#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kk7 n ALA 2 N 0.00 -2.68 0.00 3.17 0.00 -1.26 -4.94 120.51 114.80 2kk7 n ALA 2 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 53.44 53.98 2kk7 n ALA 2 Cb 0.00 -2.55 0.00 0.00 0.00 0.00 0.00 19.45 16.90 2kk7 n ALA 2 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2kk7 n VAL 3 N -0.78 0.00 -0.35 0.00 0.31 -1.26 -4.32 118.33 111.93 2kk7 n VAL 3 Ca -0.02 0.00 0.10 0.00 -0.01 0.00 0.00 64.34 64.41 2kk7 n VAL 3 Cb 0.57 -0.06 0.27 0.00 -0.91 0.00 0.00 33.84 33.72 2kk7 n VAL 3 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2kk7 h LYS 4 N 0.00 0.81 0.00 5.55 1.57 -2.02 -3.43 116.57 119.05 2kk7 h LYS 4 Ca 0.00 -0.05 -0.34 0.00 -1.87 0.00 0.00 60.65 58.40 2kk7 h LYS 4 Cb 0.00 -0.18 0.20 0.00 0.08 0.00 0.00 32.23 32.33 2kk7 h LYS 4 CO 0.00 0.53 -0.16 1.28 -0.57 0.00 0.00 179.45 180.54 2kk7 n LEU 5 N -4.73 0.00 0.27 2.94 4.77 -1.26 -4.85 117.00 114.14 2kk7 n LEU 5 Ca 0.21 -0.81 0.10 0.00 -0.03 0.00 0.00 56.01 55.48 2kk7 n LEU 5 Cb 0.47 -0.91 0.73 0.00 -2.33 0.00 0.00 43.42 41.37 2kk7 n LEU 5 CO 0.24 -2.73 1.09 0.24 -1.33 0.00 0.00 177.39 174.90 2kk7 h MET 6 N 0.00 0.00 0.00 3.23 2.86 -2.00 -3.46 114.93 115.56 2kk7 h MET 6 Ca -0.36 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.28 2kk7 h MET 6 Cb 1.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.88 2kk7 h MET 6 CO 0.22 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.60 2kk7 n GLY 7 N -1.47 1.58 0.39 8.32 0.00 -1.26 -4.98 105.19 107.76 2kk7 n GLY 7 Ca -0.03 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.17 2kk7 n GLY 7 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2kk7 h VAL 8 N 0.00 0.76 0.00 1.61 2.07 -1.97 0.26 116.25 118.98 2kk7 h VAL 8 Ca 0.00 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.35 2kk7 h VAL 8 Cb 0.00 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 2kk7 h VAL 8 CO 0.00 0.05 -0.35 0.44 0.02 0.00 0.00 177.57 177.73 2kk7 h ASP 9 N 0.28 0.00 0.02 0.57 5.19 -1.94 0.57 116.42 121.11 2kk7 h ASP 9 Ca 0.35 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.76 2kk7 h ASP 9 Cb 0.96 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.47 2kk7 h ASP 9 CO -0.08 0.35 -0.01 0.50 -3.12 0.00 0.00 179.24 176.88 2kk7 h LYS 10 N 0.00 -0.02 -0.46 3.56 3.64 -0.70 -2.16 116.57 120.42 2kk7 h LYS 10 Ca -0.00 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.28 2kk7 h LYS 10 Cb 0.68 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 2kk7 h LYS 10 CO 0.05 0.73 -0.09 -0.84 -2.27 0.00 0.00 179.45 177.02 2kk7 h ILE 11 N -0.87 1.26 0.00 2.00 -0.00 -1.38 0.40 117.51 118.92 2kk7 h ILE 11 Ca -0.00 -1.17 -0.08 0.00 -0.00 0.00 0.00 64.86 63.61 2kk7 h ILE 11 Cb 0.77 1.01 -0.01 0.00 -0.00 0.00 0.00 36.82 38.58 2kk7 h ILE 11 CO 0.00 0.40 -0.39 0.50 -0.00 0.00 0.00 178.15 178.67 2kk7 h LYS 12 N 0.75 0.00 0.00 0.16 3.11 -0.99 -3.02 116.57 116.58 2kk7 h LYS 12 Ca 0.13 0.00 -0.15 0.00 -2.81 0.00 0.00 60.65 57.82 2kk7 h LYS 12 Cb 0.59 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.79 2kk7 h LYS 12 CO 0.04 0.39 -1.44 0.43 -2.81 0.00 0.00 179.45 176.06 2kk7 n SER 13 N -3.62 0.77 0.08 4.20 7.64 -0.81 -3.51 113.62 118.37 2kk7 n SER 13 Ca -0.01 0.33 -0.03 0.00 1.01 0.00 0.00 58.87 60.18 2kk7 n SER 13 Cb 0.50 0.34 -0.01 0.00 -1.01 0.00 0.00 64.21 64.02 2kk7 n SER 13 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2kk7 h LYS 14 N 0.00 -0.19 -0.98 1.43 3.11 -0.08 0.33 116.57 120.19 2kk7 h LYS 14 Ca -0.15 0.01 0.06 0.00 -2.81 0.00 0.00 60.65 57.76 2kk7 h LYS 14 Cb 1.51 0.04 -0.06 0.00 -1.00 0.00 0.00 32.23 32.72 2kk7 h LYS 14 CO 0.04 -0.13 0.64 0.82 -2.81 0.00 0.00 179.45 178.01 2kk7 h ILE 15 N -0.21 1.11 0.90 2.00 5.03 -1.76 0.52 117.51 125.08 2kk7 h ILE 15 Ca -0.02 -0.40 -0.04 0.00 -0.12 0.00 0.00 64.86 64.27 2kk7 h ILE 15 Cb 0.15 -0.17 0.01 0.00 -3.03 0.00 0.00 36.82 33.78 2kk7 h ILE 15 CO 0.03 0.21 -0.43 -0.07 -0.68 0.00 0.00 178.15 177.22 2kk7 h LEU 16 N 1.18 -1.02 -1.18 1.44 -0.00 -1.59 0.29 115.31 114.43 2kk7 h LEU 16 Ca 0.42 0.03 -0.02 0.00 -0.00 0.00 0.00 57.88 58.31 2kk7 h LEU 16 Cb 0.12 0.26 -0.03 0.00 -0.00 0.00 0.00 40.66 41.01 2kk7 h LEU 16 CO -0.16 -0.68 0.31 -0.78 -0.00 0.00 0.00 178.44 177.13 2kk7 h ASP 17 N -1.30 0.79 0.64 -0.43 3.58 -0.17 -1.13 116.42 118.41 2kk7 h ASP 17 Ca -0.12 -0.08 -0.03 0.00 0.42 0.00 0.00 57.03 57.22 2kk7 h ASP 17 Cb 0.93 -0.20 0.01 0.00 1.72 0.00 0.00 39.33 41.78 2kk7 h ASP 17 CO 0.20 0.67 -0.31 -0.78 -2.88 0.00 0.00 179.24 176.15 2kk7 h ASP 18 N 0.88 -0.72 -0.19 2.28 3.58 0.13 0.76 116.42 123.14 2kk7 h ASP 18 Ca 0.22 -0.02 0.05 0.00 0.42 0.00 0.00 57.03 57.70 2kk7 h ASP 18 Cb 0.08 0.19 -0.05 0.00 1.72 0.00 0.00 39.33 41.26 2kk7 h ASP 18 CO -0.03 -0.37 -0.14 0.00 -2.88 0.00 0.00 179.24 175.82 2kk7 h ALA 19 N -0.93 0.01 -0.96 -0.78 0.00 -0.34 0.20 119.26 116.45 2kk7 h ALA 19 Ca -0.09 0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2kk7 h ALA 19 Cb 0.70 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 2kk7 h ALA 19 CO 0.14 -0.57 0.64 0.87 0.00 0.00 0.00 179.25 180.34 2kk7 h LYS 20 N -0.14 1.27 0.14 0.00 1.79 -1.25 -1.58 116.57 116.80 2kk7 h LYS 20 Ca 0.12 -0.08 -0.01 0.00 -2.18 0.00 0.00 60.65 58.50 2kk7 h LYS 20 Cb 0.31 -0.29 0.00 0.00 -1.58 0.00 0.00 32.23 30.68 2kk7 h LYS 20 CO -0.28 0.84 -0.07 0.00 -1.08 0.00 0.00 179.45 178.86 2kk7 h ALA 21 N 1.40 -0.19 -0.87 3.86 0.00 0.06 0.13 119.26 123.65 2kk7 h ALA 21 Ca 0.35 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.22 2kk7 h ALA 21 Cb -0.15 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 2kk7 h ALA 21 CO -0.08 -0.48 0.56 1.49 0.00 0.00 0.00 179.25 180.75 2kk7 h GLU 22 N -0.44 0.81 0.00 0.00 4.81 -0.43 0.19 114.58 119.52 2kk7 h GLU 22 Ca -0.02 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 2kk7 h GLU 22 Cb 0.35 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.55 2kk7 h GLU 22 CO 0.03 0.53 -0.09 0.00 -0.73 0.00 0.00 179.01 178.75 2kk7 h ALA 23 N 1.57 0.94 0.00 2.92 0.00 -1.15 -2.49 119.26 121.05 2kk7 h ALA 23 Ca 0.41 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 55.09 2kk7 h ALA 23 Cb 0.45 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2kk7 h ALA 23 CO -0.17 0.08 -1.01 -0.91 0.00 0.00 0.00 179.25 177.24 2kk7 h ASN 24 N 0.00 0.00 0.96 0.00 2.35 0.16 -2.95 115.58 116.10 2kk7 h ASN 24 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2kk7 h ASN 24 Cb 1.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.42 2kk7 h ASN 24 CO 0.01 0.68 -1.03 0.29 -1.65 0.00 0.00 177.43 175.73 2kk7 n LYS 25 N -3.13 0.60 0.06 0.81 4.76 0.43 -3.51 118.16 118.18 2kk7 n LYS 25 Ca -0.04 0.11 -0.02 0.00 -2.87 0.00 0.00 58.31 55.50 2kk7 n LYS 25 Cb 0.84 -1.82 -0.07 0.00 -1.84 0.00 0.00 35.03 32.15 2kk7 n LYS 25 CO 0.00 0.00 0.00 0.97 -1.37 0.00 0.00 177.40 177.00 2kk7 h ILE 26 N 0.00 0.82 0.04 -0.18 6.09 -1.53 -2.38 117.51 120.38 2kk7 h ILE 26 Ca 0.00 -2.36 -0.22 0.00 -1.37 0.00 0.00 64.86 60.90 2kk7 h ILE 26 Cb 1.00 2.31 -0.02 0.00 0.47 0.00 0.00 36.82 40.58 2kk7 h ILE 26 CO 0.00 0.47 -1.03 0.16 -3.07 0.00 0.00 178.15 174.67 2kk7 h ILE 27 N 0.00 1.60 0.00 2.19 -0.00 -1.64 -2.90 117.51 116.76 2kk7 h ILE 27 Ca -0.12 -3.12 -0.11 0.00 -0.00 0.00 0.00 64.86 61.52 2kk7 h ILE 27 Cb 1.62 2.78 -0.02 0.00 -0.00 0.00 0.00 36.82 41.21 2kk7 h ILE 27 CO 0.07 0.90 -0.60 0.28 -0.00 0.00 0.00 178.15 178.79 2kk7 h SER 28 N 0.04 0.00 -0.01 2.16 0.02 -1.67 -2.89 113.55 111.20 2kk7 h SER 28 Ca -0.05 -0.69 0.00 0.00 -0.84 0.00 0.00 61.79 60.21 2kk7 h SER 28 Cb 1.75 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.29 2kk7 h SER 28 CO 0.15 1.19 0.02 -0.33 -1.14 0.00 0.00 176.83 176.73 2kk7 h GLU 29 N -1.00 0.00 0.00 3.45 4.39 -1.58 -0.22 114.58 119.62 2kk7 h GLU 29 Ca -0.16 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.54 2kk7 h GLU 29 Cb 1.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 2kk7 h GLU 29 CO -0.10 0.00 -0.04 0.00 -1.16 0.00 0.00 179.01 177.71 2kk7 h ALA 30 N 1.97 0.00 -0.93 3.43 0.00 -1.62 -3.08 119.26 119.02 2kk7 h ALA 30 Ca 0.00 -0.13 0.26 0.00 0.00 0.00 0.00 54.91 55.04 2kk7 h ALA 30 Cb 0.04 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2kk7 h ALA 30 CO -0.00 0.04 0.66 1.05 0.00 0.00 0.00 179.25 181.01 2kk7 h GLU 31 N -0.21 0.06 0.00 0.00 -0.00 -1.48 0.26 114.58 113.22 2kk7 h GLU 31 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 2kk7 h GLU 31 Cb 0.04 -0.01 0.00 0.00 -0.00 0.00 0.00 28.75 28.78 2kk7 h GLU 31 CO 0.00 0.04 0.00 0.00 -0.00 0.00 0.00 179.01 179.05 2kk7 n ALA 32 N -2.69 -0.24 -0.17 1.06 0.00 -0.10 -1.76 120.51 116.61 2kk7 n ALA 32 Ca 0.20 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.83 2kk7 n ALA 32 Cb 0.96 0.00 0.56 0.00 0.00 0.00 0.00 19.45 20.97 2kk7 n ALA 32 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2kk7 h GLU 33 N 0.00 0.29 0.28 0.00 5.08 -1.40 -0.15 114.58 118.68 2kk7 h GLU 33 Ca 0.00 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2kk7 h GLU 33 Cb 0.00 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.19 2kk7 h GLU 33 CO 0.00 0.19 -0.14 -0.22 -1.00 0.00 0.00 179.01 177.84 2kk7 h LYS 34 N 0.30 -0.37 0.00 2.33 3.64 -0.55 0.23 116.57 122.15 2kk7 h LYS 34 Ca 0.39 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.80 2kk7 h LYS 34 Cb 1.09 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2kk7 h LYS 34 CO -0.10 -0.25 0.09 0.00 -2.27 0.00 0.00 179.45 176.92 2kk7 h ALA 35 N -1.77 1.08 0.00 5.00 0.00 -1.04 0.41 119.26 122.95 2kk7 h ALA 35 Ca -0.04 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2kk7 h ALA 35 Cb 0.29 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2kk7 h ALA 35 CO 0.06 -0.08 -0.17 0.87 0.00 0.00 0.00 179.25 179.93 2kk7 h LYS 36 N 0.00 0.00 0.00 0.00 1.57 -0.81 -3.18 116.57 114.15 2kk7 h LYS 36 Ca 0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 2kk7 h LYS 36 Cb 0.18 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 2kk7 h LYS 36 CO 0.00 0.84 -0.65 -0.84 -0.57 0.00 0.00 179.45 178.23 2kk7 h ILE 37 N -1.00 1.40 -0.69 1.86 3.07 0.10 0.58 117.51 122.83 2kk7 h ILE 37 Ca -0.04 -2.26 -0.06 0.00 1.55 0.00 0.00 64.86 64.04 2kk7 h ILE 37 Cb 0.89 2.24 -0.03 0.00 -0.27 0.00 0.00 36.82 39.65 2kk7 h ILE 37 CO -0.03 0.63 0.20 -0.07 -1.05 0.00 0.00 178.15 177.83 2kk7 h LEU 38 N 0.00 1.01 0.03 0.16 -0.00 -0.34 0.42 115.31 116.58 2kk7 h LEU 38 Ca -0.01 -0.19 -0.30 0.00 -0.00 0.00 0.00 57.88 57.38 2kk7 h LEU 38 Cb 1.19 -0.26 -0.04 0.00 -0.00 0.00 0.00 40.66 41.55 2kk7 h LEU 38 CO 0.08 0.95 -1.73 -0.33 -0.00 0.00 0.00 178.44 177.41 2kk7 h GLU 39 N 1.03 0.06 -0.08 1.13 4.39 -1.52 -3.04 114.58 116.55 2kk7 h GLU 39 Ca 0.22 -0.11 -0.07 0.00 0.34 0.00 0.00 59.36 59.74 2kk7 h GLU 39 Cb 0.32 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 2kk7 h GLU 39 CO -0.00 0.68 -0.22 0.87 -1.16 0.00 0.00 179.01 179.17 2kk7 h LYS 40 N 0.02 0.30 0.28 2.33 1.57 -0.80 -2.38 116.57 117.89 2kk7 h LYS 40 Ca -0.30 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.25 2kk7 h LYS 40 Cb 2.01 0.03 0.00 0.00 0.08 0.00 0.00 32.23 34.36 2kk7 h LYS 40 CO 0.09 0.82 -0.13 0.00 -0.57 0.00 0.00 179.45 179.66 2kk7 h ALA 41 N 0.48 -0.37 -0.47 3.86 0.00 -0.34 0.29 119.26 122.70 2kk7 h ALA 41 Ca -0.00 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 54.85 2kk7 h ALA 41 Cb 0.84 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2kk7 h ALA 41 CO 0.05 -0.50 0.38 0.87 0.00 0.00 0.00 179.25 180.05 2kk7 h LYS 42 N -0.80 0.00 0.00 0.00 1.79 -1.66 0.36 116.57 116.27 2kk7 h LYS 42 Ca -0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 2kk7 h LYS 42 Cb 0.51 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.16 2kk7 h LYS 42 CO 0.06 0.00 -0.18 1.49 -1.08 0.00 0.00 179.45 179.74 2kk7 h GLU 43 N 0.00 0.00 -0.96 3.15 4.81 -1.32 -2.75 114.58 117.51 2kk7 h GLU 43 Ca 0.22 0.00 0.21 0.00 -0.13 0.00 0.00 59.36 59.66 2kk7 h GLU 43 Cb 0.99 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.29 2kk7 h GLU 43 CO -0.00 0.00 0.62 1.05 -0.73 0.00 0.00 179.01 179.95 2kk7 h GLU 44 N -0.69 0.49 -0.13 1.92 4.11 -0.27 0.11 114.58 120.11 2kk7 h GLU 44 Ca 0.00 -0.03 -0.22 0.00 0.07 0.00 0.00 59.36 59.18 2kk7 h GLU 44 Cb 0.18 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 29.33 2kk7 h GLU 44 CO 0.00 0.32 -0.76 0.00 0.07 0.00 0.00 179.01 178.64 2kk7 h ALA 45 N 1.62 0.27 -0.70 1.06 0.00 -0.45 0.12 119.26 121.19 2kk7 h ALA 45 Ca 0.52 -0.60 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2kk7 h ALA 45 Cb 1.15 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 2kk7 h ALA 45 CO -0.25 0.64 0.19 0.93 0.00 0.00 0.00 179.25 180.76 2kk7 h GLU 46 N 0.47 1.10 0.03 0.00 5.08 -0.66 -2.45 114.58 118.14 2kk7 h GLU 46 Ca -0.06 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.05 2kk7 h GLU 46 Cb 1.40 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2kk7 h GLU 46 CO 0.16 0.96 -0.02 0.87 -1.00 0.00 0.00 179.01 179.98 2kk7 h LYS 47 N 1.03 -0.04 -2.29 2.33 1.79 -0.92 -3.36 116.57 115.11 2kk7 h LYS 47 Ca 0.22 0.00 -0.49 0.00 -2.18 0.00 0.00 60.65 58.21 2kk7 h LYS 47 Cb 0.34 0.01 -0.10 0.00 -1.58 0.00 0.00 32.23 30.90 2kk7 h LYS 47 CO -0.00 -0.03 1.16 0.54 -1.08 0.00 0.00 179.45 180.04 2kk7 n ARG 48 N -4.59 2.96 -1.40 3.15 5.12 0.41 -4.97 116.66 117.34 2kk7 n ARG 48 Ca -0.01 -2.16 -0.36 0.00 -1.93 0.00 0.00 57.85 53.40 2kk7 n ARG 48 Cb 0.02 -2.31 0.08 0.00 -1.16 0.00 0.00 32.46 29.08 2kk7 n ARG 48 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2kk7 n LYS 49 N 1.98 0.55 -4.66 5.56 4.76 -0.92 -4.73 118.16 120.69 2kk7 n LYS 49 Ca 0.55 0.24 -0.30 0.00 -2.87 0.00 0.00 58.31 55.93 2kk7 n LYS 49 Cb 0.54 -2.13 -0.08 0.00 -1.84 0.00 0.00 35.03 31.52 2kk7 n LYS 49 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2kk7 s ALA 50 N -1.77 3.59 0.30 7.82 0.00 -1.26 -5.04 121.76 125.40 2kk7 s ALA 50 Ca 0.73 -0.88 0.04 0.00 0.00 0.00 0.00 51.96 51.84 2kk7 s ALA 50 Cb -0.36 0.29 0.48 0.00 0.00 0.00 0.00 23.12 23.53 2kk7 s ALA 50 CO 0.51 -0.14 1.76 0.93 0.00 0.00 0.00 175.76 178.82 2kk7 h GLU 51 N 1.56 0.44 0.00 0.00 5.08 -2.03 -3.54 114.58 116.09 2kk7 h GLU 51 Ca -0.41 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 2kk7 h GLU 51 Cb 1.29 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.51 2kk7 h GLU 51 CO 0.69 0.64 0.00 -0.89 -1.00 0.00 0.00 179.01 178.45