#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f05 n SER 2 N 0.00 0.00 -3.58 1.62 7.64 -1.26 -4.53 113.62 113.50 2f05 n SER 2 Ca 0.00 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.73 2f05 n SER 2 Cb 0.00 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.07 2f05 n SER 2 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2f05 s ASP 3 N 0.00 0.73 -1.25 6.43 1.01 -1.26 -5.07 116.67 117.27 2f05 s ASP 3 Ca 0.00 0.27 -0.17 0.00 0.71 0.00 0.00 52.55 53.36 2f05 s ASP 3 Cb 0.00 0.58 0.10 0.00 1.01 0.00 0.00 42.92 44.61 2f05 s ASP 3 CO 0.00 -0.27 1.61 -0.55 0.21 0.00 0.00 175.17 176.17 2f05 s SER 4 N 2.38 6.89 0.08 0.27 0.15 -1.26 -4.85 113.70 117.37 2f05 s SER 4 Ca 0.04 -2.57 -0.35 0.00 0.70 0.00 0.00 55.95 53.77 2f05 s SER 4 Cb -0.13 -2.52 -0.18 0.00 -1.71 0.00 0.00 66.02 61.48 2f05 s SER 4 CO -0.10 -1.05 1.58 0.58 1.20 0.00 0.00 173.24 175.45 2f05 h VAL 5 N 5.34 0.08 -0.15 4.45 2.07 -1.97 0.65 116.25 126.72 2f05 h VAL 5 Ca 0.39 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.82 2f05 h VAL 5 Cb 0.88 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 2f05 h VAL 5 CO 1.38 0.00 -0.29 -0.33 0.02 0.00 0.00 177.57 178.35 2f05 h GLU 6 N -1.06 0.28 -0.36 1.57 4.39 -1.99 0.85 114.58 118.26 2f05 h GLU 6 Ca -0.08 -0.10 -0.08 0.00 0.34 0.00 0.00 59.36 59.44 2f05 h GLU 6 Cb 0.88 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 2f05 h GLU 6 CO 0.04 0.55 -0.08 0.35 -1.16 0.00 0.00 179.01 178.71 2f05 h PHE 7 N 0.25 0.77 -0.82 4.33 3.57 -1.91 -0.04 116.94 123.10 2f05 h PHE 7 Ca 0.04 -0.16 -0.04 0.00 3.53 0.00 0.00 57.97 61.33 2f05 h PHE 7 Cb 0.65 -0.19 -0.04 0.00 2.79 0.00 0.00 35.95 39.17 2f05 h PHE 7 CO 0.01 0.84 0.36 -0.91 -2.23 0.00 0.00 178.31 176.38 2f05 h ASN 8 N 0.48 1.10 -0.80 0.41 2.35 0.12 0.62 115.58 119.87 2f05 h ASN 8 Ca 0.09 -0.16 0.02 0.00 -0.55 0.00 0.00 56.30 55.71 2f05 h ASN 8 Cb 0.59 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.63 2f05 h ASN 8 CO 0.03 0.95 0.52 0.78 -1.65 0.00 0.00 177.43 178.06 2f05 h ASN 9 N 1.17 0.87 -0.43 5.81 2.35 -0.69 -0.82 115.58 123.84 2f05 h ASN 9 Ca 0.28 -0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.92 2f05 h ASN 9 Cb 0.17 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 2f05 h ASN 9 CO -0.03 0.61 -0.10 0.00 -1.65 0.00 0.00 177.43 176.26 2f05 h ALA 10 N 1.32 0.59 -0.86 -0.83 0.00 0.17 -2.96 119.26 116.69 2f05 h ALA 10 Ca 0.31 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2f05 h ALA 10 Cb -0.04 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 2f05 h ALA 10 CO -0.09 0.47 0.51 0.82 0.00 0.00 0.00 179.25 180.96 2f05 h ILE 11 N 0.65 1.24 -0.49 0.00 1.08 0.67 0.17 117.51 120.84 2f05 h ILE 11 Ca 0.11 -0.54 0.00 0.00 -0.39 0.00 0.00 64.86 64.04 2f05 h ILE 11 Cb 0.63 0.04 -0.02 0.00 -3.07 0.00 0.00 36.82 34.40 2f05 h ILE 11 CO 0.04 0.26 0.31 0.28 -0.69 0.00 0.00 178.15 178.35 2f05 h SER 12 N 1.18 0.57 -0.12 1.72 0.02 -1.07 0.59 113.55 116.44 2f05 h SER 12 Ca 0.31 -0.02 -0.17 0.00 -0.84 0.00 0.00 61.79 61.06 2f05 h SER 12 Cb -0.03 -0.14 0.01 0.00 0.14 0.00 0.00 62.40 62.37 2f05 h SER 12 CO -0.06 0.42 -0.60 1.88 -1.14 0.00 0.00 176.83 177.34 2f05 h TYR 13 N 0.66 0.83 -0.42 3.45 -1.99 -1.05 -2.33 116.97 116.12 2f05 h TYR 13 Ca 0.18 -0.37 -0.05 0.00 2.00 0.00 0.00 58.73 60.49 2f05 h TYR 13 Cb -0.05 -0.13 -0.02 0.00 2.00 0.00 0.00 36.73 38.53 2f05 h TYR 13 CO 0.00 1.17 0.08 0.28 -0.00 0.00 0.00 178.16 179.69 2f05 h VAL 14 N 0.26 1.24 -0.87 -2.88 2.07 0.25 -0.21 116.25 116.11 2f05 h VAL 14 Ca -0.04 -0.84 0.01 0.00 0.82 0.00 0.00 66.70 66.65 2f05 h VAL 14 Cb 1.24 0.98 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 2f05 h VAL 14 CO 0.12 0.29 0.57 -1.13 0.02 0.00 0.00 177.57 177.45 2f05 h ASN 15 N 0.54 0.99 -0.50 0.57 -1.24 0.07 0.32 115.58 116.35 2f05 h ASN 15 Ca 0.13 -0.03 -0.04 0.00 0.71 0.00 0.00 56.30 57.07 2f05 h ASN 15 Cb 0.35 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 39.13 2f05 h ASN 15 CO 0.01 0.72 0.14 0.50 -1.29 0.00 0.00 177.43 177.51 2f05 h LYS 16 N 1.17 0.78 -0.09 6.67 3.64 -0.95 0.86 116.57 128.65 2f05 h LYS 16 Ca 0.32 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2f05 h LYS 16 Cb -0.13 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.57 2f05 h LYS 16 CO -0.07 0.74 0.05 0.82 -2.27 0.00 0.00 179.45 178.72 2f05 h ILE 17 N 0.67 1.01 -0.66 2.00 2.04 0.16 0.33 117.51 123.05 2f05 h ILE 17 Ca 0.16 -0.04 0.10 0.00 1.00 0.00 0.00 64.86 66.08 2f05 h ILE 17 Cb 0.29 0.89 -0.08 0.00 -0.74 0.00 0.00 36.82 37.18 2f05 h ILE 17 CO -0.00 0.02 0.27 0.11 0.00 0.00 0.00 178.15 178.55 2f05 h LYS 18 N 0.11 0.45 -0.05 2.37 1.57 -0.02 -0.97 116.57 120.02 2f05 h LYS 18 Ca 0.04 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 2f05 h LYS 18 Cb -0.00 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.21 2f05 h LYS 18 CO -0.02 0.30 -0.25 1.15 -0.57 0.00 0.00 179.45 180.06 2f05 h THR 19 N 0.46 1.45 0.00 -0.16 2.02 -0.55 -1.05 112.91 115.07 2f05 h THR 19 Ca 0.34 -1.68 -0.02 0.00 0.77 0.00 0.00 66.41 65.81 2f05 h THR 19 Cb 0.42 2.38 -0.00 0.00 -1.74 0.00 0.00 68.15 69.20 2f05 h THR 19 CO -0.31 0.47 -0.11 0.03 0.37 0.00 0.00 175.52 175.97 2f05 h ARG 20 N -0.26 0.00 -0.29 6.66 2.47 -0.01 -1.65 114.38 121.29 2f05 h ARG 20 Ca -0.02 0.00 -0.23 0.00 -1.26 0.00 0.00 59.98 58.48 2f05 h ARG 20 Cb 0.90 0.00 -0.24 0.00 -1.65 0.00 0.00 29.97 28.98 2f05 h ARG 20 CO 0.05 0.11 -0.75 1.19 0.56 0.00 0.00 179.97 181.13 2f05 n PHE 21 N -3.35 1.02 0.08 3.04 3.72 -0.40 -4.78 117.46 116.78 2f05 n PHE 21 Ca -0.01 -1.65 -0.00 0.00 -0.05 0.00 0.00 57.45 55.74 2f05 n PHE 21 Cb 0.30 -0.26 0.29 0.00 -0.94 0.00 0.00 39.48 38.87 2f05 n PHE 21 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2f05 h LEU 22 N 1.56 0.30 -0.66 4.37 6.46 -0.17 -0.76 115.31 126.40 2f05 h LEU 22 Ca 0.07 -0.09 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 2f05 h LEU 22 Cb 1.34 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 41.18 2f05 h LEU 22 CO 0.28 0.55 -0.13 -0.67 -0.62 0.00 0.00 178.44 177.84 2f05 n ASP 23 N -4.16 1.16 -3.63 1.25 2.03 -1.26 -4.46 116.55 107.47 2f05 n ASP 23 Ca -0.01 -1.13 -0.27 0.00 0.52 0.00 0.00 54.79 53.91 2f05 n ASP 23 Cb 0.36 0.06 -0.10 0.00 -0.72 0.00 0.00 41.12 40.72 2f05 n ASP 23 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 2f05 n HIS 24 N -0.33 2.18 0.15 -0.67 8.25 -0.29 -4.96 115.22 119.55 2f05 n HIS 24 Ca 0.16 -4.01 0.04 0.00 -0.26 0.00 0.00 57.72 53.64 2f05 n HIS 24 Cb 0.34 -0.41 0.43 0.00 1.12 0.00 0.00 29.99 31.48 2f05 n HIS 24 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2f05 h PRO 25 N 5.05 0.17 -0.59 -0.41 0.13 -1.78 -2.81 132.00 131.75 2f05 h PRO 25 Ca 0.18 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.27 2f05 h PRO 25 Cb 0.77 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 31.85 2f05 h PRO 25 CO 0.65 0.30 0.34 1.05 -0.23 0.00 0.00 178.00 180.11 2f05 h GLU 26 N 0.16 0.79 -0.26 0.86 4.11 -1.92 -2.45 114.58 115.87 2f05 h GLU 26 Ca 0.03 -0.07 -0.01 0.00 0.07 0.00 0.00 59.36 59.38 2f05 h GLU 26 Cb 0.33 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2f05 h GLU 26 CO 0.02 0.57 0.12 0.82 0.07 0.00 0.00 179.01 180.61 2f05 h ILE 27 N 0.81 1.15 -0.40 -1.06 2.04 -1.85 0.25 117.51 118.45 2f05 h ILE 27 Ca 0.21 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 2f05 h ILE 27 Cb -0.01 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 2f05 h ILE 27 CO -0.04 0.15 0.23 0.22 0.00 0.00 0.00 178.15 178.71 2f05 h TYR 28 N 0.29 0.54 -0.36 1.37 3.20 -1.60 -2.34 116.97 118.08 2f05 h TYR 28 Ca 0.09 -0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.84 2f05 h TYR 28 Cb 0.13 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 2f05 h TYR 28 CO -0.02 0.41 -0.22 0.00 -1.64 0.00 0.00 178.16 176.69 2f05 h ARG 29 N 0.52 0.78 0.00 1.82 3.08 -0.97 -0.71 114.38 118.90 2f05 h ARG 29 Ca 0.14 -0.36 -0.06 0.00 0.07 0.00 0.00 59.98 59.77 2f05 h ARG 29 Cb 0.04 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 2f05 h ARG 29 CO -0.02 0.99 -0.30 0.66 -1.07 0.00 0.00 179.97 180.22 2f05 h SER 30 N 0.56 0.00 -0.02 7.04 4.64 -0.44 -2.41 113.55 122.93 2f05 h SER 30 Ca 0.07 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.16 2f05 h SER 30 Cb 0.78 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.88 2f05 h SER 30 CO 0.06 0.30 -0.88 0.15 -0.87 0.00 0.00 176.83 175.59 2f05 h PHE 31 N 0.00 0.99 -0.80 4.77 3.57 -1.16 -3.31 116.94 121.00 2f05 h PHE 31 Ca -0.00 -0.48 0.19 0.00 3.53 0.00 0.00 57.97 61.21 2f05 h PHE 31 Cb 0.55 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 39.10 2f05 h PHE 31 CO 0.00 1.31 0.54 -0.07 -2.23 0.00 0.00 178.31 177.86 2f05 h LEU 32 N 0.45 0.26 -0.81 0.59 3.38 -0.60 0.97 115.31 119.54 2f05 h LEU 32 Ca -0.08 0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 2f05 h LEU 32 Cb 1.52 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 42.22 2f05 h LEU 32 CO 0.17 0.12 -0.59 1.05 0.09 0.00 0.00 178.44 179.28 2f05 h GLU 33 N 0.26 0.03 -0.10 1.13 4.11 -1.63 -1.14 114.58 117.24 2f05 h GLU 33 Ca 0.40 -0.02 -0.06 0.00 0.07 0.00 0.00 59.36 59.75 2f05 h GLU 33 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2f05 h GLU 33 CO -0.10 0.61 -0.18 0.82 0.07 0.00 0.00 179.01 180.22 2f05 h ILE 34 N 0.02 1.39 -0.05 -1.06 2.04 -0.96 0.18 117.51 119.07 2f05 h ILE 34 Ca -0.01 -1.46 -0.13 0.00 1.00 0.00 0.00 64.86 64.27 2f05 h ILE 34 Cb 1.05 2.11 -0.01 0.00 -0.74 0.00 0.00 36.82 39.22 2f05 h ILE 34 CO 0.08 0.42 -0.55 0.25 0.00 0.00 0.00 178.15 178.35 2f05 h LEU 35 N -0.15 0.15 0.10 1.44 7.12 -1.41 -1.03 115.31 121.53 2f05 h LEU 35 Ca 0.00 -0.08 -0.28 0.00 0.13 0.00 0.00 57.88 57.65 2f05 h LEU 35 Cb 0.76 -0.04 0.02 0.00 -0.53 0.00 0.00 40.66 40.87 2f05 h LEU 35 CO 0.04 0.67 -1.24 -0.74 -0.13 0.00 0.00 178.44 177.04 2f05 h HIS 36 N 0.10 0.73 -0.10 1.25 2.76 -1.08 -2.97 115.15 115.85 2f05 h HIS 36 Ca -0.00 -0.49 -0.10 0.00 -2.20 0.00 0.00 60.37 57.58 2f05 h HIS 36 Cb 1.00 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.90 2f05 h HIS 36 CO 0.01 1.36 -0.38 0.00 -1.30 0.00 0.00 177.93 177.62 2f05 h THR 37 N 0.16 1.29 -0.56 6.26 1.03 -0.54 -1.99 112.91 118.58 2f05 h THR 37 Ca -0.16 -1.42 0.03 0.00 -0.01 0.00 0.00 66.41 64.85 2f05 h THR 37 Cb 1.93 1.64 -0.03 0.00 -1.07 0.00 0.00 68.15 70.62 2f05 h THR 37 CO 0.22 0.42 0.37 0.22 -0.01 0.00 0.00 175.52 176.74 2f05 h TYR 38 N 0.18 0.62 0.00 0.00 3.20 -1.15 -1.73 116.97 118.09 2f05 h TYR 38 Ca 0.02 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 2f05 h TYR 38 Cb 0.75 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 2f05 h TYR 38 CO 0.01 0.37 -0.17 1.96 -1.64 0.00 0.00 178.16 178.68 2f05 h GLN 39 N 0.65 0.00 0.00 1.82 1.08 -1.19 -1.84 115.11 115.63 2f05 h GLN 39 Ca 0.22 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.41 2f05 h GLN 39 Cb 0.08 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.51 2f05 h GLN 39 CO -0.06 0.17 -0.05 0.87 -0.95 0.00 0.00 178.83 178.82 2f05 h LYS 40 N 0.00 0.00 0.00 1.46 6.56 -1.38 -1.19 116.57 122.02 2f05 h LYS 40 Ca -0.00 0.00 -0.09 0.00 -1.06 0.00 0.00 60.65 59.50 2f05 h LYS 40 Cb 0.47 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.11 2f05 h LYS 40 CO 0.02 0.05 -0.80 0.93 -2.06 0.00 0.00 179.45 177.59 2f05 h GLU 41 N 0.00 0.00 -0.02 3.15 4.39 -1.41 -3.24 114.58 117.45 2f05 h GLU 41 Ca -0.00 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.49 2f05 h GLU 41 Cb 0.94 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.59 2f05 h GLU 41 CO 0.01 0.26 -0.88 1.96 -1.16 0.00 0.00 179.01 179.20 2f05 h GLN 42 N 0.00 0.40 -6.41 2.33 1.08 -1.03 -3.41 115.11 108.07 2f05 h GLN 42 Ca -0.05 -0.40 -0.54 0.00 -1.45 0.00 0.00 58.65 56.21 2f05 h GLN 42 Cb 1.32 0.11 0.01 0.00 -0.05 0.00 0.00 27.48 28.86 2f05 h GLN 42 CO 0.04 1.06 0.90 -1.17 -0.95 0.00 0.00 178.83 178.71 2f05 s LEU 43 N -7.77 4.34 -1.20 1.46 1.98 -0.49 -4.88 118.68 112.13 2f05 s LEU 43 Ca -0.06 2.28 -0.20 0.00 -2.89 0.00 0.00 54.13 53.26 2f05 s LEU 43 Cb 0.09 -3.56 0.02 0.00 0.66 0.00 0.00 46.19 43.40 2f05 s LEU 43 CO 0.86 -0.79 1.76 -1.00 -1.89 0.00 0.00 176.35 175.29 2f05 s HIS 44 N 2.46 2.46 0.00 5.38 3.76 -1.26 -3.90 115.29 124.19 2f05 s HIS 44 Ca 0.68 -0.81 0.00 0.00 -0.15 0.00 0.00 55.06 54.78 2f05 s HIS 44 Cb -0.35 -4.50 0.00 0.00 1.11 0.00 0.00 32.58 28.84 2f05 s HIS 44 CO 0.29 -1.66 0.00 2.41 -0.85 0.00 0.00 174.74 174.93 2f05 n THR 45 N 6.94 0.00 0.00 1.30 -1.04 -1.26 -5.17 114.28 115.05 2f05 n THR 45 Ca 0.45 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.46 2f05 n THR 45 Cb 0.47 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.98 2f05 n THR 45 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 2f05 n LYS 46 N -0.41 0.00 0.00 -2.82 2.85 -1.24 -5.04 118.16 111.50 2f05 n LYS 46 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2f05 n LYS 46 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 2f05 n LYS 46 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2f05 n GLY 47 N -0.76 0.00 3.71 2.58 0.00 -1.22 -4.81 105.19 104.68 2f05 n GLY 47 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2f05 n GLY 47 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2f05 s ARG 48 N -0.46 4.51 -0.46 1.61 3.00 -1.26 -5.00 118.95 120.89 2f05 s ARG 48 Ca 0.00 1.21 -0.29 0.00 -1.00 0.00 0.00 55.73 55.65 2f05 s ARG 48 Cb 0.00 -3.45 0.03 0.00 0.00 0.00 0.00 34.95 31.53 2f05 s ARG 48 CO 0.00 0.00 1.15 -1.25 0.00 0.00 0.00 175.30 175.20 2f05 s PRO 49 N 0.90 3.75 0.07 5.12 0.04 -1.26 -4.67 135.00 138.94 2f05 s PRO 49 Ca 0.46 0.63 0.00 0.00 0.04 0.00 0.00 61.00 62.13 2f05 s PRO 49 Cb -0.20 -3.90 0.00 0.00 0.04 0.00 0.00 34.50 30.44 2f05 s PRO 49 CO 0.24 -1.35 0.00 0.34 0.04 0.00 0.00 177.00 176.27 2f05 n PHE 50 N 7.81 -2.44 -0.39 0.56 7.35 -1.26 -5.04 117.46 124.06 2f05 n PHE 50 Ca 0.12 1.46 0.00 0.00 -0.76 0.00 0.00 57.45 58.28 2f05 n PHE 50 Cb 0.49 -2.86 0.00 0.00 0.35 0.00 0.00 39.48 37.45 2f05 n PHE 50 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2f05 n ARG 51 N 0.93 -0.43 -2.08 -4.13 1.74 -1.26 -4.94 116.66 106.48 2f05 n ARG 51 Ca 0.00 0.54 -0.42 0.00 -0.77 0.00 0.00 57.85 57.20 2f05 n ARG 51 Cb 0.00 -0.33 -0.03 0.00 -1.02 0.00 0.00 32.46 31.08 2f05 n ARG 51 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2f05 s GLY 52 N -0.55 2.18 -0.50 -0.13 0.00 -1.26 -4.82 107.32 102.23 2f05 s GLY 52 Ca 0.00 1.24 -0.28 0.00 0.00 0.00 0.00 44.72 45.68 2f05 s GLY 52 CO 0.00 2.29 1.70 -0.29 0.00 0.00 0.00 173.10 176.80 2f05 s MET 53 N 0.19 3.07 0.36 2.90 1.75 -1.26 -4.96 119.30 121.36 2f05 s MET 53 Ca 0.61 0.83 -0.19 0.00 -1.25 0.00 0.00 55.69 55.69 2f05 s MET 53 Cb -0.40 -4.24 -0.10 0.00 2.84 0.00 0.00 34.83 32.93 2f05 s MET 53 CO 0.38 -2.19 0.85 -1.12 -0.65 0.00 0.00 175.02 172.28 2f05 s SER 54 N 6.28 6.92 0.48 1.11 0.01 -1.26 -4.94 113.70 122.30 2f05 s SER 54 Ca 0.67 1.52 0.26 0.00 1.31 0.00 0.00 55.95 59.71 2f05 s SER 54 Cb -0.15 -2.47 1.21 0.00 0.21 0.00 0.00 66.02 64.82 2f05 s SER 54 CO 0.26 -0.24 1.96 1.05 0.41 0.00 0.00 173.24 176.68 2f05 h GLU 55 N 2.28 0.00 -0.59 12.44 9.09 -1.96 -1.50 114.58 134.34 2f05 h GLU 55 Ca -0.48 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 58.82 2f05 h GLU 55 Cb 1.18 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.26 2f05 h GLU 55 CO 0.63 0.17 -0.03 1.49 0.05 0.00 0.00 179.01 181.32 2f05 h GLU 56 N 0.00 1.07 0.00 1.06 4.81 -1.94 0.30 114.58 119.88 2f05 h GLU 56 Ca -0.00 -0.36 -0.11 0.00 -0.13 0.00 0.00 59.36 58.76 2f05 h GLU 56 Cb 0.53 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.80 2f05 h GLU 56 CO 0.02 1.06 -0.52 1.05 -0.73 0.00 0.00 179.01 179.89 2f05 h GLU 57 N 0.96 0.00 0.39 1.92 4.11 -1.69 0.02 114.58 120.29 2f05 h GLU 57 Ca 0.16 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.57 2f05 h GLU 57 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 2f05 h GLU 57 CO 0.04 0.52 -0.19 0.28 0.07 0.00 0.00 179.01 179.73 2f05 h VAL 58 N 0.00 0.61 -0.29 -1.06 2.07 -1.10 -3.02 116.25 113.46 2f05 h VAL 58 Ca -0.01 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 2f05 h VAL 58 Cb 1.19 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 2f05 h VAL 58 CO 0.07 0.06 0.17 0.15 0.02 0.00 0.00 177.57 178.04 2f05 h PHE 59 N -0.72 0.38 -0.06 1.57 3.57 -0.06 -1.99 116.94 119.62 2f05 h PHE 59 Ca -0.05 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.48 2f05 h PHE 59 Cb 0.51 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 2f05 h PHE 59 CO -0.00 0.26 -0.12 1.15 -2.23 0.00 0.00 178.31 177.36 2f05 h THR 60 N 0.40 0.68 0.00 4.41 2.02 -0.90 0.45 112.91 119.97 2f05 h THR 60 Ca 0.11 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.16 2f05 h THR 60 Cb 0.00 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 2f05 h THR 60 CO -0.02 0.00 -0.61 -0.33 0.37 0.00 0.00 175.52 174.93 2f05 h GLU 61 N -0.18 0.00 -0.24 6.66 5.08 -1.26 0.02 114.58 124.66 2f05 h GLU 61 Ca 0.07 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.32 2f05 h GLU 61 Cb 0.27 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 2f05 h GLU 61 CO -0.17 0.61 -0.27 0.28 -1.00 0.00 0.00 179.01 178.47 2f05 h VAL 62 N 0.00 1.32 -0.04 3.13 2.07 -0.97 0.15 116.25 121.91 2f05 h VAL 62 Ca -0.01 -1.44 -0.09 0.00 0.82 0.00 0.00 66.70 65.98 2f05 h VAL 62 Cb 1.13 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 32.59 2f05 h VAL 62 CO 0.08 0.45 -0.40 0.00 0.02 0.00 0.00 177.57 177.72 2f05 h ALA 63 N 0.66 1.26 0.00 1.67 0.00 0.06 -0.32 119.26 122.59 2f05 h ALA 63 Ca 0.03 -0.38 -0.14 0.00 0.00 0.00 0.00 54.91 54.43 2f05 h ALA 63 Cb 0.83 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2f05 h ALA 63 CO 0.06 0.53 -0.65 -0.97 0.00 0.00 0.00 179.25 178.22 2f05 h ASN 64 N 0.07 0.00 -0.02 0.00 -1.24 -0.85 -1.84 115.58 111.72 2f05 h ASN 64 Ca 0.01 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 56.97 2f05 h ASN 64 Cb 0.74 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.79 2f05 h ASN 64 CO 0.06 0.65 -0.17 0.25 -1.29 0.00 0.00 177.43 176.93 2f05 h LEU 65 N 0.00 0.17 -4.52 0.34 7.12 0.11 -3.35 115.31 115.18 2f05 h LEU 65 Ca -0.01 -0.72 -0.65 0.00 0.13 0.00 0.00 57.88 56.63 2f05 h LEU 65 Cb 1.19 -0.05 -0.36 0.00 -0.53 0.00 0.00 40.66 40.91 2f05 h LEU 65 CO 0.09 0.87 0.01 0.49 -0.13 0.00 0.00 178.44 179.76 2f05 n PHE 66 N -4.59 3.17 -1.64 1.25 3.72 -0.21 -5.03 117.46 114.13 2f05 n PHE 66 Ca -0.09 -2.73 -0.42 0.00 -0.05 0.00 0.00 57.45 54.15 2f05 n PHE 66 Cb 0.44 -0.62 -0.03 0.00 -0.94 0.00 0.00 39.48 38.34 2f05 n PHE 66 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2f05 n ARG 67 N -0.57 2.64 0.00 -1.08 1.74 -0.69 -1.26 116.66 117.43 2f05 n ARG 67 Ca 0.47 0.92 0.00 0.00 -0.77 0.00 0.00 57.85 58.47 2f05 n ARG 67 Cb 0.56 -3.07 0.00 0.00 -1.02 0.00 0.00 32.46 28.93 2f05 n ARG 67 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2f05 n GLY 68 N 4.88 1.79 2.74 -0.13 0.00 -1.26 -4.98 105.19 108.23 2f05 n GLY 68 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 2f05 n GLY 68 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2f05 n GLN 69 N -0.25 3.49 0.24 1.61 1.13 -0.39 -4.75 117.38 118.47 2f05 n GLN 69 Ca 0.00 -3.15 0.10 0.00 -1.94 0.00 0.00 57.00 52.02 2f05 n GLN 69 Cb 0.00 -3.00 0.59 0.00 0.11 0.00 0.00 30.24 27.95 2f05 n GLN 69 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 2f05 h GLU 70 N 5.65 0.00 -0.29 -1.09 5.08 -1.94 -1.04 114.58 120.95 2f05 h GLU 70 Ca 0.51 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.81 2f05 h GLU 70 Cb 0.57 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 2f05 h GLU 70 CO 1.71 0.19 -0.07 0.22 -1.00 0.00 0.00 179.01 180.05 2f05 h ASP 71 N 0.00 0.57 -0.52 1.42 1.82 -1.98 0.21 116.42 117.95 2f05 h ASP 71 Ca -0.00 -0.37 -0.05 0.00 -0.39 0.00 0.00 57.03 56.22 2f05 h ASP 71 Cb 0.51 -0.16 -0.02 0.00 0.68 0.00 0.00 39.33 40.35 2f05 h ASP 71 CO 0.02 0.81 0.14 -0.07 -1.61 0.00 0.00 179.24 178.53 2f05 h LEU 72 N 0.33 0.77 -0.29 2.28 3.38 -1.85 -2.66 115.31 117.27 2f05 h LEU 72 Ca 0.07 -0.22 -0.19 0.00 0.09 0.00 0.00 57.88 57.63 2f05 h LEU 72 Cb 0.56 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2f05 h LEU 72 CO 0.03 0.79 -0.57 -0.07 0.09 0.00 0.00 178.44 178.71 2f05 h LEU 73 N 0.71 0.98 -0.16 1.67 3.38 -0.98 -1.71 115.31 119.21 2f05 h LEU 73 Ca 0.16 -0.53 -0.04 0.00 0.09 0.00 0.00 57.88 57.56 2f05 h LEU 73 Cb 0.31 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 2f05 h LEU 73 CO -0.00 1.34 -0.05 -1.28 0.09 0.00 0.00 178.44 178.54 2f05 h SER 74 N 0.66 0.32 0.57 -0.43 0.87 -0.55 -3.03 113.55 111.97 2f05 h SER 74 Ca 0.01 -0.38 0.00 0.00 -1.23 0.00 0.00 61.79 60.19 2f05 h SER 74 Cb 1.18 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 2f05 h SER 74 CO 0.13 0.63 -0.19 -0.62 -0.53 0.00 0.00 176.83 176.24 2f05 n GLU 75 N -4.67 0.31 -0.32 2.24 -0.58 -1.01 -3.31 120.64 113.31 2f05 n GLU 75 Ca -0.05 -0.11 -0.02 0.00 -0.42 0.00 0.00 57.16 56.55 2f05 n GLU 75 Cb 0.27 -1.50 0.10 0.00 -0.57 0.00 0.00 31.44 29.75 2f05 n GLU 75 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 2f05 h PHE 76 N 0.28 1.08 0.00 -0.32 3.57 -1.17 -0.82 116.94 119.56 2f05 h PHE 76 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2f05 h PHE 76 Cb 0.44 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 38.82 2f05 h PHE 76 CO 0.00 0.65 0.00 0.41 -2.23 0.00 0.00 178.31 177.14 2f05 n GLY 77 N -1.34 -1.24 0.13 2.40 0.00 -1.21 -1.44 105.19 102.48 2f05 n GLY 77 Ca 0.10 -0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 2f05 n GLY 77 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2f05 h GLN 78 N 0.00 0.19 -0.48 1.61 1.08 -1.35 -3.38 115.11 112.79 2f05 h GLN 78 Ca 0.00 -0.33 -0.08 0.00 -1.45 0.00 0.00 58.65 56.79 2f05 h GLN 78 Cb 0.38 0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 27.91 2f05 h GLN 78 CO 0.00 1.16 -0.01 0.35 -0.95 0.00 0.00 178.83 179.38 2f05 h PHE 79 N -0.33 0.92 -4.04 2.96 3.57 -1.06 -3.45 116.94 115.52 2f05 h PHE 79 Ca -0.36 -0.16 -0.53 0.00 3.53 0.00 0.00 57.97 60.45 2f05 h PHE 79 Cb 1.75 -0.24 0.10 0.00 2.79 0.00 0.00 35.95 40.36 2f05 h PHE 79 CO 0.10 0.88 0.54 -0.51 -2.23 0.00 0.00 178.31 177.09 2f05 s LEU 80 N -9.38 3.89 -0.11 0.59 1.02 -0.52 -4.89 118.68 109.28 2f05 s LEU 80 Ca -0.12 2.53 -0.29 0.00 0.02 0.00 0.00 54.13 56.26 2f05 s LEU 80 Cb 0.11 -4.30 -0.07 0.00 0.02 0.00 0.00 46.19 41.95 2f05 s LEU 80 CO 0.82 -1.31 2.11 -0.81 0.02 0.00 0.00 176.35 177.18 2f05 n PRO 81 N -0.88 2.35 -3.50 1.29 -0.04 -1.26 -3.70 135.00 129.26 2f05 n PRO 81 Ca 0.09 0.77 -0.24 0.00 -0.04 0.00 0.00 63.50 64.08 2f05 n PRO 81 Cb 0.47 -3.11 -0.02 0.00 -0.04 0.00 0.00 33.50 30.79 2f05 n PRO 81 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2f05 n GLU 82 N 8.16 -2.56 0.23 0.54 0.28 -1.26 -4.81 120.64 121.22 2f05 n GLU 82 Ca 0.26 0.28 0.09 0.00 -0.16 0.00 0.00 57.16 57.62 2f05 n GLU 82 Cb 0.42 -4.91 0.55 0.00 1.43 0.00 0.00 31.44 28.94 2f05 n GLU 82 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2f05 h ALA 83 N 0.95 1.27 0.00 -1.84 0.00 -1.76 -1.85 119.26 116.02 2f05 h ALA 83 Ca -0.38 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2f05 h ALA 83 Cb 1.25 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2f05 h ALA 83 CO 0.52 0.28 0.00 0.87 0.00 0.00 0.00 179.25 180.91 2f05 h LYS 84 N 0.00 0.00 0.00 0.00 1.79 -1.88 -3.49 116.57 113.00 2f05 h LYS 84 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2f05 h LYS 84 Cb 0.52 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 2f05 h LYS 84 CO 0.03 0.00 0.00 -2.13 -1.08 0.00 0.00 179.45 176.27