#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rpr n THR 2 N 0.00 0.00 0.00 2.03 -2.24 -1.26 -5.07 114.28 107.74 1rpr n THR 2 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1rpr n THR 2 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1rpr n THR 2 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1rpr n LYS 3 N 0.00 0.00 -0.03 -0.78 4.76 -1.26 -4.64 118.16 116.21 1rpr n LYS 3 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1rpr n LYS 3 Cb 0.00 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.20 1rpr n LYS 3 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1rpr n GLN 4 N 0.00 1.12 0.03 1.97 3.00 -1.26 -3.56 117.38 118.68 1rpr n GLN 4 Ca 0.00 -0.10 -0.09 0.00 -0.01 0.00 0.00 57.00 56.80 1rpr n GLN 4 Cb 0.00 -1.42 0.06 0.00 0.00 0.00 0.00 30.24 28.88 1rpr n GLN 4 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.06 178.11 1rpr h GLU 5 N 0.14 0.46 -0.71 -1.09 9.09 -1.99 -1.78 114.58 118.69 1rpr h GLU 5 Ca 0.00 -0.32 -0.02 0.00 0.05 0.00 0.00 59.36 59.07 1rpr h GLU 5 Cb 0.44 0.05 -0.03 0.00 -1.65 0.00 0.00 28.75 27.55 1rpr h GLU 5 CO 0.01 0.93 0.35 0.87 0.05 0.00 0.00 179.01 181.22 1rpr h LYS 6 N 0.34 1.01 -0.66 1.06 1.57 -1.87 -1.37 116.57 116.66 1rpr h LYS 6 Ca -0.01 -0.13 0.05 0.00 -1.87 0.00 0.00 60.65 58.70 1rpr h LYS 6 Cb 1.15 -0.19 -0.05 0.00 0.08 0.00 0.00 32.23 33.22 1rpr h LYS 6 CO 0.11 0.77 0.37 1.15 -0.57 0.00 0.00 179.45 181.28 1rpr h THR 7 N 1.01 0.98 0.68 -0.16 2.02 -1.56 1.04 112.91 116.92 1rpr h THR 7 Ca 0.25 -0.24 -0.03 0.00 0.77 0.00 0.00 66.41 67.16 1rpr h THR 7 Cb 0.09 0.23 0.01 0.00 -1.74 0.00 0.00 68.15 66.74 1rpr h THR 7 CO -0.03 0.13 -0.33 0.00 0.37 0.00 0.00 175.52 175.65 1rpr h ALA 8 N 1.34 -0.92 0.00 6.16 0.00 -0.74 -2.32 119.26 122.78 1rpr h ALA 8 Ca 0.29 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1rpr h ALA 8 Cb 0.17 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1rpr h ALA 8 CO -0.17 -0.96 0.00 1.28 0.00 0.00 0.00 179.25 179.40 1rpr n LEU 9 N -5.44 0.38 0.16 0.00 4.32 -0.78 -1.36 117.00 114.28 1rpr n LEU 9 Ca -0.13 0.62 0.00 0.00 -0.02 0.00 0.00 56.01 56.48 1rpr n LEU 9 Cb 0.38 -0.60 0.25 0.00 -1.62 0.00 0.00 43.42 41.83 1rpr n LEU 9 CO 0.36 -0.56 0.60 0.78 -1.22 0.00 0.00 177.39 177.35 1rpr h ASN 10 N 0.00 0.01 -0.43 -1.43 -0.26 0.17 0.19 115.58 113.83 1rpr h ASN 10 Ca 0.00 -0.01 -0.12 0.00 -0.56 0.00 0.00 56.30 55.61 1rpr h ASN 10 Cb 0.21 -0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.45 1rpr h ASN 10 CO 0.00 0.52 -0.20 0.24 -1.06 0.00 0.00 177.43 176.92 1rpr h MET 11 N 0.01 0.89 -0.16 0.81 2.86 -1.12 -1.28 114.93 116.94 1rpr h MET 11 Ca -0.00 -0.39 -0.05 0.00 -2.06 0.00 0.00 59.70 57.20 1rpr h MET 11 Cb 0.90 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.52 1rpr h MET 11 CO 0.07 1.04 -0.12 0.00 1.06 0.00 0.00 176.91 178.95 1rpr h ALA 12 N 0.83 1.51 -0.54 6.32 0.00 -1.30 -0.85 119.26 125.22 1rpr h ALA 12 Ca 0.10 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1rpr h ALA 12 Cb 0.77 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1rpr h ALA 12 CO 0.06 0.35 0.27 -0.09 0.00 0.00 0.00 179.25 179.84 1rpr h ARG 13 N 0.24 0.78 -0.65 0.00 2.43 0.12 -0.88 114.38 116.41 1rpr h ARG 13 Ca 0.05 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 1rpr h ARG 13 Cb 0.37 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.74 1rpr h ARG 13 CO 0.02 0.63 0.31 0.74 -1.51 0.00 0.00 179.97 180.16 1rpr h PHE 14 N 0.73 0.92 -0.86 2.20 0.04 -0.08 -0.21 116.94 119.69 1rpr h PHE 14 Ca 0.19 -0.04 0.02 0.00 2.80 0.00 0.00 57.97 60.94 1rpr h PHE 14 Cb 0.10 -0.29 -0.05 0.00 2.20 0.00 0.00 35.95 37.91 1rpr h PHE 14 CO -0.01 0.68 0.56 0.82 -0.60 0.00 0.00 178.31 179.77 1rpr h ILE 15 N 0.93 1.20 -0.62 -0.55 2.04 -0.21 0.21 117.51 120.51 1rpr h ILE 15 Ca 0.23 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 1rpr h ILE 15 Cb 0.11 -0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.12 1rpr h ILE 15 CO -0.03 0.21 0.34 -0.09 0.00 0.00 0.00 178.15 178.58 1rpr h ARG 16 N 1.13 0.85 -0.69 2.37 2.43 -0.00 0.17 114.38 120.65 1rpr h ARG 16 Ca 0.32 -0.09 -0.06 0.00 -0.81 0.00 0.00 59.98 59.34 1rpr h ARG 16 Cb -0.09 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.25 1rpr h ARG 16 CO -0.08 0.62 0.18 0.77 -1.51 0.00 0.00 179.97 179.95 1rpr h SER 17 N 0.86 1.04 0.09 -3.80 0.02 0.91 -1.51 113.55 111.17 1rpr h SER 17 Ca 0.22 -0.23 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 1rpr h SER 17 Cb 0.02 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 1rpr h SER 17 CO -0.04 0.99 -0.29 1.56 -1.14 0.00 0.00 176.83 177.91 1rpr h GLN 18 N 1.03 0.31 0.00 3.45 4.20 0.38 -0.09 115.11 124.40 1rpr h GLN 18 Ca 0.22 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.77 1rpr h GLN 18 Cb 0.35 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 1rpr h GLN 18 CO -0.00 0.58 -0.20 1.15 -0.67 0.00 0.00 178.83 179.70 1rpr h THR 19 N 0.28 0.96 0.12 -0.54 2.02 -0.21 -0.39 112.91 115.15 1rpr h THR 19 Ca 0.04 -0.72 -0.01 0.00 0.77 0.00 0.00 66.41 66.49 1rpr h THR 19 Cb 0.67 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.49 1rpr h THR 19 CO 0.05 0.19 -0.06 0.25 0.37 0.00 0.00 175.52 176.33 1rpr h LEU 20 N 0.00 -0.14 -1.48 2.58 6.46 -0.05 -0.92 115.31 121.76 1rpr h LEU 20 Ca -0.00 -0.15 0.17 0.00 -0.12 0.00 0.00 57.88 57.78 1rpr h LEU 20 Cb 0.39 0.04 -0.06 0.00 -0.73 0.00 0.00 40.66 40.30 1rpr h LEU 20 CO 0.03 0.08 0.56 0.74 -0.62 0.00 0.00 178.44 179.23 1rpr h THR 21 N -0.35 0.74 -0.37 1.05 2.02 -0.63 0.28 112.91 115.66 1rpr h THR 21 Ca -0.02 -0.16 -0.03 0.00 0.77 0.00 0.00 66.41 66.97 1rpr h THR 21 Cb 0.28 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 1rpr h THR 21 CO 0.03 0.09 0.11 -0.07 0.37 0.00 0.00 175.52 176.05 1rpr h LEU 22 N 0.47 0.55 -0.59 2.58 3.38 -0.06 -2.16 115.31 119.48 1rpr h LEU 22 Ca 0.44 -0.21 0.12 0.00 0.09 0.00 0.00 57.88 58.32 1rpr h LEU 22 Cb 0.98 -0.14 -0.10 0.00 0.09 0.00 0.00 40.66 41.48 1rpr h LEU 22 CO -0.17 0.61 -0.05 0.25 0.09 0.00 0.00 178.44 179.17 1rpr h LEU 23 N 0.45 -0.36 0.04 1.67 5.85 0.82 0.53 115.31 124.32 1rpr h LEU 23 Ca 0.12 0.16 0.00 0.00 0.84 0.00 0.00 57.88 59.00 1rpr h LEU 23 Cb 0.26 0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 1rpr h LEU 23 CO -0.00 -0.14 -0.10 -0.33 -0.34 0.00 0.00 178.44 177.53 1rpr h GLU 24 N 0.07 -0.15 -0.97 1.25 5.08 -0.84 -0.18 114.58 118.84 1rpr h GLU 24 Ca 0.30 0.01 0.22 0.00 -1.00 0.00 0.00 59.36 58.89 1rpr h GLU 24 Cb 0.48 0.03 -0.12 0.00 0.50 0.00 0.00 28.75 29.64 1rpr h GLU 24 CO -0.54 -0.10 0.55 0.87 -1.00 0.00 0.00 179.01 178.79 1rpr h LYS 25 N -0.16 0.59 -0.62 2.33 1.79 -0.88 0.29 116.57 119.92 1rpr h LYS 25 Ca -0.00 -0.04 -0.08 0.00 -2.18 0.00 0.00 60.65 58.35 1rpr h LYS 25 Cb 0.15 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 30.65 1rpr h LYS 25 CO -0.05 0.39 0.06 -0.07 -1.08 0.00 0.00 179.45 178.71 1rpr h LEU 26 N 0.61 0.99 -0.33 2.94 4.07 -0.52 -0.39 115.31 122.67 1rpr h LEU 26 Ca 0.60 -0.25 -0.05 0.00 0.08 0.00 0.00 57.88 58.26 1rpr h LEU 26 Cb 1.07 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.53 1rpr h LEU 26 CO -0.45 1.01 0.01 0.78 -1.08 0.00 0.00 178.44 178.71 1rpr h ASN 27 N 0.96 0.57 -0.44 -0.43 -0.26 0.14 0.31 115.58 116.43 1rpr h ASN 27 Ca 0.18 -0.30 0.03 0.00 -0.56 0.00 0.00 56.30 55.65 1rpr h ASN 27 Cb 0.47 -0.15 -0.03 0.00 -1.06 0.00 0.00 38.32 37.54 1rpr h ASN 27 CO 0.02 0.73 0.24 -0.33 -1.06 0.00 0.00 177.43 177.03 1rpr h GLU 28 N 0.39 0.46 -0.89 0.81 5.08 -0.77 -1.91 114.58 117.75 1rpr h GLU 28 Ca 0.10 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.32 1rpr h GLU 28 Cb 0.44 -0.10 -0.07 0.00 0.50 0.00 0.00 28.75 29.52 1rpr h GLU 28 CO 0.02 0.30 0.14 1.28 -1.00 0.00 0.00 179.01 179.75 1rpr n LEU 29 N -4.88 3.98 -3.47 1.33 4.32 -0.18 -4.90 117.00 113.20 1rpr n LEU 29 Ca 0.02 -2.05 -0.15 0.00 -0.02 0.00 0.00 56.01 53.81 1rpr n LEU 29 Cb 0.09 -0.62 0.00 0.00 -1.62 0.00 0.00 43.42 41.27 1rpr n LEU 29 CO 0.31 0.58 -0.01 -0.67 -1.22 0.00 0.00 177.39 176.37 1rpr n ASP 30 N 0.04 -6.09 -3.12 -1.43 2.03 -0.72 -4.92 116.55 102.33 1rpr n ASP 30 Ca 0.20 -0.55 -0.21 0.00 0.52 0.00 0.00 54.79 54.75 1rpr n ASP 30 Cb 0.87 -3.17 -0.04 0.00 -0.72 0.00 0.00 41.12 38.07 1rpr n ASP 30 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rpr n ALA 31 N -2.13 2.85 -0.06 -1.67 0.00 0.11 -4.94 120.51 114.67 1rpr n ALA 31 Ca -0.18 -3.81 -0.10 0.00 0.00 0.00 0.00 53.44 49.35 1rpr n ALA 31 Cb 0.61 -0.86 -0.04 0.00 0.00 0.00 0.00 19.45 19.16 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 3.08 0.28 -0.98 0.00 3.58 -1.91 0.27 116.42 120.75 1rpr h ASP 32 Ca 0.11 -0.10 0.03 0.00 0.42 0.00 0.00 57.03 57.49 1rpr h ASP 32 Cb 0.82 -0.07 -0.05 0.00 1.72 0.00 0.00 39.33 41.75 1rpr h ASP 32 CO 0.60 0.30 0.64 1.05 -2.88 0.00 0.00 179.24 178.95 1rpr h GLU 33 N 0.24 1.23 0.00 0.28 -0.00 -1.96 0.44 114.58 114.80 1rpr h GLU 33 Ca 0.08 -0.07 -0.03 0.00 -0.00 0.00 0.00 59.36 59.33 1rpr h GLU 33 Cb 0.08 -0.28 -0.00 0.00 -0.00 0.00 0.00 28.75 28.55 1rpr h GLU 33 CO -0.01 0.81 -0.16 1.96 -0.00 0.00 0.00 179.01 181.62 1rpr h GLN 34 N 1.27 0.00 -0.29 1.06 1.08 -1.88 -2.37 115.11 113.98 1rpr h GLN 34 Ca 0.38 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.51 1rpr h GLN 34 Cb -0.06 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 1rpr h GLN 34 CO -0.11 0.16 -0.07 0.00 -0.95 0.00 0.00 178.83 177.86 1rpr h ALA 35 N 1.84 0.40 0.15 3.87 0.00 0.34 0.17 119.26 126.04 1rpr h ALA 35 Ca -0.00 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.64 1rpr h ALA 35 Cb 0.76 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1rpr h ALA 35 CO 0.02 0.21 -0.22 0.22 0.00 0.00 0.00 179.25 179.49 1rpr h ASP 36 N 0.32 -0.60 -0.43 0.00 3.58 -0.40 0.41 116.42 119.30 1rpr h ASP 36 Ca 0.07 0.06 0.06 0.00 0.42 0.00 0.00 57.03 57.65 1rpr h ASP 36 Cb 0.55 0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.79 1rpr h ASP 36 CO 0.03 -0.31 0.29 0.40 -2.88 0.00 0.00 179.24 176.77 1rpr h ILE 37 N -0.43 0.94 0.00 2.25 1.08 -1.34 0.34 117.51 120.34 1rpr h ILE 37 Ca 0.02 -0.10 -0.12 0.00 -0.39 0.00 0.00 64.86 64.27 1rpr h ILE 37 Cb 0.43 0.61 -0.02 0.00 -3.07 0.00 0.00 36.82 34.78 1rpr h ILE 37 CO -0.09 0.06 -0.55 0.00 -0.69 0.00 0.00 178.15 176.87 1rpr h GLU 39 N 0.00 -0.13 -0.60 0.00 4.39 0.35 0.59 114.58 119.17 1rpr h GLU 39 Ca -0.01 0.01 0.09 0.00 0.34 0.00 0.00 59.36 59.79 1rpr h GLU 39 Cb 1.00 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.64 1rpr h GLU 39 CO 0.07 0.38 0.40 0.66 -1.16 0.00 0.00 179.01 179.36 1rpr h SER 40 N -0.84 0.41 0.33 1.42 4.64 -1.02 0.36 113.55 118.84 1rpr h SER 40 Ca -0.01 0.01 -0.21 0.00 -0.47 0.00 0.00 61.79 61.10 1rpr h SER 40 Cb 0.57 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1rpr h SER 40 CO 0.02 0.25 -0.87 0.25 -0.87 0.00 0.00 176.83 175.62 1rpr h LEU 41 N 0.46 0.50 -0.65 5.97 5.85 -1.04 0.92 115.31 127.31 1rpr h LEU 41 Ca 0.27 -0.37 0.13 0.00 0.84 0.00 0.00 57.88 58.75 1rpr h LEU 41 Cb 0.47 -0.15 -0.09 0.00 0.37 0.00 0.00 40.66 41.25 1rpr h LEU 41 CO -0.08 1.15 0.17 -0.74 -0.34 0.00 0.00 178.44 178.60 1rpr h HIS 42 N 0.24 0.27 0.00 1.25 2.76 0.43 0.70 115.15 120.79 1rpr h HIS 42 Ca -0.06 0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.11 1rpr h HIS 42 Cb 1.48 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 30.42 1rpr h HIS 42 CO 0.05 -0.02 -1.18 -0.25 -1.30 0.00 0.00 177.93 175.23 1rpr n ASP 43 N -5.11 0.78 -0.26 3.26 9.92 -0.62 -3.54 116.55 120.99 1rpr n ASP 43 Ca 0.11 0.31 -0.06 0.00 -0.53 0.00 0.00 54.79 54.62 1rpr n ASP 43 Cb 0.36 0.51 0.07 0.00 -0.64 0.00 0.00 41.12 41.42 1rpr n ASP 43 CO 0.00 0.00 0.00 -0.74 0.13 0.00 0.00 177.20 176.59 1rpr h HIS 44 N 0.00 1.18 0.00 1.24 2.76 0.45 0.29 115.15 121.07 1rpr h HIS 44 Ca -0.04 -0.12 0.00 0.00 -2.20 0.00 0.00 60.37 58.01 1rpr h HIS 44 Cb 1.13 -0.34 0.00 0.00 1.55 0.00 0.00 27.41 29.75 1rpr h HIS 44 CO 0.00 0.93 0.00 0.00 -1.30 0.00 0.00 177.93 177.56 1rpr h ALA 45 N 1.15 1.00 0.00 5.26 0.00 -1.01 -1.09 119.26 124.56 1rpr h ALA 45 Ca 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.93 1rpr h ALA 45 Cb 0.31 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1rpr h ALA 45 CO -0.01 0.00 -1.23 0.22 0.00 0.00 0.00 179.25 178.23 1rpr h ASP 46 N 0.00 0.00 -0.15 0.00 1.82 -0.54 -3.14 116.42 114.41 1rpr h ASP 46 Ca 0.00 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1rpr h ASP 46 Cb 0.36 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.37 1rpr h ASP 46 CO 0.00 0.86 0.09 -0.33 -1.61 0.00 0.00 179.24 178.25 1rpr h GLU 47 N 0.00 0.21 0.00 0.28 5.08 0.24 0.54 114.58 120.93 1rpr h GLU 47 Ca -0.13 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1rpr h GLU 47 Cb 1.77 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.97 1rpr h GLU 47 CO 0.09 0.19 0.00 1.47 -1.00 0.00 0.00 179.01 179.76 1rpr n LEU 48 N -4.95 0.00 0.00 1.33 -0.00 -1.19 -2.03 117.00 110.17 1rpr n LEU 48 Ca -0.04 0.47 0.00 0.00 -0.00 0.00 0.00 56.01 56.43 1rpr n LEU 48 Cb 0.06 -0.47 0.00 0.00 -0.00 0.00 0.00 43.42 43.01 1rpr n LEU 48 CO 0.34 -0.30 0.00 0.00 -0.00 0.00 0.00 177.39 177.43 1rpr n TYR 49 N -1.47 0.00 0.14 1.47 9.36 0.57 -4.40 117.16 122.83 1rpr n TYR 49 Ca 0.03 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.12 1rpr n TYR 49 Cb 0.11 -0.03 -0.08 0.00 -0.63 0.00 0.00 39.34 38.71 1rpr n TYR 49 CO 0.00 0.00 0.00 -0.09 0.22 0.00 0.00 176.86 176.99 1rpr h ARG 50 N 0.00 -0.37 -0.70 2.98 9.65 -0.15 0.11 114.38 125.90 1rpr h ARG 50 Ca 0.00 0.03 0.14 0.00 -1.10 0.00 0.00 59.98 59.05 1rpr h ARG 50 Cb 0.00 0.09 -0.10 0.00 -1.39 0.00 0.00 29.97 28.56 1rpr h ARG 50 CO 0.00 -0.03 0.18 0.77 2.80 0.00 0.00 179.97 183.68 1rpr h SER 51 N -0.83 0.04 -0.09 -3.80 0.02 -1.49 0.23 113.55 107.63 1rpr h SER 51 Ca -0.04 0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 1rpr h SER 51 Cb 0.51 0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.22 1rpr h SER 51 CO 0.07 -0.01 0.01 0.00 -1.14 0.00 0.00 176.83 175.76 1rpr h LEU 53 N -0.08 0.00 -0.09 0.00 5.85 0.21 0.72 115.31 121.93 1rpr h LEU 53 Ca 0.03 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.79 1rpr h LEU 53 Cb 0.29 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.26 1rpr h LEU 53 CO 0.00 0.00 -0.35 0.00 -0.34 0.00 0.00 178.44 177.75 1rpr h ALA 54 N 0.97 -0.47 -1.62 1.25 0.00 -0.56 -3.19 119.26 115.65 1rpr h ALA 54 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1rpr h ALA 54 Cb 1.28 0.65 0.00 0.00 0.00 0.00 0.00 17.79 19.72 1rpr h ALA 54 CO -0.00 -0.85 0.00 -2.13 0.00 0.00 0.00 179.25 176.27 1rpr n ARG 55 N -5.42 0.00 0.00 0.00 0.63 0.10 -3.97 116.66 108.01 1rpr n ARG 55 Ca -0.04 0.10 0.00 0.00 -0.92 0.00 0.00 57.85 57.00 1rpr n ARG 55 Cb 0.34 -0.46 0.00 0.00 0.45 0.00 0.00 32.46 32.79 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 -1.61 0.00 -2.02 -0.14 7.35 0.21 -0.17 117.46 121.08 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 1.54 0.49 7.13 0.00 0.46 -4.81 105.19 109.99 1rpr n GLY 57 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.90 0.00 -0.76 1.61 8.00 -1.26 -4.97 116.55 117.26 1rpr n ASP 58 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1rpr n ASP 58 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1rpr n ASP 58 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1rpr n ASP 59 N -0.28 0.00 0.00 -2.24 2.03 -1.26 -5.02 116.55 109.78 1rpr n ASP 59 Ca 0.00 -0.76 0.00 0.00 0.52 0.00 0.00 54.79 54.55 1rpr n ASP 59 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1rpr n ASP 59 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1rpr n GLY 60 N 0.00 0.76 0.10 0.27 0.00 -1.26 -4.92 105.19 100.13 1rpr n GLY 60 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1rpr n GLY 60 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rpr n GLU 61 N 0.00 0.67 -2.46 1.61 4.71 -1.26 -4.87 120.64 119.03 1rpr n GLU 61 Ca 0.00 0.20 -0.31 0.00 -0.01 0.00 0.00 57.16 57.04 1rpr n GLU 61 Cb 0.00 -1.69 -0.03 0.00 -1.01 0.00 0.00 31.44 28.72 1rpr n GLU 61 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 1rpr s ASN 62 N -6.09 6.53 0.00 1.62 2.47 -1.26 -5.36 114.94 112.85 1rpr s ASN 62 Ca -0.11 1.40 0.00 0.00 0.42 0.00 0.00 52.86 54.58 1rpr s ASN 62 Cb 0.07 -2.44 0.00 0.00 -1.45 0.00 0.00 41.25 37.43 1rpr s ASN 62 CO 0.80 -0.57 0.00 0.00 -3.72 0.00 0.00 177.10 173.61