#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3abk s GLU 2 N 0.00 1.77 -0.61 -1.08 2.02 -1.26 -5.09 118.70 114.45 3abk s GLU 2 Ca 0.00 -1.86 -0.26 0.00 0.02 0.00 0.00 54.97 52.87 3abk s GLU 2 Cb 0.00 -1.74 0.04 0.00 0.10 0.00 0.00 34.13 32.53 3abk s GLU 2 CO 0.00 0.22 1.12 1.21 0.02 0.00 0.00 175.26 177.84 3abk s ASN 3 N -3.57 6.34 -0.24 -0.19 3.84 -1.26 -4.89 114.94 114.97 3abk s ASN 3 Ca 0.31 -0.22 0.14 0.00 0.21 0.00 0.00 52.86 53.31 3abk s ASN 3 Cb -0.01 -2.51 0.75 0.00 -0.55 0.00 0.00 41.25 38.93 3abk s ASN 3 CO 0.16 -1.48 1.69 0.54 -2.79 0.00 0.00 177.10 175.22 3abk n ARG 4 N 8.30 4.35 -0.01 0.43 5.12 -1.26 -4.60 116.66 128.99 3abk n ARG 4 Ca 0.05 -3.10 -0.01 0.00 -1.93 0.00 0.00 57.85 52.86 3abk n ARG 4 Cb 0.48 -2.17 0.28 0.00 -1.16 0.00 0.00 32.46 29.88 3abk n ARG 4 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 3abk h VAL 5 N 3.37 1.21 -0.27 1.55 2.07 -1.99 -2.14 116.25 120.05 3abk h VAL 5 Ca 0.03 -0.85 -0.04 0.00 0.82 0.00 0.00 66.70 66.65 3abk h VAL 5 Cb 1.91 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 32.65 3abk h VAL 5 CO 0.46 0.29 -0.02 0.00 0.02 0.00 0.00 177.57 178.32 3abk h ALA 6 N 1.46 1.46 -0.47 1.67 0.00 -2.00 0.39 119.26 121.77 3abk h ALA 6 Ca 0.11 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3abk h ALA 6 Cb 0.37 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3abk h ALA 6 CO 0.02 0.38 0.11 0.93 0.00 0.00 0.00 179.25 180.69 3abk h GLU 7 N 0.40 0.76 -0.24 0.00 5.08 -1.75 -1.13 114.58 117.70 3abk h GLU 7 Ca 0.09 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.19 3abk h GLU 7 Cb 0.30 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3abk h GLU 7 CO 0.01 0.75 -0.13 0.87 -1.00 0.00 0.00 179.01 179.52 3abk h LYS 8 N 0.64 0.51 -0.67 2.33 1.79 -0.84 -0.49 116.57 119.85 3abk h LYS 8 Ca 0.15 -0.23 0.09 0.00 -2.18 0.00 0.00 60.65 58.49 3abk h LYS 8 Cb 0.33 -0.01 -0.07 0.00 -1.58 0.00 0.00 32.23 30.90 3abk h LYS 8 CO 0.00 0.78 0.30 1.96 -1.08 0.00 0.00 179.45 181.41 3abk h GLN 9 N 0.23 0.50 0.07 3.15 4.20 -0.05 -1.15 115.11 122.06 3abk h GLN 9 Ca 0.05 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 3abk h GLN 9 Cb 0.63 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.30 3abk h GLN 9 CO 0.04 0.33 -0.03 -0.22 -0.67 0.00 0.00 178.83 178.28 3abk h LYS 10 N 0.52 -0.09 -0.39 1.46 3.64 -1.07 -1.16 116.57 119.48 3abk h LYS 10 Ca 0.33 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.79 3abk h LYS 10 Cb 0.38 0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 32.13 3abk h LYS 10 CO -0.28 -0.04 -0.40 1.25 -2.27 0.00 0.00 179.45 177.71 3abk h LEU 11 N -0.11 -1.32 0.00 5.20 5.85 -0.71 -2.23 115.31 121.99 3abk h LEU 11 Ca -0.01 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.92 3abk h LEU 11 Cb 0.09 0.59 0.00 0.00 0.37 0.00 0.00 40.66 41.70 3abk h LEU 11 CO 0.01 -0.36 0.00 0.49 -0.34 0.00 0.00 178.44 178.25 3abk n PHE 12 N -5.42 0.00 0.45 1.25 3.01 -0.47 -1.88 117.46 114.40 3abk n PHE 12 Ca -0.00 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.55 3abk n PHE 12 Cb 0.35 -0.42 0.12 0.00 -0.01 0.00 0.00 39.48 39.53 3abk n PHE 12 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3abk n GLN 13 N -1.42 1.84 -1.62 -1.08 6.02 -0.45 -4.98 117.38 115.69 3abk n GLN 13 Ca 0.10 -1.79 -0.49 0.00 -0.01 0.00 0.00 57.00 54.81 3abk n GLN 13 Cb 0.29 -1.36 -0.05 0.00 1.02 0.00 0.00 30.24 30.14 3abk n GLN 13 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 3abk n GLU 14 N 1.03 1.59 -1.85 -1.09 2.13 -0.79 -4.86 120.64 116.81 3abk n GLU 14 Ca 0.13 0.57 -0.41 0.00 0.66 0.00 0.00 57.16 58.11 3abk n GLU 14 Cb 0.47 -2.26 -0.01 0.00 0.27 0.00 0.00 31.44 29.91 3abk n GLU 14 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 3abk n ASP 15 N 2.82 6.91 -1.03 4.31 4.64 -1.26 -4.52 116.55 128.41 3abk n ASP 15 Ca 0.17 -2.94 0.08 0.00 -1.38 0.00 0.00 54.79 50.73 3abk n ASP 15 Cb 0.24 -1.49 0.25 0.00 -1.04 0.00 0.00 41.12 39.08 3abk n ASP 15 CO 0.00 0.00 0.00 -0.46 -0.82 0.00 0.00 177.20 175.92 3abk n ASN 16 N 3.39 3.69 0.00 1.67 0.23 -1.26 -4.98 115.26 118.00 3abk n ASN 16 Ca 0.60 -2.26 0.00 0.00 -0.53 0.00 0.00 54.58 52.39 3abk n ASN 16 Cb 0.29 -0.41 0.00 0.00 -2.08 0.00 0.00 39.78 37.58 3abk n ASN 16 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3abk n GLY 17 N 0.72 0.71 3.77 4.83 0.00 -1.26 -4.98 105.19 108.98 3abk n GLY 17 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 3abk n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3abk s LEU 18 N 0.00 4.16 0.57 0.99 1.43 -1.26 -5.02 118.68 119.55 3abk s LEU 18 Ca 0.00 2.31 -0.17 0.00 -1.03 0.00 0.00 54.13 55.24 3abk s LEU 18 Cb 0.00 -4.07 -0.05 0.00 0.03 0.00 0.00 46.19 42.10 3abk s LEU 18 CO 0.00 -0.70 1.05 -2.16 0.23 0.00 0.00 176.35 174.77 3abk s PRO 19 N -2.38 3.46 0.42 1.29 0.04 -1.26 -4.77 135.00 131.80 3abk s PRO 19 Ca 0.58 1.21 0.20 0.00 0.04 0.00 0.00 61.00 63.04 3abk s PRO 19 Cb -0.29 -2.05 1.16 0.00 0.04 0.00 0.00 34.50 33.35 3abk s PRO 19 CO 0.37 -0.70 1.81 -0.24 0.04 0.00 0.00 177.00 178.28 3abk h VAL 20 N 0.68 0.56 0.00 -0.36 3.04 -1.98 0.10 116.25 118.30 3abk h VAL 20 Ca -0.47 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 65.10 3abk h VAL 20 Cb 1.22 0.19 0.00 0.00 -2.01 0.00 0.00 31.29 30.69 3abk h VAL 20 CO 0.58 0.06 0.00 0.00 -1.01 0.00 0.00 177.57 177.20 3abk n HIS 21 N -4.53 0.00 0.04 3.17 1.44 -1.26 -2.70 115.22 111.38 3abk n HIS 21 Ca 0.23 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.95 3abk n HIS 21 Cb 0.86 -0.49 0.01 0.00 0.12 0.00 0.00 29.99 30.49 3abk n HIS 21 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3abk n LEU 22 N -1.49 1.38 0.00 2.39 4.77 0.30 -4.75 117.00 119.61 3abk n LEU 22 Ca 0.06 -1.26 0.12 0.00 -0.03 0.00 0.00 56.01 54.90 3abk n LEU 22 Cb 0.26 -0.01 0.53 0.00 -2.33 0.00 0.00 43.42 41.87 3abk n LEU 22 CO 0.21 0.33 0.89 1.17 -1.33 0.00 0.00 177.39 178.67 3abk n LYS 23 N -0.03 0.01 0.12 3.23 4.81 -0.87 -2.68 118.16 122.74 3abk n LYS 23 Ca 0.01 0.08 0.12 0.00 -0.87 0.00 0.00 58.31 57.65 3abk n LYS 23 Cb 0.10 -1.51 0.25 0.00 0.02 0.00 0.00 35.03 33.89 3abk n LYS 23 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 3abk h GLY 24 N 4.26 0.00 0.00 3.14 0.00 -1.87 -3.45 103.07 105.15 3abk h GLY 24 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3abk h GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3abk n GLY 25 N 1.25 0.56 0.33 4.60 0.00 -1.09 -4.84 105.19 106.00 3abk n GLY 25 Ca 0.04 -2.18 0.08 0.00 0.00 0.00 0.00 46.02 43.97 3abk n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abk h ALA 26 N 0.00 1.89 -0.97 4.61 0.00 -1.97 -1.78 119.26 121.05 3abk h ALA 26 Ca 0.00 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3abk h ALA 26 Cb 0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 3abk h ALA 26 CO 0.00 0.03 0.64 1.15 0.00 0.00 0.00 179.25 181.07 3abk h THR 27 N 0.43 1.25 -0.83 0.00 2.02 -1.96 -1.00 112.91 112.82 3abk h THR 27 Ca 0.20 -0.46 0.10 0.00 0.77 0.00 0.00 66.41 67.01 3abk h THR 27 Cb 0.25 -0.17 -0.07 0.00 -1.74 0.00 0.00 68.15 66.42 3abk h THR 27 CO -0.05 0.24 0.47 0.44 0.37 0.00 0.00 175.52 176.99 3abk h ASP 28 N 1.32 0.67 -0.41 4.18 5.19 -1.63 -1.31 116.42 124.42 3abk h ASP 28 Ca 0.35 0.05 -0.05 0.00 -0.62 0.00 0.00 57.03 56.76 3abk h ASP 28 Cb -0.14 -0.08 -0.02 0.00 0.18 0.00 0.00 39.33 39.27 3abk h ASP 28 CO -0.08 0.38 0.06 0.78 -3.12 0.00 0.00 179.24 177.26 3abk h ASN 29 N 0.79 0.67 -0.43 6.45 2.35 -1.21 -0.57 115.58 123.61 3abk h ASN 29 Ca 0.40 -0.27 -0.05 0.00 -0.55 0.00 0.00 56.30 55.83 3abk h ASN 29 Cb 0.37 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.55 3abk h ASN 29 CO -0.25 0.76 0.08 0.40 -1.65 0.00 0.00 177.43 176.77 3abk h ILE 30 N 0.54 1.24 -0.26 2.81 5.03 -0.70 -1.98 117.51 124.19 3abk h ILE 30 Ca 0.12 -0.87 -0.03 0.00 -0.12 0.00 0.00 64.86 63.96 3abk h ILE 30 Cb 0.39 0.97 -0.01 0.00 -3.03 0.00 0.00 36.82 35.14 3abk h ILE 30 CO 0.01 0.30 0.04 0.25 -0.68 0.00 0.00 178.15 178.07 3abk h LEU 31 N 0.58 0.42 -0.50 1.44 5.85 -1.12 0.47 115.31 122.43 3abk h LEU 31 Ca 0.13 -0.27 0.10 0.00 0.84 0.00 0.00 57.88 58.69 3abk h LEU 31 Cb 0.37 -0.11 -0.09 0.00 0.37 0.00 0.00 40.66 41.19 3abk h LEU 31 CO 0.01 0.58 -0.10 0.22 -0.34 0.00 0.00 178.44 178.80 3abk h TYR 32 N 0.24 -0.23 -0.57 1.25 3.20 -1.08 0.38 116.97 120.16 3abk h TYR 32 Ca 0.08 0.04 -0.10 0.00 3.14 0.00 0.00 58.73 61.89 3abk h TYR 32 Cb 0.34 0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.77 3abk h TYR 32 CO 0.02 -0.20 -0.04 0.00 -1.64 0.00 0.00 178.16 176.30 3abk h ARG 33 N 0.02 1.03 -0.56 1.82 3.08 -1.06 -0.16 114.38 118.54 3abk h ARG 33 Ca 0.25 -0.34 -0.05 0.00 0.07 0.00 0.00 59.98 59.91 3abk h ARG 33 Cb 0.38 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 3abk h ARG 33 CO -0.50 1.03 0.16 0.28 -1.07 0.00 0.00 179.97 179.86 3abk h VAL 34 N 0.93 1.24 0.33 2.04 2.07 -0.45 -0.56 116.25 121.84 3abk h VAL 34 Ca 0.16 -0.84 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 3abk h VAL 34 Cb 0.60 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 3abk h VAL 34 CO 0.04 0.31 -0.16 0.74 0.02 0.00 0.00 177.57 178.52 3abk h THR 35 N 0.79 0.67 -0.40 2.57 2.02 -0.71 -1.26 112.91 116.59 3abk h THR 35 Ca 0.18 -0.50 -0.01 0.00 0.77 0.00 0.00 66.41 66.85 3abk h THR 35 Cb 0.31 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 3abk h THR 35 CO -0.00 0.10 0.21 -0.03 0.37 0.00 0.00 175.52 176.16 3abk h MET 36 N -0.73 0.54 -0.17 6.66 -1.53 -1.08 -0.59 114.93 118.02 3abk h MET 36 Ca -0.05 -0.05 -0.02 0.00 -3.44 0.00 0.00 59.70 56.15 3abk h MET 36 Cb 0.50 -0.11 -0.01 0.00 -0.55 0.00 0.00 31.60 31.43 3abk h MET 36 CO 0.07 0.40 0.04 1.15 0.14 0.00 0.00 176.91 178.71 3abk h THR 37 N 0.55 1.21 -0.59 -0.77 2.02 -0.94 -0.63 112.91 113.76 3abk h THR 37 Ca 0.14 -0.68 -0.03 0.00 0.77 0.00 0.00 66.41 66.61 3abk h THR 37 Cb 0.02 1.33 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 3abk h THR 37 CO -0.02 0.21 0.25 -0.07 0.37 0.00 0.00 175.52 176.25 3abk h LEU 38 N 0.08 0.80 -0.55 2.58 3.38 -0.96 0.46 115.31 121.11 3abk h LEU 38 Ca 0.05 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 3abk h LEU 38 Cb 0.28 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3abk h LEU 38 CO 0.00 0.74 0.18 0.00 0.09 0.00 0.00 178.44 179.45 3abk h LEU 40 N 0.76 0.30 -0.71 0.00 3.38 -0.89 0.61 115.31 118.77 3abk h LEU 40 Ca 0.18 -0.85 0.06 0.00 0.09 0.00 0.00 57.88 57.36 3abk h LEU 40 Cb 0.27 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.87 3abk h LEU 40 CO -0.01 1.12 0.40 1.23 0.09 0.00 0.00 178.44 181.27 3abk h GLY 41 N -0.47 1.04 1.80 0.83 0.00 -0.15 -0.96 103.07 105.16 3abk h GLY 41 Ca -0.06 -0.28 -0.15 0.00 0.00 0.00 0.00 47.33 46.84 3abk h GLY 41 CO 0.08 0.17 -0.62 -1.33 0.00 0.00 0.00 176.54 174.84 3abk h GLY 42 N 0.73 0.22 1.55 4.60 0.00 -0.82 -1.22 103.07 108.13 3abk h GLY 42 Ca 0.32 -0.28 -0.09 0.00 0.00 0.00 0.00 47.33 47.28 3abk h GLY 42 CO -0.19 0.25 -0.18 -0.84 0.00 0.00 0.00 176.54 175.59 3abk h THR 43 N 0.15 1.25 -0.19 4.70 2.02 -0.53 0.82 112.91 121.13 3abk h THR 43 Ca -0.01 -1.15 -0.19 0.00 0.77 0.00 0.00 66.41 65.83 3abk h THR 43 Cb 1.12 1.22 0.00 0.00 -1.74 0.00 0.00 68.15 68.75 3abk h THR 43 CO 0.09 0.38 -0.65 -0.07 0.37 0.00 0.00 175.52 175.64 3abk h LEU 44 N 0.49 0.81 -0.88 2.58 3.38 -0.70 -2.66 115.31 118.34 3abk h LEU 44 Ca 0.08 -0.48 -0.11 0.00 0.09 0.00 0.00 57.88 57.46 3abk h LEU 44 Cb 0.59 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3abk h LEU 44 CO 0.04 1.25 -0.39 0.22 0.09 0.00 0.00 178.44 179.65 3abk h TYR 45 N 0.52 0.41 -0.56 1.13 3.20 -0.90 -2.13 116.97 118.62 3abk h TYR 45 Ca -0.01 -0.11 -0.03 0.00 3.14 0.00 0.00 58.73 61.72 3abk h TYR 45 Cb 1.24 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 39.39 3abk h TYR 45 CO 0.07 0.69 0.24 0.66 -1.64 0.00 0.00 178.16 178.17 3abk h SER 46 N 0.29 0.74 -0.44 -2.11 4.64 -0.61 -0.73 113.55 115.33 3abk h SER 46 Ca 0.03 -0.09 -0.12 0.00 -0.47 0.00 0.00 61.79 61.14 3abk h SER 46 Cb 0.82 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.70 3abk h SER 46 CO 0.07 0.66 -0.17 -0.07 -0.87 0.00 0.00 176.83 176.44 3abk h LEU 47 N 0.80 0.94 -0.00 5.97 3.38 -1.14 -0.97 115.31 124.30 3abk h LEU 47 Ca 0.19 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.85 3abk h LEU 47 Cb 0.14 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 3abk h LEU 47 CO -0.02 1.09 -0.12 0.22 0.09 0.00 0.00 178.44 179.71 3abk h TYR 48 N 0.82 -0.30 -0.55 1.13 3.20 -1.02 -0.72 116.97 119.53 3abk h TYR 48 Ca 0.12 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.03 3abk h TYR 48 Cb 0.72 0.13 -0.03 0.00 1.54 0.00 0.00 36.73 39.09 3abk h TYR 48 CO 0.04 -0.18 0.37 0.00 -1.64 0.00 0.00 178.16 176.76 3abk h LEU 50 N 0.66 0.99 -0.18 0.00 6.46 -0.82 0.83 115.31 123.25 3abk h LEU 50 Ca 0.22 -0.43 0.05 0.00 -0.12 0.00 0.00 57.88 57.60 3abk h LEU 50 Cb 0.05 -0.28 -0.05 0.00 -0.73 0.00 0.00 40.66 39.65 3abk h LEU 50 CO -0.06 1.21 -0.15 1.23 -0.62 0.00 0.00 178.44 180.06 3abk h GLY 51 N 0.78 -0.02 0.82 3.75 0.00 -0.38 0.14 103.07 108.16 3abk h GLY 51 Ca 0.08 0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.60 3abk h GLY 51 CO 0.08 -0.15 -0.19 -0.25 0.00 0.00 0.00 176.54 176.02 3abk h TRP 52 N -0.16 -0.50 0.00 5.60 7.01 -0.84 -2.93 115.95 124.12 3abk h TRP 52 Ca 0.11 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.11 3abk h TRP 52 Cb 0.32 0.19 0.00 0.00 -2.10 0.00 0.00 29.16 27.57 3abk h TRP 52 CO -0.29 -0.29 0.00 0.00 -2.79 0.00 0.00 178.44 175.07 3abk n ALA 53 N -2.41 2.00 0.64 2.65 0.00 0.26 -2.98 120.51 120.68 3abk n ALA 53 Ca -0.09 -0.06 0.10 0.00 0.00 0.00 0.00 53.44 53.39 3abk n ALA 53 Cb 0.23 -1.37 0.41 0.00 0.00 0.00 0.00 19.45 18.73 3abk n ALA 53 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3abk n SER 54 N -1.61 0.07 -4.20 0.00 7.64 0.46 -4.79 113.62 111.20 3abk n SER 54 Ca 0.05 0.51 -0.24 0.00 1.01 0.00 0.00 58.87 60.21 3abk n SER 54 Cb 0.27 -0.53 -0.14 0.00 -1.01 0.00 0.00 64.21 62.80 3abk n SER 54 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3abk s PHE 55 N -3.03 1.56 0.32 1.43 0.08 -1.16 -5.10 117.98 112.09 3abk s PHE 55 Ca 0.09 -0.35 -0.29 0.00 0.12 0.00 0.00 56.93 56.51 3abk s PHE 55 Cb 0.12 -0.95 -0.10 0.00 -0.57 0.00 0.00 43.02 41.53 3abk s PHE 55 CO 0.36 0.05 1.25 -1.25 -0.10 0.00 0.00 175.22 175.53 3abk s PRO 56 N -0.99 4.40 -0.51 0.24 0.04 -1.26 -4.91 135.00 132.00 3abk s PRO 56 Ca 0.05 2.10 0.02 0.00 0.04 0.00 0.00 61.00 63.21 3abk s PRO 56 Cb -0.08 -3.07 0.53 0.00 0.04 0.00 0.00 34.50 31.92 3abk s PRO 56 CO 0.01 -0.10 1.84 0.72 0.04 0.00 0.00 177.00 179.51 3abk n HIS 57 N 0.84 2.86 0.00 0.56 8.25 -1.26 -5.15 115.22 121.32 3abk n HIS 57 Ca -0.00 -2.37 0.00 0.00 -0.26 0.00 0.00 57.72 55.09 3abk n HIS 57 Cb 0.43 -1.05 0.00 0.00 1.12 0.00 0.00 29.99 30.48 3abk n HIS 57 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61