#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f4m h THR 2 N 0.00 0.04 -0.68 2.61 1.35 -2.05 -1.93 112.91 112.25 1f4m h THR 2 Ca 0.00 -0.26 0.05 0.00 -0.55 0.00 0.00 66.41 65.65 1f4m h THR 2 Cb 0.00 1.25 -0.05 0.00 -1.73 0.00 0.00 68.15 67.62 1f4m h THR 2 CO 0.00 0.01 0.39 0.50 -0.25 0.00 0.00 175.52 176.16 1f4m h LYS 3 N 0.00 0.70 -0.25 4.72 3.64 -2.05 0.47 116.57 123.80 1f4m h LYS 3 Ca -0.00 -0.04 -0.18 0.00 -1.27 0.00 0.00 60.65 59.16 1f4m h LYS 3 Cb 0.25 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1f4m h LYS 3 CO 0.00 0.46 -0.55 1.96 -2.27 0.00 0.00 179.45 179.06 1f4m h GLN 4 N 0.72 0.74 -0.55 1.90 1.08 -1.80 -2.41 115.11 114.80 1f4m h GLN 4 Ca 0.30 -0.47 -0.05 0.00 -1.45 0.00 0.00 58.65 56.98 1f4m h GLN 4 Cb 0.16 0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.62 1f4m h GLN 4 CO -0.17 1.09 0.16 0.93 -0.95 0.00 0.00 178.83 179.90 1f4m h GLU 5 N 0.57 0.86 -0.70 1.46 5.08 -1.16 -1.48 114.58 119.21 1f4m h GLU 5 Ca 0.01 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.11 1f4m h GLU 5 Cb 1.13 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.23 1f4m h GLU 5 CO 0.11 0.79 0.16 0.87 -1.00 0.00 0.00 179.01 179.95 1f4m h LYS 6 N 0.77 1.13 0.10 2.33 1.57 -0.01 -1.01 116.57 121.44 1f4m h LYS 6 Ca 0.18 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 1f4m h LYS 6 Cb 0.29 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1f4m h LYS 6 CO -0.00 1.00 -0.05 1.15 -0.57 0.00 0.00 179.45 180.97 1f4m h THR 7 N 1.07 1.03 -0.36 -0.16 2.02 -1.26 0.85 112.91 116.09 1f4m h THR 7 Ca 0.22 -0.49 0.06 0.00 0.77 0.00 0.00 66.41 66.97 1f4m h THR 7 Cb 0.38 1.34 -0.06 0.00 -1.74 0.00 0.00 68.15 68.08 1f4m h THR 7 CO 0.00 0.12 0.02 0.40 0.37 0.00 0.00 175.52 176.43 1f4m h ILE 8 N -0.37 0.75 -0.10 3.11 2.04 -1.13 0.64 117.51 122.46 1f4m h ILE 8 Ca -0.01 -0.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.76 1f4m h ILE 8 Cb 0.30 0.62 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1f4m h ILE 8 CO 0.02 0.02 -0.10 -0.07 0.00 0.00 0.00 178.15 178.03 1f4m h LEU 9 N 0.12 0.26 -0.60 1.44 3.38 -1.16 -2.11 115.31 116.65 1f4m h LEU 9 Ca 0.17 -0.48 -0.15 0.00 0.09 0.00 0.00 57.88 57.52 1f4m h LEU 9 Cb 0.23 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1f4m h LEU 9 CO -0.28 0.68 -0.49 0.78 0.09 0.00 0.00 178.44 179.23 1f4m h ASN 10 N -0.16 0.57 -0.04 -0.43 2.35 -0.75 -2.52 115.58 114.60 1f4m h ASN 10 Ca 0.02 -0.28 -0.05 0.00 -0.55 0.00 0.00 56.30 55.43 1f4m h ASN 10 Cb 0.61 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.82 1f4m h ASN 10 CO 0.02 0.97 -0.18 0.24 -1.65 0.00 0.00 177.43 176.83 1f4m h MET 11 N 0.41 0.19 -0.99 0.81 2.86 -0.95 -1.38 114.93 115.89 1f4m h MET 11 Ca 0.02 -0.15 0.09 0.00 -2.06 0.00 0.00 59.70 57.60 1f4m h MET 11 Cb 1.01 0.03 -0.08 0.00 0.06 0.00 0.00 31.60 32.62 1f4m h MET 11 CO 0.09 0.80 0.63 0.00 1.06 0.00 0.00 176.91 179.49 1f4m h ALA 12 N 0.40 1.44 0.01 6.32 0.00 -1.43 0.19 119.26 126.18 1f4m h ALA 12 Ca -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1f4m h ALA 12 Cb 0.82 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1f4m h ALA 12 CO 0.04 0.32 -0.00 -0.09 0.00 0.00 0.00 179.25 179.51 1f4m h ARG 13 N 1.07 -0.01 -0.17 0.00 2.43 -1.44 -3.07 114.38 113.19 1f4m h ARG 13 Ca 0.46 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.60 1f4m h ARG 13 Cb 0.34 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1f4m h ARG 13 CO -0.22 0.33 -0.04 0.35 -1.51 0.00 0.00 179.97 178.88 1f4m h PHE 14 N -0.35 0.25 -0.16 2.20 3.04 -0.49 -2.30 116.94 119.13 1f4m h PHE 14 Ca -0.00 -0.02 -0.07 0.00 3.98 0.00 0.00 57.97 61.87 1f4m h PHE 14 Cb 0.34 -0.08 -0.01 0.00 2.56 0.00 0.00 35.95 38.76 1f4m h PHE 14 CO 0.04 0.29 -0.21 0.82 -2.02 0.00 0.00 178.31 177.24 1f4m h ILE 15 N 0.24 1.22 -0.22 1.41 2.04 -0.62 -2.01 117.51 119.58 1f4m h ILE 15 Ca 0.06 -1.02 0.03 0.00 1.00 0.00 0.00 64.86 64.93 1f4m h ILE 15 Cb 0.23 1.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 1f4m h ILE 15 CO 0.01 0.31 0.04 0.03 0.00 0.00 0.00 178.15 178.54 1f4m h ARG 16 N 0.25 0.12 -0.37 2.37 3.08 -1.32 0.15 114.38 118.66 1f4m h ARG 16 Ca 0.04 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.03 1f4m h ARG 16 Cb 0.51 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 1f4m h ARG 16 CO 0.03 0.08 0.02 0.66 -1.07 0.00 0.00 179.97 179.69 1f4m h SER 17 N 0.13 0.63 -0.65 7.04 4.64 -1.54 -2.29 113.55 121.51 1f4m h SER 17 Ca 0.10 -0.29 0.07 0.00 -0.47 0.00 0.00 61.79 61.19 1f4m h SER 17 Cb 0.10 -0.17 -0.06 0.00 -0.31 0.00 0.00 62.40 61.96 1f4m h SER 17 CO -0.13 0.77 0.34 1.56 -0.87 0.00 0.00 176.83 178.50 1f4m h GLN 18 N 0.47 0.60 -0.98 4.77 4.20 -1.05 0.33 115.11 123.44 1f4m h GLN 18 Ca 0.11 -0.04 0.06 0.00 0.06 0.00 0.00 58.65 58.85 1f4m h GLN 18 Cb 0.44 -0.13 -0.07 0.00 0.30 0.00 0.00 27.48 28.02 1f4m h GLN 18 CO 0.02 0.39 0.63 0.00 -0.67 0.00 0.00 178.83 179.20 1f4m h ALA 19 N 1.37 1.36 -0.02 3.87 0.00 -0.48 -1.68 119.26 123.68 1f4m h ALA 19 Ca 0.30 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 55.03 1f4m h ALA 19 Cb 0.24 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1f4m h ALA 19 CO -0.21 0.42 -0.71 -0.07 0.00 0.00 0.00 179.25 178.67 1f4m h LEU 20 N 1.15 0.13 -1.27 0.00 4.07 -0.66 -0.87 115.31 117.85 1f4m h LEU 20 Ca 0.42 -0.09 -0.07 0.00 0.08 0.00 0.00 57.88 58.22 1f4m h LEU 20 Cb 0.16 -0.04 -0.01 0.00 1.08 0.00 0.00 40.66 41.85 1f4m h LEU 20 CO -0.17 0.80 -0.31 0.74 -1.08 0.00 0.00 178.44 178.42 1f4m h THR 21 N 0.07 1.24 0.02 0.22 2.02 -0.24 -1.48 112.91 114.77 1f4m h THR 21 Ca -0.02 -1.15 -0.18 0.00 0.77 0.00 0.00 66.41 65.83 1f4m h THR 21 Cb 1.26 1.55 0.02 0.00 -1.74 0.00 0.00 68.15 69.24 1f4m h THR 21 CO 0.10 0.34 -0.73 0.40 0.37 0.00 0.00 175.52 175.99 1f4m h ILE 22 N 0.08 1.41 -0.89 3.11 2.04 -1.06 -2.83 117.51 119.37 1f4m h ILE 22 Ca 0.01 -2.18 0.09 0.00 1.00 0.00 0.00 64.86 63.78 1f4m h ILE 22 Cb 0.59 2.65 -0.06 0.00 -0.74 0.00 0.00 36.82 39.26 1f4m h ILE 22 CO 0.04 0.64 0.58 0.25 0.00 0.00 0.00 178.15 179.66 1f4m h LEU 23 N -0.04 0.82 -0.26 1.44 5.85 -0.93 0.14 115.31 122.33 1f4m h LEU 23 Ca -0.10 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.53 1f4m h LEU 23 Cb 1.45 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 1f4m h LEU 23 CO 0.14 0.49 -0.27 -0.33 -0.34 0.00 0.00 178.44 178.13 1f4m h GLU 24 N 0.91 0.64 0.00 1.25 4.39 -1.29 -2.07 114.58 118.42 1f4m h GLU 24 Ca 0.41 -0.34 -0.06 0.00 0.34 0.00 0.00 59.36 59.70 1f4m h GLU 24 Cb 0.37 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 1f4m h GLU 24 CO -0.17 0.95 -0.29 0.87 -1.16 0.00 0.00 179.01 179.21 1f4m h LYS 25 N 0.36 0.00 0.10 2.33 1.57 -1.18 -2.74 116.57 117.01 1f4m h LYS 25 Ca 0.04 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1f4m h LYS 25 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.15 1f4m h LYS 25 CO 0.07 0.29 -0.05 0.00 -0.57 0.00 0.00 179.45 179.19 1f4m h ALA 26 N 1.71 -0.13 0.00 3.86 0.00 -0.61 -2.65 119.26 121.44 1f4m h ALA 26 Ca -0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1f4m h ALA 26 Cb 0.72 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1f4m h ALA 26 CO 0.04 -0.34 -0.06 -0.91 0.00 0.00 0.00 179.25 177.98 1f4m h ASN 27 N -0.60 0.00 0.03 0.00 2.35 -1.31 0.30 115.58 116.35 1f4m h ASN 27 Ca -0.01 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1f4m h ASN 27 Cb 0.48 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1f4m h ASN 27 CO 0.02 0.06 -0.02 -0.33 -1.65 0.00 0.00 177.43 175.51 1f4m h GLU 28 N 0.00 -0.04 0.00 0.81 5.08 -1.41 -2.71 114.58 116.31 1f4m h GLU 28 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1f4m h GLU 28 Cb 0.11 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1f4m h GLU 28 CO 0.01 0.24 0.00 1.28 -1.00 0.00 0.00 179.01 179.54 1f4m n LEU 29 N -4.97 0.00 -1.54 1.33 4.77 -0.63 -4.87 117.00 111.09 1f4m n LEU 29 Ca -0.08 0.08 -0.16 0.00 -0.03 0.00 0.00 56.01 55.82 1f4m n LEU 29 Cb 0.17 -0.08 -0.04 0.00 -2.33 0.00 0.00 43.42 41.13 1f4m n LEU 29 CO 0.33 -0.01 -0.18 -0.67 -1.33 0.00 0.00 177.39 175.53 1f4m n ASP 30 N -1.08 -4.94 -4.55 -1.43 2.03 0.86 -4.89 116.55 102.54 1f4m n ASP 30 Ca 0.19 0.22 -0.43 0.00 0.52 0.00 0.00 54.79 55.29 1f4m n ASP 30 Cb 0.13 -3.96 -0.01 0.00 -0.72 0.00 0.00 41.12 36.55 1f4m n ASP 30 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1f4m s ALA 31 N -2.71 3.21 0.33 -1.67 0.00 -0.09 -4.83 121.76 116.00 1f4m s ALA 31 Ca 0.00 -2.75 0.21 0.00 0.00 0.00 0.00 51.96 49.42 1f4m s ALA 31 Cb 0.00 -4.49 1.06 0.00 0.00 0.00 0.00 23.12 19.69 1f4m s ALA 31 CO 0.00 -3.31 1.92 -0.44 0.00 0.00 0.00 175.76 173.93 1f4m h ASP 32 N 8.35 0.00 0.00 0.00 3.32 -1.90 -1.18 116.42 125.01 1f4m h ASP 32 Ca 0.33 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.18 1f4m h ASP 32 Cb 0.93 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.49 1f4m h ASP 32 CO 1.39 0.24 -0.76 -0.33 -1.72 0.00 0.00 179.24 178.06 1f4m h GLU 33 N 0.00 0.51 -0.57 3.56 5.08 -1.98 -2.12 114.58 119.06 1f4m h GLU 33 Ca -0.00 -0.55 -0.07 0.00 -1.00 0.00 0.00 59.36 57.73 1f4m h GLU 33 Cb 0.55 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 1f4m h GLU 33 CO 0.03 1.19 0.05 0.82 -1.00 0.00 0.00 179.01 180.10 1f4m h ILE 34 N 0.06 1.25 -0.22 3.13 2.04 -1.95 -2.64 117.51 119.18 1f4m h ILE 34 Ca -0.10 -1.01 0.02 0.00 1.00 0.00 0.00 64.86 64.77 1f4m h ILE 34 Cb 1.46 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 38.28 1f4m h ILE 34 CO 0.15 0.37 0.09 0.00 0.00 0.00 0.00 178.15 178.76 1f4m h ALA 35 N 1.18 0.25 -0.72 1.87 0.00 -1.16 -0.92 119.26 119.76 1f4m h ALA 35 Ca 0.17 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1f4m h ALA 35 Cb 0.44 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1f4m h ALA 35 CO 0.02 -0.33 0.39 -0.44 0.00 0.00 0.00 179.25 178.89 1f4m h ASP 36 N 0.20 0.90 -0.45 0.00 3.32 -1.19 -1.63 116.42 117.57 1f4m h ASP 36 Ca 0.10 -0.10 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 1f4m h ASP 36 Cb 0.05 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1f4m h ASP 36 CO -0.09 0.73 -0.22 0.40 -1.72 0.00 0.00 179.24 178.34 1f4m h ILE 37 N 0.99 1.27 -0.62 0.35 2.04 -1.28 -1.90 117.51 118.36 1f4m h ILE 37 Ca 0.25 -1.39 -0.02 0.00 1.00 0.00 0.00 64.86 64.71 1f4m h ILE 37 Cb 0.04 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 1f4m h ILE 37 CO -0.04 0.48 0.30 0.00 0.00 0.00 0.00 178.15 178.89 1f4m h ALA 38 N 0.90 1.37 0.21 1.87 0.00 -0.84 0.20 119.26 122.97 1f4m h ALA 38 Ca 0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1f4m h ALA 38 Cb 0.80 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1f4m h ALA 38 CO 0.07 0.50 -0.10 1.49 0.00 0.00 0.00 179.25 181.20 1f4m h GLU 39 N 0.87 -0.27 -0.67 0.00 4.57 -1.05 -0.95 114.58 117.08 1f4m h GLU 39 Ca 0.22 0.02 0.13 0.00 -1.18 0.00 0.00 59.36 58.54 1f4m h GLU 39 Cb 0.08 0.06 -0.09 0.00 -0.16 0.00 0.00 28.75 28.64 1f4m h GLU 39 CO -0.03 -0.04 0.19 1.03 -1.18 0.00 0.00 179.01 178.97 1f4m h SER 40 N -0.47 0.08 -0.47 1.04 0.87 -0.50 0.67 113.55 114.77 1f4m h SER 40 Ca -0.03 0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 1f4m h SER 40 Cb 0.36 0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.44 1f4m h SER 40 CO 0.05 0.03 0.24 0.40 -0.53 0.00 0.00 176.83 177.01 1f4m h ILE 41 N 0.31 1.18 -0.76 2.23 2.04 -0.49 0.13 117.51 122.15 1f4m h ILE 41 Ca 0.36 -0.50 0.10 0.00 1.00 0.00 0.00 64.86 65.83 1f4m h ILE 41 Cb 0.56 0.64 -0.08 0.00 -0.74 0.00 0.00 36.82 37.21 1f4m h ILE 41 CO -0.43 0.20 0.39 -0.74 0.00 0.00 0.00 178.15 177.58 1f4m h HIS 42 N 0.62 0.70 -0.04 1.37 2.76 0.40 0.17 115.15 121.12 1f4m h HIS 42 Ca 0.16 0.03 -0.13 0.00 -2.20 0.00 0.00 60.37 58.24 1f4m h HIS 42 Cb 0.10 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 28.84 1f4m h HIS 42 CO -0.01 0.25 -0.56 -0.44 -1.30 0.00 0.00 177.93 175.87 1f4m h ASP 43 N 0.65 0.14 0.10 3.26 3.32 0.03 -1.43 116.42 122.48 1f4m h ASP 43 Ca 0.38 -0.08 -0.29 0.00 0.02 0.00 0.00 57.03 57.06 1f4m h ASP 43 Cb 0.41 -0.04 0.03 0.00 0.22 0.00 0.00 39.33 39.95 1f4m h ASP 43 CO -0.28 0.67 -1.18 0.45 -1.72 0.00 0.00 179.24 177.19 1f4m h HIS 44 N 0.10 1.02 -0.60 4.55 3.86 0.04 -2.84 115.15 121.28 1f4m h HIS 44 Ca -0.00 -0.61 -0.06 0.00 -1.16 0.00 0.00 60.37 58.54 1f4m h HIS 44 Cb 1.02 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 29.37 1f4m h HIS 44 CO 0.01 1.45 0.14 0.00 0.86 0.00 0.00 177.93 180.38 1f4m h ALA 45 N 0.34 0.79 -0.92 2.45 0.00 -0.66 -1.39 119.26 119.87 1f4m h ALA 45 Ca -0.17 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.53 1f4m h ALA 45 Cb 1.84 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 19.36 1f4m h ALA 45 CO 0.23 0.51 0.61 0.22 0.00 0.00 0.00 179.25 180.81 1f4m h ASP 46 N 0.88 1.03 -0.64 0.00 -0.00 -1.31 0.12 116.42 116.50 1f4m h ASP 46 Ca 0.19 -0.02 -0.03 0.00 -0.00 0.00 0.00 57.03 57.17 1f4m h ASP 46 Cb 0.37 -0.25 -0.03 0.00 -0.00 0.00 0.00 39.33 39.42 1f4m h ASP 46 CO 0.00 0.73 0.30 -0.08 -0.00 0.00 0.00 179.24 180.20 1f4m h GLU 47 N 1.21 0.92 -0.64 0.28 4.57 -1.19 0.16 114.58 119.90 1f4m h GLU 47 Ca 0.35 -0.14 -0.03 0.00 -1.18 0.00 0.00 59.36 58.36 1f4m h GLU 47 Cb -0.09 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.31 1f4m h GLU 47 CO -0.09 0.74 0.29 0.82 -1.18 0.00 0.00 179.01 179.59 1f4m h ILE 48 N 0.88 1.23 -0.59 2.32 2.04 -0.54 0.24 117.51 123.08 1f4m h ILE 48 Ca 0.22 -0.67 -0.02 0.00 1.00 0.00 0.00 64.86 65.38 1f4m h ILE 48 Cb 0.13 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 36.66 1f4m h ILE 48 CO -0.03 0.27 0.28 0.22 0.00 0.00 0.00 178.15 178.89 1f4m h TYR 49 N 0.90 0.87 -0.21 1.37 3.20 -0.11 0.68 116.97 123.66 1f4m h TYR 49 Ca 0.22 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 62.00 1f4m h TYR 49 Cb 0.16 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 1f4m h TYR 49 CO 0.01 0.67 -0.04 0.00 -1.64 0.00 0.00 178.16 177.16 1f4m h ARG 50 N 0.81 0.40 -0.96 1.82 3.08 -0.46 -1.68 114.38 117.40 1f4m h ARG 50 Ca 0.20 -0.15 0.03 0.00 0.07 0.00 0.00 59.98 60.14 1f4m h ARG 50 Cb 0.13 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.10 1f4m h ARG 50 CO -0.02 0.63 0.63 0.77 -1.07 0.00 0.00 179.97 180.91 1f4m h SER 51 N 0.14 1.06 0.44 7.04 0.02 -0.72 -2.55 113.55 118.96 1f4m h SER 51 Ca 0.06 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 1f4m h SER 51 Cb 0.47 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.77 1f4m h SER 51 CO 0.02 0.74 -0.21 0.00 -1.14 0.00 0.00 176.83 176.23 1f4m h ALA 52 N 1.43 -0.76 -0.83 3.77 0.00 -0.76 -1.77 119.26 120.33 1f4m h ALA 52 Ca 0.37 -0.13 0.24 0.00 0.00 0.00 0.00 54.91 55.40 1f4m h ALA 52 Cb -0.03 0.23 -0.15 0.00 0.00 0.00 0.00 17.79 17.83 1f4m h ALA 52 CO -0.11 -0.72 0.08 1.28 0.00 0.00 0.00 179.25 179.78 1f4m n LEU 53 N -4.35 -0.04 0.04 0.00 4.77 -0.64 -0.47 117.00 116.31 1f4m n LEU 53 Ca -0.07 1.40 -0.02 0.00 -0.03 0.00 0.00 56.01 57.29 1f4m n LEU 53 Cb 0.23 -0.53 -0.01 0.00 -2.33 0.00 0.00 43.42 40.78 1f4m n LEU 53 CO 0.18 -1.44 0.33 0.00 -1.33 0.00 0.00 177.39 175.13 1f4m h ALA 54 N 1.66 -0.69 -0.84 -1.18 0.00 -1.46 -3.33 119.26 113.42 1f4m h ALA 54 Ca 0.53 -0.02 0.18 0.00 0.00 0.00 0.00 54.91 55.60 1f4m h ALA 54 Cb 1.15 0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.87 1f4m h ALA 54 CO -0.76 -0.68 0.34 -0.09 0.00 0.00 0.00 179.25 178.06 1f4m h ARG 55 N -0.15 0.41 -0.02 0.00 2.43 -0.31 -3.52 114.38 113.21 1f4m h ARG 55 Ca -0.01 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1f4m h ARG 55 Cb 0.08 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1f4m h ARG 55 CO 0.02 0.27 0.00 1.19 -1.51 0.00 0.00 179.97 179.94