#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rpr s THR 2 N 0.00 0.61 -0.13 2.03 2.01 -1.26 -5.02 115.64 113.87 1rpr s THR 2 Ca 0.00 -2.00 0.17 0.00 0.31 0.00 0.00 61.69 60.17 1rpr s THR 2 Cb 0.00 -2.48 -0.10 0.00 0.01 0.00 0.00 72.50 69.92 1rpr s THR 2 CO 0.00 -0.14 0.91 0.07 -0.69 0.00 0.00 174.62 174.77 1rpr h LYS 3 N 2.47 0.00 -0.53 4.92 2.10 -2.07 -3.09 116.57 120.37 1rpr h LYS 3 Ca -0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.27 1rpr h LYS 3 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1rpr h LYS 3 CO 0.61 0.30 0.00 1.04 -2.00 0.00 0.00 179.45 179.40 1rpr n GLN 4 N -2.92 2.29 0.20 0.07 1.13 -1.26 -4.23 117.38 112.67 1rpr n GLN 4 Ca -0.08 -1.44 -0.08 0.00 -1.94 0.00 0.00 57.00 53.47 1rpr n GLN 4 Cb 0.81 -1.52 -0.04 0.00 0.11 0.00 0.00 30.24 29.60 1rpr n GLN 4 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 1rpr h GLU 5 N 2.12 -0.50 -0.88 -1.09 4.81 -1.94 0.38 114.58 117.48 1rpr h GLU 5 Ca 0.00 0.03 0.13 0.00 -0.13 0.00 0.00 59.36 59.40 1rpr h GLU 5 Cb 0.79 0.11 -0.07 0.00 0.63 0.00 0.00 28.75 30.21 1rpr h GLU 5 CO 0.10 -0.34 0.57 0.87 -0.73 0.00 0.00 179.01 179.48 1rpr h LYS 6 N -0.57 0.69 -0.36 1.92 1.79 -1.80 0.10 116.57 118.34 1rpr h LYS 6 Ca -0.05 -0.04 0.01 0.00 -2.18 0.00 0.00 60.65 58.39 1rpr h LYS 6 Cb 0.40 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 30.87 1rpr h LYS 6 CO 0.09 0.46 0.21 1.15 -1.08 0.00 0.00 179.45 180.28 1rpr h THR 7 N 0.71 1.04 -0.88 -0.16 2.02 -1.74 0.18 112.91 114.09 1rpr h THR 7 Ca 0.43 -0.15 0.01 0.00 0.77 0.00 0.00 66.41 67.47 1rpr h THR 7 Cb 0.66 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 67.59 1rpr h THR 7 CO -0.19 0.08 0.58 0.00 0.37 0.00 0.00 175.52 176.36 1rpr h ALA 8 N 1.16 1.38 0.00 6.16 0.00 0.14 0.16 119.26 128.26 1rpr h ALA 8 Ca 0.14 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1rpr h ALA 8 Cb -0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1rpr h ALA 8 CO -0.06 0.58 -0.25 1.25 0.00 0.00 0.00 179.25 180.77 1rpr h LEU 9 N 1.19 0.00 -1.32 0.00 5.85 -0.57 0.62 115.31 121.08 1rpr h LEU 9 Ca 0.32 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.98 1rpr h LEU 9 Cb -0.14 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1rpr h LEU 9 CO -0.07 0.25 -0.31 0.78 -0.34 0.00 0.00 178.44 178.75 1rpr h ASN 10 N 0.00 0.00 1.50 1.25 2.35 0.22 0.13 115.58 121.04 1rpr h ASN 10 Ca -0.00 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.65 1rpr h ASN 10 Cb 0.85 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.20 1rpr h ASN 10 CO 0.03 0.31 -0.50 0.24 -1.65 0.00 0.00 177.43 175.86 1rpr h MET 11 N 0.00 0.00 -0.02 0.81 2.86 -0.10 -2.82 114.93 115.66 1rpr h MET 11 Ca -0.00 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.57 1rpr h MET 11 Cb 0.65 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.30 1rpr h MET 11 CO 0.04 0.42 -0.32 0.00 1.06 0.00 0.00 176.91 178.11 1rpr h ALA 12 N 1.56 1.44 -0.24 6.32 0.00 0.14 0.11 119.26 128.59 1rpr h ALA 12 Ca -0.01 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1rpr h ALA 12 Cb 1.34 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1rpr h ALA 12 CO 0.06 0.42 0.15 -0.09 0.00 0.00 0.00 179.25 179.78 1rpr h ARG 13 N 0.03 0.32 -0.48 0.00 2.43 -0.88 0.14 114.38 115.95 1rpr h ARG 13 Ca 0.00 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 1rpr h ARG 13 Cb 0.58 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 1rpr h ARG 13 CO 0.04 0.23 0.02 0.35 -1.51 0.00 0.00 179.97 179.10 1rpr h PHE 14 N 0.33 0.81 -0.94 2.20 3.57 -0.81 -0.42 116.94 121.69 1rpr h PHE 14 Ca 0.09 -0.10 0.02 0.00 3.53 0.00 0.00 57.97 61.50 1rpr h PHE 14 Cb -0.02 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 38.45 1rpr h PHE 14 CO 0.00 0.74 0.62 0.82 -2.23 0.00 0.00 178.31 178.26 1rpr h ILE 15 N 0.73 1.21 -0.10 1.41 1.08 -0.55 0.18 117.51 121.47 1rpr h ILE 15 Ca 0.15 -0.43 0.02 0.00 -0.39 0.00 0.00 64.86 64.21 1rpr h ILE 15 Cb 0.41 -0.14 -0.02 0.00 -3.07 0.00 0.00 36.82 34.01 1rpr h ILE 15 CO 0.01 0.23 -0.03 -0.09 -0.69 0.00 0.00 178.15 177.58 1rpr h ARG 16 N 1.24 -0.00 -0.72 2.37 2.43 -0.57 -1.66 114.38 117.47 1rpr h ARG 16 Ca 0.35 0.00 0.12 0.00 -0.81 0.00 0.00 59.98 59.65 1rpr h ARG 16 Cb -0.10 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.41 1rpr h ARG 16 CO -0.09 -0.00 0.48 0.77 -1.51 0.00 0.00 179.97 179.62 1rpr h SER 17 N -0.00 0.44 -0.25 -3.80 0.02 0.67 0.27 113.55 110.90 1rpr h SER 17 Ca 0.05 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 1rpr h SER 17 Cb 0.08 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1rpr h SER 17 CO -0.10 0.24 0.09 1.56 -1.14 0.00 0.00 176.83 177.48 1rpr h GLN 18 N 0.47 0.37 0.00 3.45 4.20 0.18 -0.16 115.11 123.63 1rpr h GLN 18 Ca 0.34 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.98 1rpr h GLN 18 Cb 0.69 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.41 1rpr h GLN 18 CO -0.11 0.43 -0.02 1.15 -0.67 0.00 0.00 178.83 179.60 1rpr h THR 19 N 0.24 0.14 0.50 -0.54 2.02 -0.64 0.79 112.91 115.42 1rpr h THR 19 Ca 0.08 -0.23 -0.02 0.00 0.77 0.00 0.00 66.41 67.01 1rpr h THR 19 Cb 0.20 1.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1rpr h THR 19 CO -0.01 0.02 -0.24 0.25 0.37 0.00 0.00 175.52 175.91 1rpr h LEU 20 N 0.00 -0.57 -2.45 2.58 6.46 0.75 0.10 115.31 122.19 1rpr h LEU 20 Ca -0.00 -0.01 0.01 0.00 -0.12 0.00 0.00 57.88 57.77 1rpr h LEU 20 Cb 0.19 0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 40.27 1rpr h LEU 20 CO 0.00 -0.16 0.17 0.74 -0.62 0.00 0.00 178.44 178.57 1rpr h THR 21 N -1.16 0.13 0.23 1.05 2.02 -0.50 0.25 112.91 114.94 1rpr h THR 21 Ca -0.07 0.00 -0.34 0.00 0.77 0.00 0.00 66.41 66.77 1rpr h THR 21 Cb 0.54 0.84 0.03 0.00 -1.74 0.00 0.00 68.15 67.83 1rpr h THR 21 CO 0.11 0.00 -1.54 0.25 0.37 0.00 0.00 175.52 174.71 1rpr h LEU 22 N 0.00 0.77 0.31 2.58 5.85 -0.59 -3.14 115.31 121.09 1rpr h LEU 22 Ca 0.02 -0.93 -0.00 0.00 0.84 0.00 0.00 57.88 57.82 1rpr h LEU 22 Cb 0.36 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 1rpr h LEU 22 CO -0.00 1.73 -0.51 0.25 -0.34 0.00 0.00 178.44 179.57 1rpr h LEU 23 N 0.11 -1.47 -0.30 2.25 5.85 0.21 -0.01 115.31 121.96 1rpr h LEU 23 Ca -0.28 0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.63 1rpr h LEU 23 Cb 2.13 0.52 -0.05 0.00 0.37 0.00 0.00 40.66 43.63 1rpr h LEU 23 CO 0.24 -0.61 -0.01 1.05 -0.34 0.00 0.00 178.44 178.77 1rpr h GLU 24 N -0.88 0.07 -0.82 1.25 4.11 -1.55 -0.86 114.58 115.90 1rpr h GLU 24 Ca -0.03 -0.00 0.03 0.00 0.07 0.00 0.00 59.36 59.42 1rpr h GLU 24 Cb 0.82 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.00 1rpr h GLU 24 CO -0.17 0.05 0.53 0.87 0.07 0.00 0.00 179.01 180.36 1rpr h LYS 25 N 0.07 1.02 -0.77 1.06 1.79 -1.43 0.78 116.57 119.09 1rpr h LYS 25 Ca 0.14 -0.06 -0.03 0.00 -2.18 0.00 0.00 60.65 58.52 1rpr h LYS 25 Cb 0.20 -0.23 -0.03 0.00 -1.58 0.00 0.00 32.23 30.58 1rpr h LYS 25 CO -0.25 0.67 0.35 -0.07 -1.08 0.00 0.00 179.45 179.07 1rpr h LEU 26 N 1.05 1.03 -0.44 2.94 3.38 -0.41 0.51 115.31 123.37 1rpr h LEU 26 Ca 0.32 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 58.19 1rpr h LEU 26 Cb -0.02 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.42 1rpr h LEU 26 CO -0.10 0.89 0.20 -1.13 0.09 0.00 0.00 178.44 178.39 1rpr h ASN 27 N 1.10 0.26 0.42 -0.43 -0.73 0.25 0.19 115.58 116.63 1rpr h ASN 27 Ca 0.26 0.03 -0.04 0.00 1.87 0.00 0.00 56.30 58.43 1rpr h ASN 27 Cb 0.16 -0.01 -0.01 0.00 0.27 0.00 0.00 38.32 38.73 1rpr h ASN 27 CO -0.03 0.19 -0.18 -0.33 -0.37 0.00 0.00 177.43 176.71 1rpr h GLU 28 N 0.40 0.00 -0.90 6.67 5.08 -0.18 -1.13 114.58 124.53 1rpr h GLU 28 Ca 0.20 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.43 1rpr h GLU 28 Cb 0.13 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.31 1rpr h GLU 28 CO -0.16 0.18 0.16 1.28 -1.00 0.00 0.00 179.01 179.48 1rpr n LEU 29 N -3.76 4.13 -1.19 1.33 4.77 0.10 -4.81 117.00 117.58 1rpr n LEU 29 Ca -0.02 -2.14 -0.11 0.00 -0.03 0.00 0.00 56.01 53.72 1rpr n LEU 29 Cb 0.29 -0.63 -0.05 0.00 -2.33 0.00 0.00 43.42 40.70 1rpr n LEU 29 CO 0.33 0.61 -0.10 0.47 -1.33 0.00 0.00 177.39 177.36 1rpr n ASP 30 N -0.00 -3.34 -3.60 -1.43 9.92 -0.43 -4.78 116.55 112.88 1rpr n ASP 30 Ca 0.22 0.27 -0.41 0.00 -0.53 0.00 0.00 54.79 54.34 1rpr n ASP 30 Cb 0.91 -3.01 0.01 0.00 -0.64 0.00 0.00 41.12 38.39 1rpr n ASP 30 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1rpr n ALA 31 N 0.45 6.29 0.21 2.24 0.00 0.48 -4.65 120.51 125.53 1rpr n ALA 31 Ca -0.11 -4.43 0.08 0.00 0.00 0.00 0.00 53.44 48.98 1rpr n ALA 31 Cb 0.40 -2.41 0.43 0.00 0.00 0.00 0.00 19.45 17.88 1rpr n ALA 31 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1rpr h ASP 32 N 4.41 0.00 0.03 0.00 3.58 -1.82 0.10 116.42 122.72 1rpr h ASP 32 Ca 0.58 0.00 0.01 0.00 0.42 0.00 0.00 57.03 58.04 1rpr h ASP 32 Cb 0.33 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.37 1rpr h ASP 32 CO 1.29 0.28 -0.05 -0.33 -2.88 0.00 0.00 179.24 177.55 1rpr h GLU 33 N 0.00 -0.10 0.00 0.28 3.07 -1.93 0.89 114.58 116.78 1rpr h GLU 33 Ca -0.00 0.01 -0.05 0.00 -0.50 0.00 0.00 59.36 58.82 1rpr h GLU 33 Cb 0.76 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.68 1rpr h GLU 33 CO 0.04 -0.07 -0.22 1.96 -1.40 0.00 0.00 179.01 179.31 1rpr h GLN 34 N -0.11 0.00 -0.28 2.33 4.20 -1.83 -1.99 115.11 117.43 1rpr h GLN 34 Ca 0.01 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.67 1rpr h GLN 34 Cb 0.12 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1rpr h GLN 34 CO -0.04 0.22 -0.02 0.00 -0.67 0.00 0.00 178.83 178.32 1rpr h ALA 35 N 1.78 0.38 0.41 3.87 0.00 0.14 0.32 119.26 126.16 1rpr h ALA 35 Ca -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1rpr h ALA 35 Cb 0.54 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1rpr h ALA 35 CO 0.03 0.15 -0.38 0.22 0.00 0.00 0.00 179.25 179.27 1rpr h ASP 36 N 0.29 -1.02 -0.59 0.00 3.58 -0.21 0.38 116.42 118.84 1rpr h ASP 36 Ca 0.08 0.08 0.12 0.00 0.42 0.00 0.00 57.03 57.73 1rpr h ASP 36 Cb 0.46 0.34 -0.03 0.00 1.72 0.00 0.00 39.33 41.82 1rpr h ASP 36 CO 0.02 -0.54 0.40 0.40 -2.88 0.00 0.00 179.24 176.65 1rpr h ILE 37 N -0.80 0.84 0.00 2.25 2.04 -1.36 0.23 117.51 120.70 1rpr h ILE 37 Ca -0.04 -0.10 -0.12 0.00 1.00 0.00 0.00 64.86 65.60 1rpr h ILE 37 Cb 0.71 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 1rpr h ILE 37 CO -0.04 0.05 -0.56 0.00 0.00 0.00 0.00 178.15 177.60 1rpr h GLU 39 N 0.00 0.14 -0.87 0.00 4.22 0.27 0.38 114.58 118.72 1rpr h GLU 39 Ca -0.01 -0.15 0.21 0.00 0.08 0.00 0.00 59.36 59.49 1rpr h GLU 39 Cb 1.17 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.40 1rpr h GLU 39 CO 0.07 0.89 0.58 0.77 -2.18 0.00 0.00 179.01 179.15 1rpr h SER 40 N -0.55 0.32 0.27 1.04 0.02 -0.79 0.99 113.55 114.85 1rpr h SER 40 Ca -0.02 0.03 -0.23 0.00 -0.84 0.00 0.00 61.79 60.72 1rpr h SER 40 Cb 0.96 -0.03 0.01 0.00 0.14 0.00 0.00 62.40 63.48 1rpr h SER 40 CO 0.04 0.13 -0.96 0.25 -1.14 0.00 0.00 176.83 175.15 1rpr h LEU 41 N 0.32 0.61 0.56 5.07 5.85 -0.65 -1.33 115.31 125.74 1rpr h LEU 41 Ca 0.44 -0.49 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 1rpr h LEU 41 Cb 1.22 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.07 1rpr h LEU 41 CO -0.14 1.28 -0.31 -0.74 -0.34 0.00 0.00 178.44 178.20 1rpr h HIS 42 N 0.27 -0.82 0.00 1.25 2.76 0.51 -0.83 115.15 118.29 1rpr h HIS 42 Ca -0.09 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.07 1rpr h HIS 42 Cb 1.60 0.28 0.00 0.00 1.55 0.00 0.00 27.41 30.84 1rpr h HIS 42 CO 0.07 -0.48 0.00 0.22 -1.30 0.00 0.00 177.93 176.44 1rpr h ASP 43 N -0.81 0.00 -0.38 3.26 3.58 -0.47 -1.67 116.42 119.92 1rpr h ASP 43 Ca -0.08 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.33 1rpr h ASP 43 Cb 0.63 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.67 1rpr h ASP 43 CO 0.10 0.00 0.09 -0.74 -2.88 0.00 0.00 179.24 175.81 1rpr h HIS 44 N 0.00 0.65 0.00 0.28 2.76 -0.77 0.52 115.15 118.59 1rpr h HIS 44 Ca 0.00 -0.08 -0.03 0.00 -2.20 0.00 0.00 60.37 58.06 1rpr h HIS 44 Cb 0.41 -0.18 -0.00 0.00 1.55 0.00 0.00 27.41 29.19 1rpr h HIS 44 CO 0.00 0.64 -0.14 0.00 -1.30 0.00 0.00 177.93 177.13 1rpr h ALA 45 N 0.93 1.40 0.03 5.26 0.00 -0.26 -0.64 119.26 125.98 1rpr h ALA 45 Ca 0.12 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 1rpr h ALA 45 Cb 0.32 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1rpr h ALA 45 CO 0.00 0.18 -0.99 0.22 0.00 0.00 0.00 179.25 178.66 1rpr h ASP 46 N 0.00 0.13 -0.59 0.00 3.58 -0.47 -3.27 116.42 115.81 1rpr h ASP 46 Ca -0.00 -0.13 -0.04 0.00 0.42 0.00 0.00 57.03 57.28 1rpr h ASP 46 Cb 0.33 -0.04 -0.03 0.00 1.72 0.00 0.00 39.33 41.31 1rpr h ASP 46 CO 0.02 1.04 0.23 -0.33 -2.88 0.00 0.00 179.24 177.31 1rpr h GLU 47 N 0.04 0.89 0.00 0.28 4.39 0.16 0.69 114.58 121.02 1rpr h GLU 47 Ca -0.04 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.49 1rpr h GLU 47 Cb 1.70 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 30.21 1rpr h GLU 47 CO 0.14 0.77 0.00 1.47 -1.16 0.00 0.00 179.01 180.23 1rpr n LEU 48 N -4.46 0.00 -0.09 1.33 -0.00 -1.06 -0.80 117.00 111.92 1rpr n LEU 48 Ca 0.03 0.20 0.03 0.00 -0.00 0.00 0.00 56.01 56.27 1rpr n LEU 48 Cb 0.17 -0.20 -0.01 0.00 -0.00 0.00 0.00 43.42 43.38 1rpr n LEU 48 CO 0.39 -0.11 0.13 0.00 -0.00 0.00 0.00 177.39 177.80 1rpr n TYR 49 N -1.20 0.00 0.00 1.47 9.36 -0.10 -4.25 117.16 122.44 1rpr n TYR 49 Ca 0.08 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.30 1rpr n TYR 49 Cb 0.10 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.81 1rpr n TYR 49 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 1rpr n ARG 50 N -0.55 0.00 -0.36 2.98 0.63 0.22 -4.04 116.66 115.54 1rpr n ARG 50 Ca 0.02 0.00 0.08 0.00 -0.92 0.00 0.00 57.85 57.03 1rpr n ARG 50 Cb 0.11 0.00 0.25 0.00 0.45 0.00 0.00 32.46 33.27 1rpr n ARG 50 CO 0.00 0.00 0.00 0.77 -2.51 0.00 0.00 177.63 175.89 1rpr h SER 51 N 0.00 0.88 -0.37 6.15 0.02 -1.76 0.31 113.55 118.78 1rpr h SER 51 Ca 0.00 0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 60.95 1rpr h SER 51 Cb 0.00 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1rpr h SER 51 CO 0.00 0.44 0.02 0.00 -1.14 0.00 0.00 176.83 176.14 1rpr h LEU 53 N 0.46 0.00 -0.94 0.00 5.85 -0.57 0.75 115.31 120.86 1rpr h LEU 53 Ca 0.11 0.00 0.28 0.00 0.84 0.00 0.00 57.88 59.11 1rpr h LEU 53 Cb 0.44 0.00 -0.16 0.00 0.37 0.00 0.00 40.66 41.31 1rpr h LEU 53 CO 0.02 0.00 0.26 0.00 -0.34 0.00 0.00 178.44 178.37 1rpr h ALA 54 N 1.65 1.46 -0.65 1.25 0.00 -0.49 -3.29 119.26 119.19 1rpr h ALA 54 Ca 0.09 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1rpr h ALA 54 Cb 0.62 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1rpr h ALA 54 CO -0.00 -0.59 0.00 -2.13 0.00 0.00 0.00 179.25 176.53 1rpr n ARG 55 N -5.29 0.00 0.00 0.00 0.63 0.21 -5.03 116.66 107.18 1rpr n ARG 55 Ca 0.26 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.19 1rpr n ARG 55 Cb 0.84 -0.15 0.00 0.00 0.45 0.00 0.00 32.46 33.59 1rpr n ARG 55 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1rpr n PHE 56 N -2.22 0.00 0.00 -0.14 7.35 0.23 -5.05 117.46 117.64 1rpr n PHE 56 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1rpr n PHE 56 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 1rpr n PHE 56 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1rpr n GLY 57 N 0.00 0.96 0.00 7.13 0.00 0.36 -4.93 105.19 108.71 1rpr n GLY 57 Ca 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.52 1rpr n GLY 57 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rpr n ASP 58 N -0.25 0.00 -4.66 1.61 9.92 -1.26 -4.97 116.55 116.94 1rpr n ASP 58 Ca 0.00 0.00 -0.43 0.00 -0.53 0.00 0.00 54.79 53.83 1rpr n ASP 58 Cb 0.00 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.46 1rpr n ASP 58 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1rpr s ASP 59 N -0.23 6.80 0.00 -2.24 2.15 -1.26 -4.46 116.67 117.43 1rpr s ASP 59 Ca 0.00 1.98 0.00 0.00 0.43 0.00 0.00 52.55 54.96 1rpr s ASP 59 Cb 0.00 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.08 1rpr s ASP 59 CO 0.00 -0.84 0.00 0.61 -0.17 0.00 0.00 175.17 174.77 1rpr n GLY 60 N 3.87 0.83 0.53 2.66 0.00 -1.26 -4.90 105.19 106.92 1rpr n GLY 60 Ca 0.15 0.54 0.07 0.00 0.00 0.00 0.00 46.02 46.78 1rpr n GLY 60 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1rpr n GLU 61 N 0.00 -1.18 -4.53 1.61 2.13 -1.26 -4.96 120.64 112.45 1rpr n GLU 61 Ca 0.00 0.90 -0.22 0.00 0.66 0.00 0.00 57.16 58.51 1rpr n GLU 61 Cb 0.00 -1.39 -0.15 0.00 0.27 0.00 0.00 31.44 30.16 1rpr n GLU 61 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 1rpr s ASN 62 N -5.66 1.48 0.00 4.31 2.47 -1.26 -5.18 114.94 111.10 1rpr s ASN 62 Ca 0.00 -0.23 0.03 0.00 0.42 0.00 0.00 52.86 53.08 1rpr s ASN 62 Cb 0.00 -0.33 0.03 0.00 -1.45 0.00 0.00 41.25 39.50 1rpr s ASN 62 CO 0.00 0.11 0.61 0.18 -3.72 0.00 0.00 177.10 174.28