00 -2.11 3.04 -1.39 -3.40 116.42 112.18 1bq0 h ASP 66 Ca -0.00 0.26 0.00 0.00 -3.24 0.00 0.00 57.03 54.05 1bq0 h ASP 66 Cb 0.26 0.44 0.00 0.00 -1.04 0.00 0.00 39.33 38.99 1bq0 h ASP 66 CO 0.02 -0.31 0.00 0.00 -2.04 0.00 0.00 179.24 176.90 1bq0 n GLN 67 N -5.43 0.00 0.00 4.15 1.13 -1.02 -5.07 117.38 111.14 1bq0 n GLN 67 Ca 0.22 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.28 1bq0 n GLN 67 Cb 0.73 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.08 1bq0 n GLN 67 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1bq0 n TYR 68 N 0.00 0.00 -2.00 1.08 4.01 -0.85 -4.97 117.16 114.43 1bq0 n TYR 68 Ca 0.00 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.56 1bq0 n TYR 68 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 38.99 1bq0 n TYR 68 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1bq0 n GLY 69 N 2.74 0.53 0.00 2.72 0.00 -1.26 -4.86 105.19 105.06 1bq0 n GLY 69 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1bq0 n GLY 69 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1bq0 n HIS 70 N -3.04 0.00 1.76 1.61 -0.00 -1.26 -4.92 115.22 109.37 1bq0 n HIS 70 Ca -0.20 0.00 0.01 0.00 -0.00 0.00 0.00 57.72 57.53 1bq0 n HIS 70 Cb 0.63 0.00 0.03 0.00 -0.00 0.00 0.00 29.99 30.65 1bq0 n HIS 70 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1bq0 n ALA 71 N -3.00 2.49 -1.00 1.57 0.00 -1.26 -4.23 120.51 115.08 1bq0 n ALA 71 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1bq0 n ALA 71 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 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 -0.30 0.00 0.22 0.00 0.00 -1.26 -4.28 120.51 114.90 1bq0 n ALA 72 Ca 0.02 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.49 1bq0 n ALA 72 Cb 0.06 0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.54 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 -0.11 0.00 -2.97 0.00 3.72 -1.26 -5.06 117.46 111.78 1bq0 n PHE 73 Ca 0.00 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.30 1bq0 n PHE 73 Cb 0.00 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.55 1bq0 n PHE 73 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1bq0 n GLU 74 N -0.22 -2.39 -3.57 -1.08 1.02 -1.26 -4.92 120.64 108.21 1bq0 n GLU 74 Ca 0.02 2.04 -0.40 0.00 -0.02 0.00 0.00 57.16 58.81 1bq0 n GLU 74 Cb 0.11 -4.39 -0.06 0.00 -0.02 0.00 0.00 31.44 27.07 1bq0 n GLU 74 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1bq0 s GLN 75 N -2.10 3.06 0.00 3.49 0.74 -1.26 -4.45 119.66 119.14 1bq0 s GLN 75 Ca 0.17 -2.66 0.00 0.00 0.05 0.00 0.00 55.36 52.92 1bq0 s GLN 75 Cb -0.04 -4.01 0.00 0.00 1.10 0.00 0.00 33.01 30.06 1bq0 s GLN 75 CO 0.70 -1.23 0.00 0.41 -0.55 0.00 0.00 175.29 174.62 1bq0 n GLY 76 N 3.41 1.03 0.00 2.59 0.00 -1.26 -5.22 105.19 105.74 1bq0 n GLY 76 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1bq0 n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93