#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 -1.05 -3.83 0.00 3.00 -1.26 -4.94 118.16 110.08 1bq0 n LYS 2 Ca 0.00 0.56 -0.25 0.00 -0.00 0.00 0.00 58.31 58.62 1bq0 n LYS 2 Cb 0.00 -3.15 -0.03 0.00 0.00 0.00 0.00 35.03 31.85 1bq0 n LYS 2 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 1bq0 s GLN 3 N -5.74 3.47 0.00 1.64 0.00 -1.26 -5.09 119.66 112.69 1bq0 s GLN 3 Ca 0.26 -0.55 0.00 0.00 -0.00 0.00 0.00 55.36 55.08 1bq0 s GLN 3 Cb -0.12 -2.88 0.00 0.00 0.00 0.00 0.00 33.01 30.01 1bq0 s GLN 3 CO 0.90 0.43 0.00 -3.47 0.00 0.00 0.00 175.29 173.14 1bq0 n ASP 4 N -0.94 0.00 0.00 12.60 -0.08 -1.26 -5.05 116.55 121.82 1bq0 n ASP 4 Ca -0.07 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.21 1bq0 n ASP 4 Cb 0.55 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.01 1bq0 n ASP 4 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1bq0 n TYR 5 N 0.00 0.00 -0.03 -0.67 4.11 -1.26 -4.87 117.16 114.44 1bq0 n TYR 5 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 57.90 57.73 1bq0 n TYR 5 Cb 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 39.34 39.21 1bq0 n TYR 5 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 176.86 176.96 1bq0 h TYR 6 N 0.00 0.21 0.00 -3.48 -0.00 -1.95 -3.25 116.97 108.49 1bq0 h TYR 6 Ca 0.00 -0.15 -0.07 0.00 0.00 0.00 0.00 58.73 58.51 1bq0 h TYR 6 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 36.73 36.71 1bq0 h TYR 6 CO 0.00 1.17 -0.33 0.93 -0.00 0.00 0.00 178.16 179.93 1bq0 h GLU 7 N -0.75 0.00 -1.51 0.10 5.08 -1.93 -2.95 114.58 112.61 1bq0 h GLU 7 Ca -0.09 0.00 0.45 0.00 -1.00 0.00 0.00 59.36 58.72 1bq0 h GLU 7 Cb 1.28 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.45 1bq0 h GLU 7 CO 0.04 0.33 1.06 0.82 -1.00 0.00 0.00 179.01 180.26 1bq0 h ILE 8 N 0.00 0.19 -0.82 3.13 2.04 -1.89 1.39 117.51 121.56 1bq0 h ILE 8 Ca -0.00 -0.02 -0.44 0.00 1.00 0.00 0.00 64.86 65.40 1bq0 h ILE 8 Cb 0.81 0.14 -0.26 0.00 -0.74 0.00 0.00 36.82 36.77 1bq0 h ILE 8 CO 0.04 0.01 0.44 0.18 0.00 0.00 0.00 178.15 178.82 1bq0 n LEU 9 N -4.24 6.08 -3.63 1.44 4.77 -1.11 -4.94 117.00 115.36 1bq0 n LEU 9 Ca 0.36 -3.75 -0.20 0.00 -0.03 0.00 0.00 56.01 52.38 1bq0 n LEU 9 Cb 1.56 -0.79 0.00 0.00 -2.33 0.00 0.00 43.42 41.87 1bq0 n LEU 9 CO 0.36 1.18 -0.09 0.61 -1.33 0.00 0.00 177.39 178.12 1bq0 n GLY 10 N -1.11 -1.25 0.00 -0.72 0.00 0.48 -4.66 105.19 97.92 1bq0 n GLY 10 Ca 0.53 0.55 0.00 0.00 0.00 0.00 0.00 46.02 47.10 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 -2.65 0.00 -0.28 1.61 0.31 -1.25 -4.89 118.33 111.18 1bq0 n VAL 11 Ca -0.22 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 1bq0 n VAL 11 Cb 0.64 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.57 1bq0 n VAL 11 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1bq0 n SER 12 N 0.00 0.41 0.00 4.52 2.88 -1.26 -4.75 113.62 115.42 1bq0 n SER 12 Ca 0.00 -0.78 0.00 0.00 -1.33 0.00 0.00 58.87 56.76 1bq0 n SER 12 Cb 0.00 0.18 0.00 0.00 -0.75 0.00 0.00 64.21 63.64 1bq0 n SER 12 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1bq0 n LYS 13 N -0.18 0.00 -0.05 -1.46 2.85 -1.26 -4.40 118.16 113.66 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 0.07 -0.10 0.44 0.00 -0.65 0.00 0.00 35.03 34.79 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 0.00 0.13 0.00 0.58 -2.24 -1.26 -4.86 114.28 106.63 1bq0 n THR 14 Ca 0.00 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1bq0 n THR 14 Cb 0.00 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 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 0.22 0.00 -2.83 6.98 0.00 -1.26 -5.07 120.51 118.54 1bq0 n ALA 15 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1bq0 n ALA 15 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.78 1bq0 n ALA 15 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1bq0 n GLU 16 N 0.00 0.00 -0.06 0.00 2.13 -1.26 -4.93 120.64 116.51 1bq0 n GLU 16 Ca 0.00 0.00 0.10 0.00 0.66 0.00 0.00 57.16 57.92 1bq0 n GLU 16 Cb 0.00 0.00 0.40 0.00 0.27 0.00 0.00 31.44 32.11 1bq0 n GLU 16 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1bq0 n GLU 17 N 0.00 1.57 0.01 5.31 1.02 -1.26 -3.28 120.64 124.01 1bq0 n GLU 17 Ca 0.00 -0.85 0.12 0.00 -0.02 0.00 0.00 57.16 56.41 1bq0 n GLU 17 Cb 0.00 -1.36 0.25 0.00 -0.02 0.00 0.00 31.44 30.31 1bq0 n GLU 17 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1bq0 n ARG 18 N 0.08 0.07 0.00 3.49 -4.01 -1.26 -3.56 116.66 111.46 1bq0 n ARG 18 Ca 0.15 0.02 0.00 0.00 -1.04 0.00 0.00 57.85 56.98 1bq0 n ARG 18 Cb 0.27 -1.54 0.00 0.00 -3.04 0.00 0.00 32.46 28.15 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 -1.63 1.66 0.22 2.89 2.13 -1.24 -4.22 120.64 120.45 1bq0 n GLU 19 Ca 0.05 0.00 0.15 0.00 0.66 0.00 0.00 57.16 58.02 1bq0 n GLU 19 Cb 0.36 -0.99 0.70 0.00 0.27 0.00 0.00 31.44 31.78 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 0.06 6.31 5.03 -1.74 3.02 117.51 130.19 1bq0 h ILE 20 Ca 0.00 -0.22 -0.31 0.00 -0.12 0.00 0.00 64.86 64.21 1bq0 h ILE 20 Cb 0.98 1.02 -0.03 0.00 -3.03 0.00 0.00 36.82 35.76 1bq0 h ILE 20 CO 0.00 0.00 -1.69 -0.09 -0.68 0.00 0.00 178.15 175.69 1bq0 h ARG 21 N 0.00 0.12 0.00 2.37 1.12 -1.79 -1.21 114.38 114.98 1bq0 h ARG 21 Ca 0.00 -0.20 -0.26 0.00 -1.11 0.00 0.00 59.98 58.41 1bq0 h ARG 21 Cb 0.26 0.07 -0.04 0.00 -0.01 0.00 0.00 29.97 30.26 1bq0 h ARG 21 CO 0.00 0.83 -1.54 -0.22 -3.11 0.00 0.00 179.97 175.94 1bq0 h LYS 22 N 0.03 0.00 0.15 0.20 3.11 -1.53 -3.18 116.57 115.36 1bq0 h LYS 22 Ca -0.29 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.54 1bq0 h LYS 22 Cb 2.00 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 33.23 1bq0 h LYS 22 CO 0.10 0.52 -0.07 0.00 -2.81 0.00 0.00 179.45 177.19 1bq0 h ALA 23 N 1.09 -0.22 -1.20 5.00 0.00 0.53 2.11 119.26 126.57 1bq0 h ALA 23 Ca -0.22 -0.04 0.34 0.00 0.00 0.00 0.00 54.91 54.99 1bq0 h ALA 23 Cb 1.89 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 19.68 1bq0 h ALA 23 CO 0.08 -0.20 0.82 -0.92 0.00 0.00 0.00 179.25 179.02 1bq0 h TYR 24 N -0.98 0.35 0.05 0.00 3.20 -1.33 2.29 116.97 120.56 1bq0 h TYR 24 Ca -0.02 0.01 -0.24 0.00 3.14 0.00 0.00 58.73 61.62 1bq0 h TYR 24 Cb 0.16 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 1bq0 h TYR 24 CO 0.00 -0.01 -1.28 -0.22 -1.64 0.00 0.00 178.16 175.01 1bq0 h LYS 25 N 0.17 0.11 -0.00 1.82 3.11 -1.56 -2.79 116.57 117.43 1bq0 h LYS 25 Ca 0.65 -0.19 -0.14 0.00 -2.81 0.00 0.00 60.65 58.16 1bq0 h LYS 25 Cb 2.12 0.07 -0.02 0.00 -1.00 0.00 0.00 32.23 33.40 1bq0 h LYS 25 CO -0.20 1.09 -0.66 -0.09 -2.81 0.00 0.00 179.45 176.79 1bq0 h ARG 26 N -0.64 0.01 0.00 1.90 9.65 0.52 -3.08 114.38 122.73 1bq0 h ARG 26 Ca -0.31 -0.01 -0.13 0.00 -1.10 0.00 0.00 59.98 58.43 1bq0 h ARG 26 Cb 1.51 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 30.07 1bq0 h ARG 26 CO -0.07 0.66 -1.01 1.25 2.80 0.00 0.00 179.97 183.61 1bq0 h LEU 27 N 0.00 0.00 -1.01 3.80 7.12 0.36 -3.28 115.31 122.31 1bq0 h LEU 27 Ca -0.01 0.00 -0.05 0.00 0.13 0.00 0.00 57.88 57.96 1bq0 h LEU 27 Cb 1.16 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.28 1bq0 h LEU 27 CO 0.09 0.51 -0.22 0.00 -0.13 0.00 0.00 178.44 178.68 1bq0 h ALA 28 N 1.49 0.99 -0.78 1.25 0.00 -1.46 -3.04 119.26 117.71 1bq0 h ALA 28 Ca -0.09 -0.20 0.18 0.00 0.00 0.00 0.00 54.91 54.80 1bq0 h ALA 28 Cb 1.46 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 19.08 1bq0 h ALA 28 CO 0.05 0.28 -0.01 1.98 0.00 0.00 0.00 179.25 181.55 1bq0 h MET 29 N 0.00 0.08 -0.02 0.00 1.85 -1.59 3.41 114.93 118.66 1bq0 h MET 29 Ca -0.00 -0.00 0.01 0.00 -0.61 0.00 0.00 59.70 59.09 1bq0 h MET 29 Cb 0.79 -0.02 -0.00 0.00 0.43 0.00 0.00 31.60 32.80 1bq0 h MET 29 CO 0.03 0.05 0.51 0.87 -0.40 0.00 0.00 176.91 177.98 1bq0 h LYS 30 N 0.08 0.00 0.00 0.39 6.56 -1.75 -1.87 116.57 119.98 1bq0 h LYS 30 Ca 0.43 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.02 1bq0 h LYS 30 Cb 0.76 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.42 1bq0 h LYS 30 CO -0.71 0.00 -0.87 0.66 -2.06 0.00 0.00 179.45 176.48 1bq0 n TYR 31 N -2.81 0.00 -0.93 -1.35 4.01 0.94 -5.03 117.16 111.99 1bq0 n TYR 31 Ca -0.01 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.38 1bq0 n TYR 31 Cb 0.55 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.62 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 -1.57 -3.29 0.00 -0.72 8.25 0.87 -4.44 115.22 114.33 1bq0 n HIS 32 Ca 0.00 0.25 0.00 0.00 -0.26 0.00 0.00 57.72 57.71 1bq0 n HIS 32 Cb 0.23 -1.31 0.00 0.00 1.12 0.00 0.00 29.99 30.03 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 2.33 1.47 0.00 -0.41 -0.04 -1.26 -2.94 135.00 134.15 1bq0 n PRO 33 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 1bq0 n PRO 33 Cb 0.60 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.06 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 0.15 3.54 2.03 -1.26 -2.60 116.55 118.41 1bq0 n ASP 34 Ca 0.00 0.00 0.03 0.00 0.52 0.00 0.00 54.79 55.34 1bq0 n ASP 34 Cb 0.00 0.00 0.06 0.00 -0.72 0.00 0.00 41.12 40.46 1bq0 n ASP 34 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 1bq0 h ARG 35 N 0.00 0.00 0.00 -0.67 0.11 -1.91 -3.45 114.38 108.46 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 0.48 0.00 0.09 0.10 0.00 0.00 179.97 180.64 1bq0 n ASN 36 N -3.25 0.00 -2.81 0.08 4.13 -1.07 -5.06 115.26 107.28 1bq0 n ASN 36 Ca 0.02 0.00 -0.10 0.00 1.68 0.00 0.00 54.58 56.18 1bq0 n ASN 36 Cb 0.71 0.00 0.04 0.00 -1.54 0.00 0.00 39.78 38.98 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 0.00 0.78 0.00 3.52 6.02 -1.26 -4.79 117.38 121.65 1bq0 n GLN 37 Ca 0.00 -1.93 0.00 0.00 -0.01 0.00 0.00 57.00 55.06 1bq0 n GLN 37 Cb 0.00 -1.42 0.00 0.00 1.02 0.00 0.00 30.24 29.84 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 1.55 1.67 0.00 1.08 0.00 -1.26 -4.40 105.19 103.83 1bq0 n GLY 38 Ca 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 2.92 0.00 0.00 1.61 8.00 -1.26 -4.80 116.55 123.02 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 0.00 0.00 0.01 -1.24 4.76 -1.26 -1.04 118.16 119.39 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 -0.11 0.00 -1.84 0.00 0.00 35.03 33.08 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 0.53 0.12 1.97 1.02 -1.26 -3.92 120.64 119.10 1bq0 n GLU 41 Ca 0.00 -0.10 0.12 0.00 -0.02 0.00 0.00 57.16 57.15 1bq0 n GLU 41 Cb 0.00 -1.57 0.05 0.00 -0.02 0.00 0.00 31.44 29.90 1bq0 n GLU 41 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bq0 h ALA 42 N 2.18 0.61 -0.48 0.62 0.00 -1.31 -3.15 119.26 117.73 1bq0 h ALA 42 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.01 1bq0 h ALA 42 Cb 0.91 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.61 1bq0 h ALA 42 CO 0.00 0.00 -0.07 1.49 0.00 0.00 0.00 179.25 180.67 1bq0 h GLU 43 N 0.00 0.04 0.00 0.00 4.22 -1.71 1.75 114.58 118.89 1bq0 h GLU 43 Ca 0.00 -0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.41 1bq0 h GLU 43 Cb 0.98 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.21 1bq0 h GLU 43 CO 0.00 0.03 -0.20 0.00 -2.18 0.00 0.00 179.01 176.65 1bq0 h ALA 44 N 1.46 0.03 -1.19 2.92 0.00 -1.80 -3.27 119.26 117.42 1bq0 h ALA 44 Ca 0.24 -0.38 0.34 0.00 0.00 0.00 0.00 54.91 55.11 1bq0 h ALA 44 Cb 0.37 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 1bq0 h ALA 44 CO -0.46 0.14 0.84 -0.22 0.00 0.00 0.00 179.25 179.55 1bq0 h LYS 45 N -1.00 0.04 -0.06 0.00 1.63 -1.48 2.71 116.57 118.41 1bq0 h LYS 45 Ca -0.04 -0.00 0.02 0.00 -0.85 0.00 0.00 60.65 59.78 1bq0 h LYS 45 Cb 0.56 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.18 1bq0 h LYS 45 CO -0.02 0.03 0.25 0.35 -3.45 0.00 0.00 179.45 176.60 1bq0 h PHE 46 N 0.04 0.00 0.00 1.91 3.57 0.26 2.70 116.94 125.43 1bq0 h PHE 46 Ca 0.58 0.00 -0.20 0.00 3.53 0.00 0.00 57.97 61.88 1bq0 h PHE 46 Cb 2.22 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 40.93 1bq0 h PHE 46 CO -0.00 0.00 -1.05 1.57 -2.23 0.00 0.00 178.31 176.60 1bq0 h LYS 47 N 0.00 0.00 -0.00 1.11 2.10 0.47 0.28 116.57 120.52 1bq0 h LYS 47 Ca 0.03 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.68 1bq0 h LYS 47 Cb 0.53 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.86 1bq0 h LYS 47 CO -0.00 0.75 -0.32 0.39 -2.00 0.00 0.00 179.45 178.26 1bq0 n GLU 48 N -3.23 0.29 0.00 0.07 1.02 0.76 -1.84 120.64 117.72 1bq0 n GLU 48 Ca -0.03 -0.15 0.00 0.00 -0.02 0.00 0.00 57.16 56.96 1bq0 n GLU 48 Cb 0.91 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.83 1bq0 n GLU 48 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1bq0 n ILE 49 N -1.22 0.00 0.85 -3.67 2.08 0.62 -4.09 119.36 113.93 1bq0 n ILE 49 Ca 0.09 0.14 0.14 0.00 0.56 0.00 0.00 62.75 63.67 1bq0 n ILE 49 Cb 0.33 -1.12 0.52 0.00 -0.75 0.00 0.00 39.64 38.61 1bq0 n ILE 49 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 1bq0 n LYS 50 N -1.78 0.11 -0.01 0.38 4.76 0.94 0.66 118.16 123.22 1bq0 n LYS 50 Ca 0.00 0.08 -0.06 0.00 -2.87 0.00 0.00 58.31 55.46 1bq0 n LYS 50 Cb 0.00 -1.62 -0.13 0.00 -1.84 0.00 0.00 35.03 31.44 1bq0 n LYS 50 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1bq0 n GLU 51 N -1.80 0.63 -0.07 1.97 2.13 -0.97 -2.86 120.64 119.67 1bq0 n GLU 51 Ca 0.06 0.27 -0.04 0.00 0.66 0.00 0.00 57.16 58.12 1bq0 n GLU 51 Cb 0.38 -1.79 -0.01 0.00 0.27 0.00 0.00 31.44 30.28 1bq0 n GLU 51 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1bq0 h ALA 52 N 1.10 0.00 0.00 4.31 0.00 -1.25 -3.38 119.26 120.04 1bq0 h ALA 52 Ca -0.26 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.17 1bq0 h ALA 52 Cb 1.91 0.47 0.00 0.00 0.00 0.00 0.00 17.79 20.17 1bq0 h ALA 52 CO 0.07 0.47 0.00 2.48 0.00 0.00 0.00 179.25 182.27 1bq0 n TYR 53 N -4.54 0.00 -0.21 0.00 0.18 0.21 -2.99 117.16 109.82 1bq0 n TYR 53 Ca -0.07 0.00 -0.04 0.00 1.88 0.00 0.00 57.90 59.68 1bq0 n TYR 53 Cb 0.25 -0.44 0.15 0.00 -0.38 0.00 0.00 39.34 38.92 1bq0 n TYR 53 CO 0.00 0.00 0.00 1.49 -2.08 0.00 0.00 176.86 176.27 1bq0 h GLU 54 N 0.00 1.01 -0.73 -3.48 4.81 -1.60 -2.48 114.58 112.12 1bq0 h GLU 54 Ca 0.00 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 1bq0 h GLU 54 Cb 0.18 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.39 1bq0 h GLU 54 CO 0.00 0.83 0.00 1.33 -0.73 0.00 0.00 179.01 180.44 1bq0 n VAL 55 N -4.29 1.03 1.83 0.32 0.24 -1.16 -4.14 118.33 112.16 1bq0 n VAL 55 Ca 0.06 -0.99 0.09 0.00 -2.04 0.00 0.00 64.34 61.46 1bq0 n VAL 55 Cb 0.18 0.46 0.48 0.00 -1.47 0.00 0.00 33.84 33.50 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 1.60 0.35 -0.01 1.34 4.32 -0.93 -3.13 117.00 120.55 1bq0 n LEU 56 Ca 0.24 -0.15 0.02 0.00 -0.02 0.00 0.00 56.01 56.11 1bq0 n LEU 56 Cb 0.63 -0.02 -0.05 0.00 -1.62 0.00 0.00 43.42 42.36 1bq0 n LEU 56 CO 0.17 0.07 -0.60 1.07 -1.22 0.00 0.00 177.39 176.89 1bq0 n THR 57 N -0.54 0.07 -2.96 -5.08 5.66 -1.26 -4.40 114.28 105.77 1bq0 n THR 57 Ca 0.14 -0.17 -0.20 0.00 -3.05 0.00 0.00 64.05 60.77 1bq0 n THR 57 Cb 0.12 0.15 0.07 0.00 -1.55 0.00 0.00 70.33 69.11 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 -2.92 5.02 -0.01 1.09 -1.08 -1.18 -4.86 116.67 112.72 1bq0 s ASP 58 Ca -0.02 -0.75 0.00 0.00 -0.52 0.00 0.00 52.55 51.26 1bq0 s ASP 58 Cb 0.04 0.19 -0.01 0.00 -1.46 0.00 0.00 42.92 41.68 1bq0 s ASP 58 CO 0.27 -1.39 -0.01 -0.24 0.52 0.00 0.00 175.17 174.32 1bq0 n SER 59 N -2.31 4.14 0.21 -0.34 2.88 -1.26 -4.25 113.62 112.69 1bq0 n SER 59 Ca 0.15 -0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.75 1bq0 n SER 59 Cb 0.61 0.13 0.55 0.00 -0.75 0.00 0.00 64.21 64.76 1bq0 n SER 59 CO 0.00 0.00 0.00 0.06 -1.23 0.00 0.00 175.04 173.87 1bq0 h GLN 60 N 0.00 0.07 0.15 -1.46 3.07 -1.97 -2.16 115.11 112.81 1bq0 h GLN 60 Ca -0.03 -0.01 -0.31 0.00 0.09 0.00 0.00 58.65 58.39 1bq0 h GLN 60 Cb 1.05 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 28.60 1bq0 h GLN 60 CO -0.00 0.12 -1.52 0.87 0.09 0.00 0.00 178.83 178.39 1bq0 h LYS 61 N 0.07 0.32 -0.38 0.06 1.57 -1.88 -2.88 116.57 113.45 1bq0 h LYS 61 Ca 0.02 -0.54 0.11 0.00 -1.87 0.00 0.00 60.65 58.36 1bq0 h LYS 61 Cb 0.13 0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 1bq0 h LYS 61 CO 0.01 1.21 0.61 0.00 -0.57 0.00 0.00 179.45 180.70 1bq0 h ARG 62 N 0.09 0.00 0.00 3.15 2.47 -1.56 2.51 114.38 121.03 1bq0 h ARG 62 Ca -0.25 0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.33 1bq0 h ARG 62 Cb 2.05 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 30.34 1bq0 h ARG 62 CO 0.19 0.00 -1.88 0.00 0.56 0.00 0.00 179.97 178.83 1bq0 n ALA 63 N -2.12 2.20 -0.09 0.04 0.00 -1.14 -3.27 120.51 116.11 1bq0 n ALA 63 Ca 0.07 -0.73 -0.18 0.00 0.00 0.00 0.00 53.44 52.59 1bq0 n ALA 63 Cb 0.76 -0.67 -0.10 0.00 0.00 0.00 0.00 19.45 19.44 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 1.57 0.19 -0.04 0.00 0.00 0.27 -3.37 119.26 117.89 1bq0 h ALA 64 Ca -0.20 -1.01 -0.13 0.00 0.00 0.00 0.00 54.91 53.57 1bq0 h ALA 64 Cb 1.50 0.61 -0.01 0.00 0.00 0.00 0.00 17.79 19.88 1bq0 h ALA 64 CO 0.02 0.58 -0.59 -0.92 0.00 0.00 0.00 179.25 178.34 1bq0 h TYR 65 N -1.00 0.15 -0.10 0.00 3.20 0.32 -1.57 116.97 117.97 1bq0 h TYR 65 Ca -0.26 -0.06 0.03 0.00 3.14 0.00 0.00 58.73 61.59 1bq0 h TYR 65 Cb 1.13 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 39.37 1bq0 h TYR 65 CO 0.07 0.67 0.07 0.38 -1.64 0.00 0.00 178.16 177.72 1bq0 h ASP 66 N 0.09 0.01 0.00 -2.11 2.03 -1.58 0.81 116.42 115.67 1bq0 h ASP 66 Ca -0.00 -0.00 -0.21 0.00 -0.73 0.00 0.00 57.03 56.08 1bq0 h ASP 66 Cb 1.06 -0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 39.52 1bq0 h ASP 66 CO 0.08 0.01 -2.21 0.00 -1.03 0.00 0.00 179.24 176.09 1bq0 n GLN 67 N -4.51 0.70 -0.02 4.15 10.64 -1.14 -4.77 117.38 122.43 1bq0 n GLN 67 Ca -0.01 -0.09 -0.02 0.00 -1.83 0.00 0.00 57.00 55.06 1bq0 n GLN 67 Cb 0.18 -1.51 -0.01 0.00 -0.86 0.00 0.00 30.24 28.04 1bq0 n GLN 67 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1bq0 n TYR 68 N -2.53 0.00 -2.58 2.61 4.01 -0.60 -5.01 117.16 113.05 1bq0 n TYR 68 Ca -0.21 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.42 1bq0 n TYR 68 Cb 0.90 -0.11 0.01 0.00 -0.31 0.00 0.00 39.34 39.84 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 1.77 0.03 0.00 2.72 0.00 0.25 -4.90 105.19 105.05 1bq0 n GLY 69 Ca -0.03 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 -3.92 0.00 0.27 1.61 -0.00 -1.26 -4.96 115.22 106.96 1bq0 n HIS 70 Ca -0.07 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.58 1bq0 n HIS 70 Cb 0.57 0.00 0.07 0.00 -0.00 0.00 0.00 29.99 30.63 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 3.45 -0.37 1.57 0.00 -1.26 -4.59 120.51 116.32 1bq0 n ALA 71 Ca 0.00 -0.92 -0.05 0.00 0.00 0.00 0.00 53.44 52.47 1bq0 n ALA 71 Cb 0.00 -1.13 -0.02 0.00 0.00 0.00 0.00 19.45 18.29 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 -0.01 -0.33 -3.91 0.00 0.00 -1.26 -3.18 120.51 111.81 1bq0 n ALA 72 Ca 0.18 0.85 -0.30 0.00 0.00 0.00 0.00 53.44 54.18 1bq0 n ALA 72 Cb 0.85 -0.28 -0.14 0.00 0.00 0.00 0.00 19.45 19.88 1bq0 n ALA 72 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1bq0 s PHE 73 N -5.68 3.11 -0.35 0.00 2.19 -1.26 -4.91 117.98 111.08 1bq0 s PHE 73 Ca -0.12 -3.12 0.15 0.00 0.33 0.00 0.00 56.93 54.17 1bq0 s PHE 73 Cb 0.15 -2.69 0.43 0.00 -1.31 0.00 0.00 43.02 39.59 1bq0 s PHE 73 CO 0.61 -0.71 1.00 -1.91 1.83 0.00 0.00 175.22 176.04 1bq0 n GLU 74 N 2.95 1.12 0.17 10.12 4.07 -1.19 -4.89 120.64 133.00 1bq0 n GLU 74 Ca 0.08 -2.94 0.13 0.00 -0.06 0.00 0.00 57.16 54.36 1bq0 n GLU 74 Cb 0.33 -1.07 0.62 0.00 -0.06 0.00 0.00 31.44 31.27 1bq0 n GLU 74 CO 0.00 0.00 0.00 -0.56 -0.06 0.00 0.00 177.13 176.51 1bq0 h GLN 75 N 2.81 0.00 0.00 5.31 -0.00 -1.91 -3.35 115.11 117.98 1bq0 h GLN 75 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.54 1bq0 h GLN 75 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.65 1bq0 h GLN 75 CO 0.38 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.62 1bq0 n GLY 76 N -0.91 0.01 0.00 0.06 0.00 -1.26 -5.31 105.19 97.78 1bq0 n GLY 76 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1bq0 n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93