#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jcc n SER 2 N 0.00 1.36 -4.55 -3.46 2.88 -1.26 -4.68 113.62 103.91 1jcc n SER 2 Ca 0.00 -1.23 -0.42 0.00 -1.33 0.00 0.00 58.87 55.89 1jcc n SER 2 Cb 0.00 0.09 -0.03 0.00 -0.75 0.00 0.00 64.21 63.52 1jcc n SER 2 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1jcc s ASN 3 N -2.27 6.32 0.16 -3.46 3.84 -1.26 -4.89 114.94 113.39 1jcc s ASN 3 Ca 0.30 -0.26 -0.15 0.00 0.21 0.00 0.00 52.86 52.96 1jcc s ASN 3 Cb 0.20 -2.52 0.05 0.00 -0.55 0.00 0.00 41.25 38.44 1jcc s ASN 3 CO 0.43 -1.52 1.81 0.00 -2.79 0.00 0.00 177.10 175.03 1jcc h ALA 4 N 9.63 0.57 -0.88 1.71 0.00 -2.01 -2.62 119.26 125.67 1jcc h ALA 4 Ca -0.26 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.65 1jcc h ALA 4 Cb 1.06 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 1jcc h ALA 4 CO 1.19 -0.03 0.58 0.87 0.00 0.00 0.00 179.25 181.87 1jcc h LYS 5 N 0.56 1.13 -0.55 0.00 1.57 -1.99 -1.85 116.57 115.44 1jcc h LYS 5 Ca 0.18 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 1jcc h LYS 5 Cb -0.01 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.02 1jcc h LYS 5 CO -0.07 0.75 0.05 0.82 -0.57 0.00 0.00 179.45 180.43 1jcc h ILE 6 N 1.16 1.25 -0.69 1.86 1.08 -1.90 -2.10 117.51 118.17 1jcc h ILE 6 Ca 0.33 -1.00 -0.06 0.00 -0.39 0.00 0.00 64.86 63.75 1jcc h ILE 6 Cb -0.08 0.77 -0.03 0.00 -3.07 0.00 0.00 36.82 34.41 1jcc h ILE 6 CO -0.08 0.36 0.21 0.44 -0.69 0.00 0.00 178.15 178.39 1jcc h ASP 7 N 0.85 1.00 -0.62 1.72 3.32 -1.00 -0.65 116.42 121.04 1jcc h ASP 7 Ca 0.17 -0.21 -0.06 0.00 0.02 0.00 0.00 57.03 56.94 1jcc h ASP 7 Cb 0.43 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 1jcc h ASP 7 CO 0.02 0.95 0.16 -0.61 -1.72 0.00 0.00 179.24 178.03 1jcc h GLN 8 N 1.01 1.02 -0.62 3.56 5.75 -1.15 -1.32 115.11 123.36 1jcc h GLN 8 Ca 0.22 -0.23 -0.06 0.00 -0.15 0.00 0.00 58.65 58.43 1jcc h GLN 8 Cb 0.31 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.69 1jcc h GLN 8 CO -0.01 0.90 0.16 -0.07 -2.65 0.00 0.00 178.83 177.17 1jcc h LEU 9 N 0.97 0.93 -0.79 -2.39 3.38 -0.97 -0.92 115.31 115.51 1jcc h LEU 9 Ca 0.21 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1jcc h LEU 9 Cb 0.34 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 1jcc h LEU 9 CO 0.00 0.91 0.38 -1.28 0.09 0.00 0.00 178.44 178.54 1jcc h SER 10 N 0.90 1.04 -0.35 -0.43 0.87 -0.69 -0.54 113.55 114.35 1jcc h SER 10 Ca 0.20 -0.14 -0.05 0.00 -1.23 0.00 0.00 61.79 60.57 1jcc h SER 10 Cb 0.34 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 1jcc h SER 10 CO -0.00 0.89 0.01 -1.28 -0.53 0.00 0.00 176.83 175.92 1jcc h SER 11 N 1.12 0.59 -0.70 6.23 0.87 -0.94 -1.35 113.55 119.38 1jcc h SER 11 Ca 0.27 -0.30 -0.05 0.00 -1.23 0.00 0.00 61.79 60.49 1jcc h SER 11 Cb 0.13 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 61.90 1jcc h SER 11 CO -0.03 0.74 0.25 0.44 -0.53 0.00 0.00 176.83 177.70 1jcc h ASP 12 N 0.42 0.99 -0.55 6.23 3.32 -0.94 -1.37 116.42 124.52 1jcc h ASP 12 Ca 0.10 -0.19 -0.06 0.00 0.02 0.00 0.00 57.03 56.90 1jcc h ASP 12 Cb 0.43 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1jcc h ASP 12 CO 0.02 0.91 0.10 0.00 -1.72 0.00 0.00 179.24 178.54 1jcc h ALA 13 N 1.11 0.73 -0.53 3.45 0.00 -0.98 -1.28 119.26 121.78 1jcc h ALA 13 Ca 0.23 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1jcc h ALA 13 Cb 0.25 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1jcc h ALA 13 CO -0.01 0.47 0.14 1.96 0.00 0.00 0.00 179.25 181.81 1jcc h GLN 14 N 0.80 0.84 -0.56 0.00 7.50 -1.04 -1.35 115.11 121.31 1jcc h GLN 14 Ca 0.17 -0.20 -0.08 0.00 0.50 0.00 0.00 58.65 59.04 1jcc h GLN 14 Cb 0.40 -0.11 -0.02 0.00 0.05 0.00 0.00 27.48 27.79 1jcc h GLN 14 CO 0.01 0.79 0.03 1.15 -1.50 0.00 0.00 178.83 179.32 1jcc h THR 15 N 0.74 1.26 -0.44 -0.54 2.02 -1.12 -1.46 112.91 113.37 1jcc h THR 15 Ca 0.17 -1.07 -0.01 0.00 0.77 0.00 0.00 66.41 66.27 1jcc h THR 15 Cb 0.32 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.56 1jcc h THR 15 CO -0.00 0.38 0.22 0.00 0.37 0.00 0.00 175.52 176.49 1jcc h ALA 16 N 0.97 0.56 -0.66 6.16 0.00 -1.04 -0.90 119.26 124.36 1jcc h ALA 16 Ca 0.16 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1jcc h ALA 16 Cb 0.49 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1jcc h ALA 16 CO 0.02 0.12 0.13 -0.91 0.00 0.00 0.00 179.25 178.61 1jcc h ASN 17 N 0.57 1.03 -0.64 0.00 2.35 -1.10 -0.67 115.58 117.12 1jcc h ASN 17 Ca 0.15 -0.25 -0.04 0.00 -0.55 0.00 0.00 56.30 55.61 1jcc h ASN 17 Cb 0.11 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.18 1jcc h ASN 17 CO -0.02 1.01 0.23 0.00 -1.65 0.00 0.00 177.43 177.01 1jcc h ALA 18 N 1.05 0.83 -0.45 -0.83 0.00 -1.02 -1.08 119.26 117.76 1jcc h ALA 18 Ca 0.20 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1jcc h ALA 18 Cb 0.41 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1jcc h ALA 18 CO 0.01 0.47 -0.22 0.87 0.00 0.00 0.00 179.25 180.38 1jcc h LYS 19 N 0.90 0.94 -0.80 0.00 1.57 -0.98 -1.81 116.57 116.38 1jcc h LYS 19 Ca 0.21 -0.41 -0.04 0.00 -1.87 0.00 0.00 60.65 58.54 1jcc h LYS 19 Cb 0.24 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 1jcc h LYS 19 CO -0.01 1.08 0.36 0.00 -0.57 0.00 0.00 179.45 180.30 1jcc h ALA 20 N 0.84 1.12 -0.48 3.86 0.00 -0.91 0.37 119.26 124.06 1jcc h ALA 20 Ca 0.10 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1jcc h ALA 20 Cb 0.80 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1jcc h ALA 20 CO 0.07 0.65 -0.11 -0.44 0.00 0.00 0.00 179.25 179.42 1jcc h ASP 21 N 1.15 0.87 -0.36 0.00 3.32 -1.08 -0.16 116.42 120.17 1jcc h ASP 21 Ca 0.27 -0.27 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1jcc h ASP 21 Cb 0.16 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1jcc h ASP 21 CO -0.03 1.00 0.11 -0.61 -1.72 0.00 0.00 179.24 177.99 1jcc h GLN 22 N 0.79 0.56 -0.18 3.56 4.15 -0.85 -2.05 115.11 121.10 1jcc h GLN 22 Ca 0.13 -0.12 -0.11 0.00 0.77 0.00 0.00 58.65 59.32 1jcc h GLN 22 Cb 0.63 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.23 1jcc h GLN 22 CO 0.04 0.58 -0.36 0.00 -1.93 0.00 0.00 178.83 177.16 1jcc h ALA 23 N 0.95 1.05 -0.60 3.38 0.00 -0.77 -1.65 119.26 121.62 1jcc h ALA 23 Ca 0.12 -0.40 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 1jcc h ALA 23 Cb 0.26 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1jcc h ALA 23 CO -0.00 0.59 0.10 1.03 0.00 0.00 0.00 179.25 180.97 1jcc h SER 24 N 0.32 0.95 -0.37 0.00 0.87 -0.84 -0.79 113.55 113.69 1jcc h SER 24 Ca 0.04 -0.26 -0.09 0.00 -1.23 0.00 0.00 61.79 60.24 1jcc h SER 24 Cb 0.79 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 1jcc h SER 24 CO 0.06 0.97 -0.14 0.78 -0.53 0.00 0.00 176.83 177.97 1jcc h ASN 25 N 0.90 0.76 -0.31 6.23 2.35 -1.16 -1.98 115.58 122.36 1jcc h ASN 25 Ca 0.18 -0.39 0.02 0.00 -0.55 0.00 0.00 56.30 55.56 1jcc h ASN 25 Cb 0.42 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.55 1jcc h ASN 25 CO 0.01 0.98 0.16 0.44 -1.65 0.00 0.00 177.43 177.37 1jcc h ASP 26 N 0.54 0.25 -0.68 5.81 3.32 -1.12 -1.65 116.42 122.89 1jcc h ASP 26 Ca 0.09 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.07 1jcc h ASP 26 Cb 0.67 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.16 1jcc h ASP 26 CO 0.05 0.19 0.12 0.00 -1.72 0.00 0.00 179.24 177.87 1jcc h ALA 27 N 1.15 0.91 -0.29 3.45 0.00 -1.11 -1.06 119.26 122.31 1jcc h ALA 27 Ca 0.13 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1jcc h ALA 27 Cb 0.03 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1jcc h ALA 27 CO -0.08 0.68 0.09 -0.97 0.00 0.00 0.00 179.25 178.97 1jcc h ASN 28 N 1.06 0.42 -0.49 0.00 -0.73 -1.15 -1.25 115.58 113.43 1jcc h ASN 28 Ca 0.21 -0.20 -0.08 0.00 1.87 0.00 0.00 56.30 58.10 1jcc h ASN 28 Cb 0.44 -0.11 -0.02 0.00 0.27 0.00 0.00 38.32 38.90 1jcc h ASN 28 CO 0.01 0.51 0.04 0.00 -0.37 0.00 0.00 177.43 177.61 1jcc h ALA 29 N 0.93 1.04 -0.29 1.57 0.00 -1.19 -2.78 119.26 118.55 1jcc h ALA 29 Ca 0.09 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 1jcc h ALA 29 Cb 0.24 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1jcc h ALA 29 CO -0.00 0.60 -0.26 0.00 0.00 0.00 0.00 179.25 179.59 1jcc h ALA 30 N 1.19 1.01 -0.55 0.00 0.00 -1.01 -0.84 119.26 119.06 1jcc h ALA 30 Ca 0.16 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 1jcc h ALA 30 Cb 0.45 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1jcc h ALA 30 CO 0.02 0.59 0.06 0.00 0.00 0.00 0.00 179.25 179.92 1jcc h ARG 31 N 0.50 0.94 -0.53 0.00 3.08 -1.07 -1.13 114.38 116.17 1jcc h ARG 31 Ca 0.07 -0.27 -0.06 0.00 0.07 0.00 0.00 59.98 59.79 1jcc h ARG 31 Cb 0.72 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.65 1jcc h ARG 31 CO 0.06 0.92 0.10 1.03 -1.07 0.00 0.00 179.97 181.00 1jcc h SER 32 N 0.82 0.83 -0.67 7.04 0.87 -1.28 -2.39 113.55 118.78 1jcc h SER 32 Ca 0.16 -0.25 -0.03 0.00 -1.23 0.00 0.00 61.79 60.45 1jcc h SER 32 Cb 0.46 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 62.16 1jcc h SER 32 CO 0.02 0.87 0.32 -0.78 -0.53 0.00 0.00 176.83 176.73 1jcc h ASP 33 N 0.76 0.89 -0.15 6.23 3.58 -0.98 -2.19 116.42 124.56 1jcc h ASP 33 Ca 0.16 -0.10 -0.08 0.00 0.42 0.00 0.00 57.03 57.43 1jcc h ASP 33 Cb 0.38 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.19 1jcc h ASP 33 CO 0.01 0.76 -0.16 0.00 -2.88 0.00 0.00 179.24 176.97 1jcc h ALA 34 N 1.37 1.16 -0.54 -0.78 0.00 -0.92 -1.74 119.26 117.81 1jcc h ALA 34 Ca 0.24 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1jcc h ALA 34 Cb 0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1jcc h ALA 34 CO -0.03 0.53 -0.07 1.96 0.00 0.00 0.00 179.25 181.64 1jcc h GLN 35 N 0.49 0.98 -0.69 0.00 1.08 -0.92 -0.90 115.11 115.16 1jcc h GLN 35 Ca 0.08 -0.34 -0.05 0.00 -1.45 0.00 0.00 58.65 56.90 1jcc h GLN 35 Cb 0.56 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.88 1jcc h GLN 35 CO 0.04 1.01 0.24 0.00 -0.95 0.00 0.00 178.83 179.17 1jcc h ALA 36 N 1.02 1.12 -0.51 3.87 0.00 -0.98 -0.65 119.26 123.13 1jcc h ALA 36 Ca 0.15 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1jcc h ALA 36 Cb 0.62 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1jcc h ALA 36 CO 0.04 0.62 -0.14 0.00 0.00 0.00 0.00 179.25 179.76 1jcc h ALA 37 N 1.25 0.79 -0.86 0.00 0.00 -0.97 -0.93 119.26 118.54 1jcc h ALA 37 Ca 0.23 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1jcc h ALA 37 Cb 0.25 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1jcc h ALA 37 CO -0.01 0.66 0.44 0.87 0.00 0.00 0.00 179.25 181.21 1jcc h LYS 38 N 0.86 1.22 -0.46 0.00 1.57 -0.70 -1.64 116.57 117.43 1jcc h LYS 38 Ca 0.13 -0.16 -0.11 0.00 -1.87 0.00 0.00 60.65 58.64 1jcc h LYS 38 Cb 0.70 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 1jcc h LYS 38 CO 0.05 0.91 -0.14 -0.44 -0.57 0.00 0.00 179.45 179.26 1jcc h ASP 39 N 1.21 0.86 -0.32 0.86 3.32 -0.82 -1.39 116.42 120.13 1jcc h ASP 39 Ca 0.30 -0.28 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1jcc h ASP 39 Cb 0.07 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1jcc h ASP 39 CO -0.04 1.01 0.11 0.44 -1.72 0.00 0.00 179.24 179.03 1jcc h ASP 40 N 0.77 0.47 -0.74 6.45 3.45 -0.75 -0.85 116.42 125.22 1jcc h ASP 40 Ca 0.12 -0.20 -0.05 0.00 0.43 0.00 0.00 57.03 57.33 1jcc h ASP 40 Cb 0.66 -0.12 -0.03 0.00 -0.56 0.00 0.00 39.33 39.28 1jcc h ASP 40 CO 0.05 0.54 0.26 0.00 -1.57 0.00 0.00 179.24 178.52 1jcc h ALA 41 N 0.94 0.96 -0.73 3.45 0.00 -1.21 -2.15 119.26 120.52 1jcc h ALA 41 Ca 0.11 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1jcc h ALA 41 Cb 0.24 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1jcc h ALA 41 CO -0.00 0.61 0.28 0.00 0.00 0.00 0.00 179.25 180.14 1jcc h ALA 42 N 1.13 1.12 -0.24 0.00 0.00 -1.06 -2.54 119.26 117.67 1jcc h ALA 42 Ca 0.24 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1jcc h ALA 42 Cb 0.26 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1jcc h ALA 42 CO -0.01 0.63 -0.30 -0.09 0.00 0.00 0.00 179.25 179.48 1jcc h ARG 43 N 1.06 0.48 -0.50 0.00 2.43 -0.85 -0.57 114.38 116.43 1jcc h ARG 43 Ca 0.24 -0.20 -0.06 0.00 -0.81 0.00 0.00 59.98 59.16 1jcc h ARG 43 Cb 0.22 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 1jcc h ARG 43 CO -0.02 0.73 0.09 0.00 -1.51 0.00 0.00 179.97 179.27 1jcc h ALA 44 N 1.26 0.66 -0.19 2.80 0.00 -1.02 -1.64 119.26 121.13 1jcc h ALA 44 Ca 0.06 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1jcc h ALA 44 Cb 0.73 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1jcc h ALA 44 CO 0.06 0.39 -0.33 -0.91 0.00 0.00 0.00 179.25 178.45 1jcc h ASN 45 N 0.70 0.41 -0.84 0.00 2.35 -1.25 -2.90 115.58 114.05 1jcc h ASN 45 Ca 0.15 -0.16 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1jcc h ASN 45 Cb 0.38 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.60 1jcc h ASN 45 CO 0.01 0.72 0.52 -0.61 -1.65 0.00 0.00 177.43 176.42 1jcc h GLN 46 N 0.34 1.13 -0.60 0.81 5.75 -0.61 0.82 115.11 122.75 1jcc h GLN 46 Ca 0.04 -0.09 -0.03 0.00 -0.15 0.00 0.00 58.65 58.42 1jcc h GLN 46 Cb 0.76 -0.24 -0.03 0.00 1.07 0.00 0.00 27.48 29.04 1jcc h GLN 46 CO 0.06 0.78 0.26 0.00 -2.65 0.00 0.00 178.83 177.28 1jcc h ARG 47 N 1.15 0.87 -0.11 1.69 3.08 -1.13 -0.91 114.38 119.02 1jcc h ARG 47 Ca 0.30 -0.12 -0.15 0.00 0.07 0.00 0.00 59.98 60.08 1jcc h ARG 47 Cb -0.07 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.81 1jcc h ARG 47 CO -0.06 0.69 -0.57 -0.07 -1.07 0.00 0.00 179.97 178.90 1jcc h LEU 48 N 0.86 0.39 -0.40 3.04 3.38 -1.17 -2.96 115.31 118.46 1jcc h LEU 48 Ca 0.21 -0.21 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 1jcc h LEU 48 Cb 0.14 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1jcc h LEU 48 CO -0.02 0.88 -0.27 0.44 0.09 0.00 0.00 178.44 179.56 1jcc h ASP 49 N 0.27 0.92 0.02 -0.43 3.32 -0.15 -3.27 116.42 117.10 1jcc h ASP 49 Ca 0.00 -0.43 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1jcc h ASP 49 Cb 1.08 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.37 1jcc h ASP 49 CO 0.09 1.16 -0.03 0.59 -1.72 0.00 0.00 179.24 179.34 1jcc n ASN 50 N -4.16 1.28 -4.76 6.45 3.02 -0.41 -4.92 115.26 111.76 1jcc n ASN 50 Ca -0.02 -1.37 -0.40 0.00 -0.03 0.00 0.00 54.58 52.77 1jcc n ASN 50 Cb 0.48 0.01 -0.05 0.00 -0.61 0.00 0.00 39.78 39.61 1jcc n ASN 50 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jcc s MET 51 N -2.06 4.64 0.00 3.52 0.23 -1.12 -5.08 119.30 119.42 1jcc s MET 51 Ca 0.37 1.71 0.27 0.00 -1.03 0.00 0.00 55.69 57.01 1jcc s MET 51 Cb 0.21 -3.14 0.81 0.00 -1.53 0.00 0.00 34.83 31.18 1jcc s MET 51 CO 0.36 0.24 1.61 0.00 -2.03 0.00 0.00 175.02 175.20