#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dt7 n SER 1 N 0.00 -5.00 0.04 7.83 7.64 -1.26 -4.81 113.62 118.07 1dt7 n SER 1 Ca 0.00 0.18 0.13 0.00 1.01 0.00 0.00 58.87 60.19 1dt7 n SER 1 Cb 0.00 -4.28 0.50 0.00 -1.01 0.00 0.00 64.21 59.42 1dt7 n SER 1 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1dt7 n GLU 2 N -2.69 0.10 0.28 1.43 1.02 -1.26 -3.73 120.64 115.79 1dt7 n GLU 2 Ca -0.20 0.14 0.07 0.00 -0.02 0.00 0.00 57.16 57.15 1dt7 n GLU 2 Cb 0.63 -1.63 0.37 0.00 -0.02 0.00 0.00 31.44 30.80 1dt7 n GLU 2 CO 0.00 0.00 0.00 1.37 1.18 0.00 0.00 177.13 179.68 1dt7 h LEU 3 N 0.00 0.00 -0.75 -4.62 -0.00 -1.99 0.29 115.31 108.24 1dt7 h LEU 3 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.81 1dt7 h LEU 3 Cb 0.52 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.15 1dt7 h LEU 3 CO 0.00 0.00 0.17 -0.33 -0.00 0.00 0.00 178.44 178.28 1dt7 h GLU 4 N 0.00 1.12 0.06 0.17 5.08 -1.97 -1.18 114.58 117.86 1dt7 h GLU 4 Ca 0.00 -0.27 -0.26 0.00 -1.00 0.00 0.00 59.36 57.83 1dt7 h GLU 4 Cb 1.17 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 30.28 1dt7 h GLU 4 CO 0.00 0.98 -1.10 1.57 -1.00 0.00 0.00 179.01 179.47 1dt7 h LYS 5 N 1.06 0.45 -0.16 2.33 2.10 -0.74 -3.10 116.57 118.51 1dt7 h LYS 5 Ca 0.22 -0.57 -0.01 0.00 -2.00 0.00 0.00 60.65 58.29 1dt7 h LYS 5 Cb 0.37 0.18 -0.01 0.00 -0.90 0.00 0.00 32.23 31.88 1dt7 h LYS 5 CO 0.00 1.22 0.06 0.00 -2.00 0.00 0.00 179.45 178.73 1dt7 h ALA 6 N 0.57 0.21 -0.94 0.07 0.00 -1.40 -1.94 119.26 115.82 1dt7 h ALA 6 Ca -0.12 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.68 1dt7 h ALA 6 Cb 1.76 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 19.45 1dt7 h ALA 6 CO 0.19 -0.19 0.62 0.52 0.00 0.00 0.00 179.25 180.39 1dt7 h MET 7 N 0.10 1.24 -0.70 0.00 2.86 -1.31 -1.91 114.93 115.20 1dt7 h MET 7 Ca 0.05 -0.08 -0.05 0.00 -2.06 0.00 0.00 59.70 57.57 1dt7 h MET 7 Cb 0.19 -0.28 -0.03 0.00 0.06 0.00 0.00 31.60 31.54 1dt7 h MET 7 CO -0.00 0.82 0.25 0.28 1.06 0.00 0.00 176.91 179.32 1dt7 h VAL 8 N 1.28 1.25 -0.36 -2.22 2.07 -1.43 -2.86 116.25 113.96 1dt7 h VAL 8 Ca 0.34 -0.81 -0.11 0.00 0.82 0.00 0.00 66.70 66.95 1dt7 h VAL 8 Cb -0.14 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 1dt7 h VAL 8 CO -0.07 0.32 -0.23 0.00 0.02 0.00 0.00 177.57 177.61 1dt7 h ALA 9 N 1.25 0.92 -1.00 1.67 0.00 -0.60 -2.51 119.26 118.98 1dt7 h ALA 9 Ca 0.23 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1dt7 h ALA 9 Cb 0.23 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 1dt7 h ALA 9 CO -0.02 0.62 0.66 -0.07 0.00 0.00 0.00 179.25 180.44 1dt7 h LEU 10 N 0.63 1.13 -0.49 0.00 3.38 -1.17 -2.07 115.31 116.72 1dt7 h LEU 10 Ca 0.09 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 1dt7 h LEU 10 Cb 0.72 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1dt7 h LEU 10 CO 0.06 0.80 -0.21 0.40 0.09 0.00 0.00 178.44 179.57 1dt7 h ILE 11 N 1.32 1.27 0.02 1.22 2.04 -1.48 -2.82 117.51 119.09 1dt7 h ILE 11 Ca 0.38 -1.38 -0.00 0.00 1.00 0.00 0.00 64.86 64.86 1dt7 h ILE 11 Cb -0.10 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1dt7 h ILE 11 CO -0.10 0.48 -0.01 -0.78 0.00 0.00 0.00 178.15 177.74 1dt7 h ASP 12 N 0.87 -0.02 -0.91 1.72 1.82 -0.94 -2.88 116.42 116.07 1dt7 h ASP 12 Ca 0.11 -0.08 -0.01 0.00 -0.39 0.00 0.00 57.03 56.67 1dt7 h ASP 12 Cb 0.80 0.01 -0.04 0.00 0.68 0.00 0.00 39.33 40.77 1dt7 h ASP 12 CO 0.07 0.06 0.53 0.58 -1.61 0.00 0.00 179.24 178.87 1dt7 h VAL 13 N -0.11 1.26 -0.97 2.25 2.07 -1.50 -2.14 116.25 117.10 1dt7 h VAL 13 Ca -0.00 -0.59 0.11 0.00 0.82 0.00 0.00 66.70 67.03 1dt7 h VAL 13 Cb 0.10 -0.01 -0.08 0.00 -1.52 0.00 0.00 31.29 29.78 1dt7 h VAL 13 CO 0.00 0.28 0.61 0.15 0.02 0.00 0.00 177.57 178.63 1dt7 h PHE 14 N 1.27 1.11 0.00 1.57 3.57 -1.30 0.26 116.94 123.41 1dt7 h PHE 14 Ca 0.33 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.84 1dt7 h PHE 14 Cb -0.02 -0.35 -0.00 0.00 2.79 0.00 0.00 35.95 38.36 1dt7 h PHE 14 CO 0.01 0.47 -0.10 0.45 -2.23 0.00 0.00 178.31 176.90 1dt7 h HIS 15 N 1.00 0.00 -0.78 0.41 3.86 -1.22 -2.26 115.15 116.15 1dt7 h HIS 15 Ca 0.47 0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.72 1dt7 h HIS 15 Cb 0.41 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.83 1dt7 h HIS 15 CO -0.01 0.10 0.49 1.96 0.86 0.00 0.00 177.93 181.33 1dt7 h GLN 16 N 0.00 0.91 0.00 2.45 1.08 -0.32 -3.21 115.11 116.03 1dt7 h GLN 16 Ca -0.00 -0.05 -0.05 0.00 -1.45 0.00 0.00 58.65 57.09 1dt7 h GLN 16 Cb 1.01 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 28.22 1dt7 h GLN 16 CO 0.01 0.60 -1.32 2.48 -0.95 0.00 0.00 178.83 179.65 1dt7 n TYR 17 N -4.63 0.00 -0.30 2.96 4.11 -1.23 -4.50 117.16 113.57 1dt7 n TYR 17 Ca 0.10 0.00 -0.04 0.00 -0.00 0.00 0.00 57.90 57.95 1dt7 n TYR 17 Cb 0.11 -0.21 0.08 0.00 -0.00 0.00 0.00 39.34 39.32 1dt7 n TYR 17 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.86 177.63 1dt7 h SER 18 N 0.00 0.99 0.81 9.48 0.02 -1.51 -1.06 113.55 122.28 1dt7 h SER 18 Ca -0.08 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 1dt7 h SER 18 Cb 0.85 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.14 1dt7 h SER 18 CO 0.00 0.77 0.00 0.61 -1.14 0.00 0.00 176.83 177.07 1dt7 n GLY 19 N -1.21 -1.31 0.27 -3.77 0.00 -1.21 -3.39 105.19 94.57 1dt7 n GLY 19 Ca 0.08 -0.08 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 1dt7 n GLY 19 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1dt7 h ARG 20 N 0.00 0.91 0.00 1.61 2.43 -1.41 -3.36 114.38 114.56 1dt7 h ARG 20 Ca 0.00 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1dt7 h ARG 20 Cb 0.40 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 1dt7 h ARG 20 CO 0.00 0.66 0.00 -1.91 -1.51 0.00 0.00 179.97 177.21 1dt7 n GLU 21 N -4.56 0.00 0.00 0.20 4.07 -1.22 -5.03 120.64 114.10 1dt7 n GLU 21 Ca 0.05 0.07 0.00 0.00 -0.06 0.00 0.00 57.16 57.23 1dt7 n GLU 21 Cb 0.06 -0.58 0.00 0.00 -0.06 0.00 0.00 31.44 30.86 1dt7 n GLU 21 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1dt7 n GLY 22 N 2.37 0.10 3.57 8.31 0.00 -1.25 -5.08 105.19 113.21 1dt7 n GLY 22 Ca 0.00 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 1dt7 n GLY 22 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1dt7 s ASP 23 N -0.86 6.48 0.12 1.61 1.01 -1.26 -4.84 116.67 118.93 1dt7 s ASP 23 Ca 0.00 0.12 0.15 0.00 0.71 0.00 0.00 52.55 53.52 1dt7 s ASP 23 Cb 0.00 -2.52 -0.10 0.00 1.01 0.00 0.00 42.92 41.32 1dt7 s ASP 23 CO 0.00 -1.32 1.04 0.11 0.21 0.00 0.00 175.17 175.21 1dt7 h LYS 24 N 9.36 0.00 -0.02 8.23 1.57 -1.93 -3.33 116.57 130.45 1dt7 h LYS 24 Ca -0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1dt7 h LYS 24 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.37 1dt7 h LYS 24 CO 1.13 0.46 -0.26 -2.39 -0.57 0.00 0.00 179.45 177.82 1dt7 n HIS 25 N -3.06 0.00 -3.88 -1.35 1.44 -1.26 -4.87 115.22 102.24 1dt7 n HIS 25 Ca -0.06 0.00 -0.12 0.00 -2.01 0.00 0.00 57.72 55.53 1dt7 n HIS 25 Cb 0.84 0.00 -0.14 0.00 0.12 0.00 0.00 29.99 30.81 1dt7 n HIS 25 CO 0.00 0.00 0.00 0.21 -2.81 0.00 0.00 176.34 173.74 1dt7 s LYS 26 N -2.26 0.01 -0.13 -1.40 2.20 -1.25 -3.58 119.74 113.33 1dt7 s LYS 26 Ca 0.23 -0.01 -0.04 0.00 -0.36 0.00 0.00 55.97 55.79 1dt7 s LYS 26 Cb 0.19 -0.01 -0.03 0.00 -1.51 0.00 0.00 37.83 36.47 1dt7 s LYS 26 CO 0.45 0.00 0.01 -1.17 -0.36 0.00 0.00 175.35 174.29 1dt7 s LEU 27 N -0.02 3.59 0.11 5.43 2.96 -0.76 -4.57 118.68 125.42 1dt7 s LEU 27 Ca -0.00 0.07 0.02 0.00 -0.22 0.00 0.00 54.13 53.99 1dt7 s LEU 27 Cb -0.00 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.79 1dt7 s LEU 27 CO -0.00 0.26 0.22 -0.54 -1.32 0.00 0.00 176.35 174.97 1dt7 s LYS 28 N -0.19 3.32 0.64 1.98 1.02 -1.26 -0.57 119.74 124.68 1dt7 s LYS 28 Ca 0.06 -0.57 0.24 0.00 0.02 0.00 0.00 55.97 55.72 1dt7 s LYS 28 Cb -0.12 -2.94 1.27 0.00 -0.52 0.00 0.00 37.83 35.52 1dt7 s LYS 28 CO 0.02 0.56 1.72 1.57 -0.92 0.00 0.00 175.35 178.29 1dt7 h LYS 29 N 2.67 0.00 0.01 1.68 2.10 -1.91 0.41 116.57 121.53 1dt7 h LYS 29 Ca -0.47 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.10 1dt7 h LYS 29 Cb 1.18 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.51 1dt7 h LYS 29 CO 0.71 0.00 -0.32 0.66 -2.00 0.00 0.00 179.45 178.50 1dt7 h SER 30 N 0.00 0.26 -0.16 7.07 4.64 -1.92 -2.42 113.55 121.02 1dt7 h SER 30 Ca 0.09 -0.81 -0.11 0.00 -0.47 0.00 0.00 61.79 60.49 1dt7 h SER 30 Cb 1.18 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 1dt7 h SER 30 CO -0.00 1.04 -0.27 -0.33 -0.87 0.00 0.00 176.83 176.40 1dt7 h GLU 31 N -0.50 0.62 -0.89 4.77 5.08 -0.69 -2.46 114.58 120.52 1dt7 h GLU 31 Ca -0.04 -0.26 0.01 0.00 -1.00 0.00 0.00 59.36 58.07 1dt7 h GLU 31 Cb 1.10 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 30.28 1dt7 h GLU 31 CO 0.06 0.83 0.58 1.25 -1.00 0.00 0.00 179.01 180.74 1dt7 h LEU 32 N 0.54 1.00 -0.83 1.33 5.85 -0.85 -1.43 115.31 120.92 1dt7 h LEU 32 Ca 0.07 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 1dt7 h LEU 32 Cb 0.74 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 1dt7 h LEU 32 CO 0.06 0.72 0.33 0.50 -0.34 0.00 0.00 178.44 179.71 1dt7 h LYS 33 N 1.18 1.19 -0.96 1.25 3.64 -1.04 -2.44 116.57 119.39 1dt7 h LYS 33 Ca 0.33 -0.21 0.01 0.00 -1.27 0.00 0.00 60.65 59.51 1dt7 h LYS 33 Cb -0.11 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 31.46 1dt7 h LYS 33 CO -0.08 0.95 0.63 0.93 -2.27 0.00 0.00 179.45 179.61 1dt7 h GLU 34 N 1.16 1.28 -0.28 1.90 5.08 -0.83 0.30 114.58 123.19 1dt7 h GLU 34 Ca 0.27 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 58.43 1dt7 h GLU 34 Cb 0.20 -0.28 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 1dt7 h GLU 34 CO -0.02 0.85 -0.27 1.25 -1.00 0.00 0.00 179.01 179.82 1dt7 h LEU 35 N 1.31 0.73 -0.26 1.33 6.46 -1.15 -0.96 115.31 122.77 1dt7 h LEU 35 Ca 0.35 -0.47 -0.11 0.00 -0.12 0.00 0.00 57.88 57.53 1dt7 h LEU 35 Cb -0.13 -0.20 -0.00 0.00 -0.73 0.00 0.00 40.66 39.59 1dt7 h LEU 35 CO -0.07 1.05 -0.27 0.40 -0.62 0.00 0.00 178.44 178.92 1dt7 h ILE 36 N 0.42 1.31 0.12 4.05 2.04 -0.98 -0.35 117.51 124.12 1dt7 h ILE 36 Ca 0.05 -1.44 -0.28 0.00 1.00 0.00 0.00 64.86 64.18 1dt7 h ILE 36 Cb 0.84 1.66 -0.00 0.00 -0.74 0.00 0.00 36.82 38.57 1dt7 h ILE 36 CO 0.07 0.46 -1.31 0.78 0.00 0.00 0.00 178.15 178.14 1dt7 h ASN 37 N 0.36 0.38 0.00 1.72 4.21 -0.46 -3.27 115.58 118.52 1dt7 h ASN 37 Ca 0.04 -0.44 -0.38 0.00 1.21 0.00 0.00 56.30 56.73 1dt7 h ASN 37 Cb 0.84 -0.12 -0.07 0.00 -1.12 0.00 0.00 38.32 37.84 1dt7 h ASN 37 CO 0.07 1.35 -2.44 0.59 -1.29 0.00 0.00 177.43 175.71 1dt7 n ASN 38 N -3.49 1.38 0.08 5.81 5.03 -0.37 -4.48 115.26 119.22 1dt7 n ASN 38 Ca -0.10 -0.09 0.12 0.00 0.87 0.00 0.00 54.58 55.38 1dt7 n ASN 38 Cb 1.02 0.04 0.24 0.00 -1.02 0.00 0.00 39.78 40.06 1dt7 n ASN 38 CO 0.00 0.00 0.00 -0.08 -1.83 0.00 0.00 177.26 175.35 1dt7 h GLU 39 N 0.00 0.00 -1.98 3.52 4.81 -1.05 -3.35 114.58 116.53 1dt7 h GLU 39 Ca -0.57 0.00 -0.67 0.00 -0.13 0.00 0.00 59.36 57.99 1dt7 h GLU 39 Cb 2.00 0.00 -0.36 0.00 0.63 0.00 0.00 28.75 31.02 1dt7 h GLU 39 CO -0.05 0.00 0.02 1.28 -0.73 0.00 0.00 179.01 179.53 1dt7 n LEU 40 N -2.23 5.76 -0.29 1.64 4.77 -1.07 -4.81 117.00 120.78 1dt7 n LEU 40 Ca 0.04 -5.31 0.00 0.00 -0.03 0.00 0.00 56.01 50.71 1dt7 n LEU 40 Cb 0.45 -0.76 0.13 0.00 -2.33 0.00 0.00 43.42 40.91 1dt7 n LEU 40 CO 0.34 2.14 1.17 -1.28 -1.33 0.00 0.00 177.39 178.43 1dt7 h SER 41 N 3.10 0.77 0.00 -1.43 0.87 -1.80 -3.36 113.55 111.70 1dt7 h SER 41 Ca 0.35 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.93 1dt7 h SER 41 Cb 0.49 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.31 1dt7 h SER 41 CO 1.03 0.49 -0.02 1.41 -0.53 0.00 0.00 176.83 179.21 1dt7 n HIS 42 N -4.66 0.00 0.26 2.24 8.25 -1.26 -4.78 115.22 115.27 1dt7 n HIS 42 Ca 0.11 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.72 1dt7 n HIS 42 Cb 0.17 0.00 0.63 0.00 1.12 0.00 0.00 29.99 31.91 1dt7 n HIS 42 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 1dt7 h PHE 43 N 0.00 0.00 -3.61 4.41 3.57 -1.88 -3.45 116.94 115.99 1dt7 h PHE 43 Ca 0.00 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 1dt7 h PHE 43 Cb 0.00 0.00 -0.10 0.00 2.79 0.00 0.00 35.95 38.64 1dt7 h PHE 43 CO 0.00 0.08 -0.12 -1.17 -2.23 0.00 0.00 178.31 174.87 1dt7 s LEU 44 N -6.46 0.41 -0.14 0.59 2.96 -1.26 -5.09 118.68 109.69 1dt7 s LEU 44 Ca 0.01 -0.78 -0.29 0.00 -0.22 0.00 0.00 54.13 52.84 1dt7 s LEU 44 Cb 0.10 1.74 -0.04 0.00 0.50 0.00 0.00 46.19 48.49 1dt7 s LEU 44 CO 0.57 -1.06 1.57 -1.83 -1.32 0.00 0.00 176.35 174.29 1dt7 s GLU 45 N -3.96 4.04 0.69 1.98 -1.05 -1.26 -4.71 118.70 114.42 1dt7 s GLU 45 Ca 0.17 1.89 -0.15 0.00 -0.15 0.00 0.00 54.97 56.73 1dt7 s GLU 45 Cb 0.00 -3.97 0.02 0.00 -0.44 0.00 0.00 34.13 29.74 1dt7 s GLU 45 CO 0.03 -1.00 1.16 -1.21 0.95 0.00 0.00 175.26 175.19 1dt7 s GLU 46 N 4.20 2.46 -0.11 -4.83 2.02 -1.26 -4.98 118.70 116.20 1dt7 s GLU 46 Ca 0.69 1.59 -0.08 0.00 0.02 0.00 0.00 54.97 57.20 1dt7 s GLU 46 Cb -0.28 -1.89 -0.04 0.00 0.10 0.00 0.00 34.13 32.02 1dt7 s GLU 46 CO 0.27 -1.55 0.17 0.42 0.02 0.00 0.00 175.26 174.59 1dt7 s ILE 47 N -2.13 5.45 -0.05 -1.63 1.01 -1.26 -4.99 121.20 117.60 1dt7 s ILE 47 Ca 0.71 0.27 0.10 0.00 0.00 0.00 0.00 60.65 61.73 1dt7 s ILE 47 Cb -0.25 -3.44 -0.15 0.00 0.01 0.00 0.00 42.46 38.63 1dt7 s ILE 47 CO 0.43 0.60 0.15 0.29 0.00 0.00 0.00 174.94 176.41 1dt7 n LYS 48 N 2.09 1.23 -4.78 2.79 4.76 -1.26 -4.76 118.16 118.23 1dt7 n LYS 48 Ca -0.19 -0.06 -0.33 0.00 -2.87 0.00 0.00 58.31 54.86 1dt7 n LYS 48 Cb 0.54 -1.26 -0.12 0.00 -1.84 0.00 0.00 35.03 32.36 1dt7 n LYS 48 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1dt7 s GLU 49 N -2.52 2.54 0.54 1.97 2.02 -1.26 -4.99 118.70 116.99 1dt7 s GLU 49 Ca -0.04 -0.68 0.34 0.00 0.02 0.00 0.00 54.97 54.60 1dt7 s GLU 49 Cb 0.05 -2.43 1.42 0.00 0.10 0.00 0.00 34.13 33.28 1dt7 s GLU 49 CO 0.43 0.63 1.99 -0.56 0.02 0.00 0.00 175.26 177.77 1dt7 h GLN 50 N 5.21 0.00 -0.93 1.61 3.07 -2.01 -2.92 115.11 119.14 1dt7 h GLN 50 Ca -0.47 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.27 1dt7 h GLN 50 Cb 1.16 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 28.67 1dt7 h GLN 50 CO 0.51 0.00 0.58 1.05 0.09 0.00 0.00 178.83 181.06 1dt7 h GLU 51 N 0.00 1.25 -0.91 0.06 4.11 -2.00 -1.31 114.58 115.78 1dt7 h GLU 51 Ca 0.00 -0.10 0.00 0.00 0.07 0.00 0.00 59.36 59.33 1dt7 h GLU 51 Cb 0.46 -0.27 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 1dt7 h GLU 51 CO 0.00 0.86 0.59 0.28 0.07 0.00 0.00 179.01 180.81 1dt7 h VAL 52 N 1.28 1.24 -0.65 -1.06 2.07 -1.94 -1.70 116.25 115.48 1dt7 h VAL 52 Ca 0.34 -0.46 -0.05 0.00 0.82 0.00 0.00 66.70 67.34 1dt7 h VAL 52 Cb -0.09 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 29.57 1dt7 h VAL 52 CO -0.07 0.24 0.19 0.58 0.02 0.00 0.00 177.57 178.53 1dt7 h VAL 53 N 1.24 1.24 -0.55 2.57 2.07 -1.38 -1.77 116.25 119.68 1dt7 h VAL 53 Ca 0.33 -0.86 -0.09 0.00 0.82 0.00 0.00 66.70 66.91 1dt7 h VAL 53 Cb -0.12 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 1dt7 h VAL 53 CO -0.07 0.33 -0.01 0.44 0.02 0.00 0.00 177.57 178.28 1dt7 h ASP 54 N 0.97 0.92 -0.54 0.57 3.32 -0.57 -0.22 116.42 120.87 1dt7 h ASP 54 Ca 0.21 -0.25 -0.12 0.00 0.02 0.00 0.00 57.03 56.90 1dt7 h ASP 54 Cb 0.29 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 1dt7 h ASP 54 CO -0.01 0.98 -0.12 0.50 -1.72 0.00 0.00 179.24 178.88 1dt7 h LYS 55 N 0.87 1.04 -0.15 3.56 3.64 -1.08 -0.94 116.57 123.50 1dt7 h LYS 55 Ca 0.16 -0.39 -0.08 0.00 -1.27 0.00 0.00 60.65 59.07 1dt7 h LYS 55 Cb 0.53 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1dt7 h LYS 55 CO 0.03 1.08 -0.27 0.28 -2.27 0.00 0.00 179.45 178.30 1dt7 h VAL 56 N 0.92 1.25 0.00 2.00 2.07 -1.04 -1.28 116.25 120.17 1dt7 h VAL 56 Ca 0.14 -1.18 -0.08 0.00 0.82 0.00 0.00 66.70 66.41 1dt7 h VAL 56 Cb 0.69 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1dt7 h VAL 56 CO 0.05 0.36 -0.37 0.24 0.02 0.00 0.00 177.57 177.87 1dt7 h MET 57 N 0.25 0.00 -1.00 1.57 2.86 -0.27 -0.08 114.93 118.26 1dt7 h MET 57 Ca 0.04 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.73 1dt7 h MET 57 Cb 0.61 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.20 1dt7 h MET 57 CO 0.04 0.37 0.65 1.49 1.06 0.00 0.00 176.91 180.52 1dt7 h GLU 58 N 0.00 1.17 0.02 1.72 4.81 0.04 3.92 114.58 126.25 1dt7 h GLU 58 Ca -0.00 -0.07 -0.21 0.00 -0.13 0.00 0.00 59.36 58.95 1dt7 h GLU 58 Cb 0.79 -0.26 0.02 0.00 0.63 0.00 0.00 28.75 29.92 1dt7 h GLU 58 CO 0.05 0.77 -0.82 1.15 -0.73 0.00 0.00 179.01 179.43 1dt7 h THR 59 N 1.20 1.37 0.00 0.32 2.02 -1.31 -3.33 112.91 113.18 1dt7 h THR 59 Ca 0.42 -2.20 0.00 0.00 0.77 0.00 0.00 66.41 65.40 1dt7 h THR 59 Cb 0.11 2.57 0.00 0.00 -1.74 0.00 0.00 68.15 69.09 1dt7 h THR 59 CO -0.15 0.65 -0.75 0.18 0.37 0.00 0.00 175.52 175.82 1dt7 n LEU 60 N -4.06 0.67 -3.31 2.58 4.77 -0.12 -4.31 117.00 113.22 1dt7 n LEU 60 Ca -0.11 0.15 -0.39 0.00 -0.03 0.00 0.00 56.01 55.64 1dt7 n LEU 60 Cb 0.78 -0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 41.68 1dt7 n LEU 60 CO 0.51 -0.02 3.23 -0.67 -1.33 0.00 0.00 177.39 179.10 1dt7 n ASP 61 N -2.07 8.60 -0.32 -1.43 -0.08 1.29 -4.59 116.55 117.95 1dt7 n ASP 61 Ca 0.03 -2.66 -0.00 0.00 -1.51 0.00 0.00 54.79 50.65 1dt7 n ASP 61 Cb 0.44 -1.53 0.17 0.00 2.34 0.00 0.00 41.12 42.54 1dt7 n ASP 61 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1dt7 h GLU 62 N 4.89 1.19 -0.00 -0.67 5.08 -1.80 0.86 114.58 124.13 1dt7 h GLU 62 Ca 0.84 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 59.13 1dt7 h GLU 62 Cb 0.31 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1dt7 h GLU 62 CO 1.71 0.79 -0.02 -0.40 -1.00 0.00 0.00 179.01 180.09 1dt7 n ASP 63 N -4.41 0.05 -2.52 1.42 5.68 -1.26 -4.90 116.55 110.61 1dt7 n ASP 63 Ca 0.11 -0.14 -0.18 0.00 -0.50 0.00 0.00 54.79 54.09 1dt7 n ASP 63 Cb 0.04 -0.28 0.03 0.00 -1.14 0.00 0.00 41.12 39.78 1dt7 n ASP 63 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1dt7 n GLY 64 N 1.30 -0.26 0.64 6.12 0.00 0.29 -4.89 105.19 108.39 1dt7 n GLY 64 Ca 0.14 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.19 1dt7 n GLY 64 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1dt7 n ASP 65 N -1.70 2.36 0.00 1.61 5.75 -1.26 -4.94 116.55 118.38 1dt7 n ASP 65 Ca -0.07 -1.67 0.00 0.00 -0.01 0.00 0.00 54.79 53.03 1dt7 n ASP 65 Cb 0.59 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.66 1dt7 n ASP 65 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1dt7 n GLY 66 N 0.88 0.70 2.85 6.12 0.00 -1.26 -4.99 105.19 109.48 1dt7 n GLY 66 Ca 0.10 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.98 1dt7 n GLY 66 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dt7 s GLU 67 N -0.04 0.06 -0.27 1.61 2.02 -1.26 -3.03 118.70 117.80 1dt7 s GLU 67 Ca 0.00 0.04 -0.11 0.00 0.02 0.00 0.00 54.97 54.92 1dt7 s GLU 67 Cb 0.00 -0.15 -0.05 0.00 0.10 0.00 0.00 34.13 34.03 1dt7 s GLU 67 CO 0.00 -0.04 0.18 0.00 0.02 0.00 0.00 175.26 175.41 1dt7 n ASP 69 N 4.86 -0.53 -0.34 0.00 -0.08 -1.26 -1.83 116.55 117.37 1dt7 n ASP 69 Ca -0.14 0.18 0.18 0.00 -1.51 0.00 0.00 54.79 53.50 1dt7 n ASP 69 Cb 0.52 -1.39 0.39 0.00 2.34 0.00 0.00 41.12 42.98 1dt7 n ASP 69 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 1dt7 h PHE 70 N -2.23 1.01 -0.32 -0.67 3.57 -1.90 0.33 116.94 116.73 1dt7 h PHE 70 Ca -0.51 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.02 1dt7 h PHE 70 Cb 1.30 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.73 1dt7 h PHE 70 CO 0.40 0.05 0.17 0.37 -2.23 0.00 0.00 178.31 177.07 1dt7 h GLN 71 N 0.57 0.45 -0.84 1.11 4.15 -1.90 -1.58 115.11 117.07 1dt7 h GLN 71 Ca 0.65 -0.06 -0.04 0.00 0.77 0.00 0.00 58.65 59.98 1dt7 h GLN 71 Cb 1.25 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 28.82 1dt7 h GLN 71 CO -0.49 0.39 0.38 0.93 -1.93 0.00 0.00 178.83 178.12 1dt7 h GLU 72 N 0.39 1.22 -0.11 1.69 5.08 -0.67 -2.21 114.58 119.97 1dt7 h GLU 72 Ca 0.11 -0.19 -0.12 0.00 -1.00 0.00 0.00 59.36 58.16 1dt7 h GLU 72 Cb 0.08 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1dt7 h GLU 72 CO -0.02 0.95 -0.46 0.35 -1.00 0.00 0.00 179.01 178.83 1dt7 h PHE 73 N 1.21 0.33 -0.84 4.33 3.57 -1.13 -2.96 116.94 121.45 1dt7 h PHE 73 Ca 0.29 -0.10 0.01 0.00 3.53 0.00 0.00 57.97 61.69 1dt7 h PHE 73 Cb 0.15 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.78 1dt7 h PHE 73 CO 0.02 0.69 0.55 0.52 -2.23 0.00 0.00 178.31 177.85 1dt7 h MET 74 N 0.22 1.11 -0.26 1.11 2.86 -0.67 -2.17 114.93 117.12 1dt7 h MET 74 Ca 0.01 -0.07 -0.09 0.00 -2.06 0.00 0.00 59.70 57.49 1dt7 h MET 74 Cb 0.90 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 32.30 1dt7 h MET 74 CO 0.07 0.74 -0.24 0.00 1.06 0.00 0.00 176.91 178.54 1dt7 h ALA 75 N 1.46 1.10 0.00 6.32 0.00 -1.31 -2.40 119.26 124.43 1dt7 h ALA 75 Ca 0.31 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1dt7 h ALA 75 Cb -0.12 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1dt7 h ALA 75 CO -0.06 0.56 -0.01 0.35 0.00 0.00 0.00 179.25 180.08 1dt7 h PHE 76 N 0.44 0.00 0.02 0.00 3.57 -1.40 -1.22 116.94 118.34 1dt7 h PHE 76 Ca 0.07 0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.36 1dt7 h PHE 76 Cb 0.66 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.39 1dt7 h PHE 76 CO 0.02 0.01 -0.93 0.28 -2.23 0.00 0.00 178.31 175.46 1dt7 h VAL 77 N 0.00 1.53 -0.47 1.41 2.07 -1.37 -2.67 116.25 116.75 1dt7 h VAL 77 Ca -0.00 -2.80 -0.11 0.00 0.82 0.00 0.00 66.70 64.61 1dt7 h VAL 77 Cb 0.02 2.58 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 1dt7 h VAL 77 CO 0.00 0.81 -0.14 0.77 0.02 0.00 0.00 177.57 179.03 1dt7 h SER 78 N 0.08 0.94 -0.12 0.57 4.64 -1.19 -2.39 113.55 116.07 1dt7 h SER 78 Ca -0.05 -0.37 -0.18 0.00 -0.47 0.00 0.00 61.79 60.72 1dt7 h SER 78 Cb 1.59 -0.26 0.01 0.00 -0.31 0.00 0.00 62.40 63.43 1dt7 h SER 78 CO 0.14 1.10 -0.62 0.00 -0.87 0.00 0.00 176.83 176.58 1dt7 h MET 79 N 0.77 0.63 -0.77 4.77 3.00 -1.56 -3.11 114.93 118.66 1dt7 h MET 79 Ca 0.12 -0.52 0.01 0.00 0.00 0.00 0.00 59.70 59.30 1dt7 h MET 79 Cb 0.70 0.11 -0.04 0.00 0.00 0.00 0.00 31.60 32.37 1dt7 h MET 79 CO 0.05 1.14 0.51 0.28 0.00 0.00 0.00 176.91 178.89 1dt7 h VAL 80 N 0.29 1.20 -0.97 -0.10 2.07 -1.47 -0.85 116.25 116.42 1dt7 h VAL 80 Ca -0.04 -0.37 0.02 0.00 0.82 0.00 0.00 66.70 67.13 1dt7 h VAL 80 Cb 1.26 0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 31.05 1dt7 h VAL 80 CO 0.13 0.19 0.64 0.74 0.02 0.00 0.00 177.57 179.29 1dt7 h THR 81 N 1.05 1.21 -0.99 2.57 2.02 -1.42 -0.40 112.91 116.94 1dt7 h THR 81 Ca 0.28 -0.44 0.24 0.00 0.77 0.00 0.00 66.41 67.27 1dt7 h THR 81 Cb -0.11 -0.17 -0.12 0.00 -1.74 0.00 0.00 68.15 66.00 1dt7 h THR 81 CO -0.06 0.23 0.58 0.74 0.37 0.00 0.00 175.52 177.38 1dt7 h THR 82 N 1.27 0.54 -0.31 3.16 2.02 -1.08 1.65 112.91 120.16 1dt7 h THR 82 Ca 0.37 -0.20 -0.07 0.00 0.77 0.00 0.00 66.41 67.29 1dt7 h THR 82 Cb -0.08 -0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.23 1dt7 h THR 82 CO -0.10 0.10 -0.09 0.00 0.37 0.00 0.00 175.52 175.81 1dt7 h ALA 83 N 1.73 1.28 -0.82 6.16 0.00 -1.06 -2.34 119.26 124.21 1dt7 h ALA 83 Ca 0.63 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 55.30 1dt7 h ALA 83 Cb 1.19 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 1dt7 h ALA 83 CO -0.48 0.48 0.54 0.00 0.00 0.00 0.00 179.25 179.79 1dt7 h HIS 85 N 1.11 1.23 -0.98 0.00 6.17 -0.80 2.20 115.15 124.08 1dt7 h HIS 85 Ca 0.30 0.03 0.01 0.00 0.71 0.00 0.00 60.37 61.42 1dt7 h HIS 85 Cb -0.13 -0.41 -0.05 0.00 2.52 0.00 0.00 27.41 29.34 1dt7 h HIS 85 CO -0.00 0.77 0.65 0.93 0.71 0.00 0.00 177.93 180.99 1dt7 h GLU 86 N 1.32 1.29 0.00 5.26 5.08 -1.32 -2.01 114.58 124.20 1dt7 h GLU 86 Ca 0.36 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 58.53 1dt7 h GLU 86 Cb -0.15 -0.29 -0.02 0.00 0.50 0.00 0.00 28.75 28.79 1dt7 h GLU 86 CO -0.08 0.85 -0.81 0.35 -1.00 0.00 0.00 179.01 178.32 1dt7 h PHE 87 N 1.32 0.00 -0.86 4.33 3.57 -0.76 -3.30 116.94 121.25 1dt7 h PHE 87 Ca 0.36 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.86 1dt7 h PHE 87 Cb -0.15 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.55 1dt7 h PHE 87 CO 0.00 0.44 0.56 0.35 -2.23 0.00 0.00 178.31 177.43 1dt7 h PHE 88 N 0.00 1.09 -1.45 0.41 3.04 0.43 -3.34 116.94 117.13 1dt7 h PHE 88 Ca -0.06 0.02 -0.49 0.00 3.98 0.00 0.00 57.97 61.42 1dt7 h PHE 88 Cb 1.38 -0.37 -0.07 0.00 2.56 0.00 0.00 35.95 39.46 1dt7 h PHE 88 CO 0.00 0.70 1.18 -1.21 -2.02 0.00 0.00 178.31 176.95 1dt7 s GLU 89 N -5.95 3.07 0.44 1.11 2.02 -1.05 -4.78 118.70 113.57 1dt7 s GLU 89 Ca -0.12 -0.41 0.23 0.00 0.02 0.00 0.00 54.97 54.70 1dt7 s GLU 89 Cb 0.18 -4.85 0.99 0.00 0.10 0.00 0.00 34.13 30.55 1dt7 s GLU 89 CO 0.80 -2.59 1.86 1.12 0.02 0.00 0.00 175.26 176.48 1dt7 h HIS 90 N 11.13 0.00 0.00 1.61 2.07 -1.88 -3.49 115.15 124.59 1dt7 h HIS 90 Ca -0.02 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.50 1dt7 h HIS 90 Cb 1.04 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.02 1dt7 h HIS 90 CO 1.19 0.24 0.00 0.39 -3.07 0.00 0.00 177.93 176.68