#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kk7 h ALA 2 N 0.00 2.38 0.00 -5.12 0.00 -2.06 0.24 119.26 114.70 2kk7 h ALA 2 Ca 0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2kk7 h ALA 2 Cb 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2kk7 h ALA 2 CO 0.00 -0.58 -0.62 0.28 0.00 0.00 0.00 179.25 178.33 2kk7 h VAL 3 N 0.20 0.83 -0.01 0.00 2.07 -2.00 -3.24 116.25 114.09 2kk7 h VAL 3 Ca 0.35 -2.20 0.00 0.00 0.82 0.00 0.00 66.70 65.67 2kk7 h VAL 3 Cb 1.08 2.38 -0.00 0.00 -1.52 0.00 0.00 31.29 33.23 2kk7 h VAL 3 CO -0.07 0.47 0.01 0.50 0.02 0.00 0.00 177.57 178.50 2kk7 h LYS 4 N 0.00 0.00 -0.34 1.57 1.63 -0.99 -2.59 116.57 115.85 2kk7 h LYS 4 Ca -0.02 0.00 0.07 0.00 -0.85 0.00 0.00 60.65 59.85 2kk7 h LYS 4 Cb 1.41 0.00 -0.07 0.00 -0.60 0.00 0.00 32.23 32.97 2kk7 h LYS 4 CO 0.06 0.00 -0.13 -0.07 -3.45 0.00 0.00 179.45 175.86 2kk7 h LEU 5 N 0.00 -0.46 0.00 5.20 4.07 -1.57 -3.45 115.31 119.10 2kk7 h LEU 5 Ca 0.00 0.12 0.00 0.00 0.08 0.00 0.00 57.88 58.08 2kk7 h LEU 5 Cb 0.02 0.27 0.00 0.00 1.08 0.00 0.00 40.66 42.03 2kk7 h LEU 5 CO -0.00 -0.17 0.00 1.15 -1.08 0.00 0.00 178.44 178.34 2kk7 n MET 6 N -5.32 0.00 0.00 1.13 0.00 -0.98 -5.04 117.12 106.91 2kk7 n MET 6 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.71 2kk7 n MET 6 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.45 2kk7 n MET 6 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2kk7 n GLY 7 N -0.27 0.92 0.27 3.17 0.00 -1.16 -5.02 105.19 103.10 2kk7 n GLY 7 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 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 1.13 0.00 1.61 2.07 -1.87 -1.51 116.25 117.67 2kk7 h VAL 8 Ca 0.00 -0.48 -0.07 0.00 0.82 0.00 0.00 66.70 66.97 2kk7 h VAL 8 Cb 0.00 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2kk7 h VAL 8 CO 0.00 0.17 -0.36 0.44 0.02 0.00 0.00 177.57 177.84 2kk7 h ASP 9 N 0.34 0.00 0.02 0.57 5.19 -1.95 0.43 116.42 121.01 2kk7 h ASP 9 Ca 0.08 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.49 2kk7 h ASP 9 Cb 0.17 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.68 2kk7 h ASP 9 CO -0.00 0.36 -0.01 0.11 -3.12 0.00 0.00 179.24 176.58 2kk7 h LYS 10 N 0.00 -0.02 -0.50 3.56 1.57 -1.69 -2.19 116.57 117.30 2kk7 h LYS 10 Ca -0.00 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.68 2kk7 h LYS 10 Cb 0.70 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.00 2kk7 h LYS 10 CO 0.05 0.74 -0.06 -0.84 -0.57 0.00 0.00 179.45 178.76 2kk7 h ILE 11 N -0.87 1.26 0.00 1.86 -0.00 -1.40 0.40 117.51 118.76 2kk7 h ILE 11 Ca -0.00 -1.15 -0.08 0.00 -0.00 0.00 0.00 64.86 63.62 2kk7 h ILE 11 Cb 0.77 0.94 -0.01 0.00 -0.00 0.00 0.00 36.82 38.52 2kk7 h ILE 11 CO 0.00 0.40 -0.40 0.50 -0.00 0.00 0.00 178.15 178.66 2kk7 h LYS 12 N 0.80 0.00 0.00 0.16 3.11 -1.02 -3.00 116.57 116.62 2kk7 h LYS 12 Ca 0.14 0.00 -0.15 0.00 -2.81 0.00 0.00 60.65 57.83 2kk7 h LYS 12 Cb 0.57 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.77 2kk7 h LYS 12 CO 0.03 0.40 -1.40 0.43 -2.81 0.00 0.00 179.45 176.10 2kk7 n SER 13 N -3.68 0.83 0.10 4.20 7.64 -0.82 -3.45 113.62 118.45 2kk7 n SER 13 Ca -0.01 0.36 -0.04 0.00 1.01 0.00 0.00 58.87 60.19 2kk7 n SER 13 Cb 0.49 0.23 -0.02 0.00 -1.01 0.00 0.00 64.21 63.90 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 -0.26 -0.98 1.43 3.11 -0.07 0.33 116.57 120.14 2kk7 h LYS 14 Ca -0.15 0.02 0.04 0.00 -2.81 0.00 0.00 60.65 57.75 2kk7 h LYS 14 Cb 1.53 0.06 -0.06 0.00 -1.00 0.00 0.00 32.23 32.76 2kk7 h LYS 14 CO 0.04 -0.17 0.63 0.82 -2.81 0.00 0.00 179.45 177.96 2kk7 h ILE 15 N -0.29 1.15 0.86 2.00 5.03 -1.76 0.50 117.51 125.00 2kk7 h ILE 15 Ca -0.03 -0.42 -0.04 0.00 -0.12 0.00 0.00 64.86 64.25 2kk7 h ILE 15 Cb 0.20 -0.17 0.01 0.00 -3.03 0.00 0.00 36.82 33.83 2kk7 h ILE 15 CO 0.04 0.22 -0.41 -0.07 -0.68 0.00 0.00 178.15 177.25 2kk7 h LEU 16 N 1.21 -0.98 -1.10 1.44 3.38 -1.58 0.29 115.31 117.98 2kk7 h LEU 16 Ca 0.40 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.36 2kk7 h LEU 16 Cb 0.04 0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2kk7 h LEU 16 CO -0.13 -0.66 0.27 -0.78 0.09 0.00 0.00 178.44 177.23 2kk7 h ASP 17 N -1.23 0.83 0.61 -0.43 3.58 -0.19 0.22 116.42 119.81 2kk7 h ASP 17 Ca -0.12 -0.10 -0.03 0.00 0.42 0.00 0.00 57.03 57.20 2kk7 h ASP 17 Cb 0.89 -0.21 0.01 0.00 1.72 0.00 0.00 39.33 41.73 2kk7 h ASP 17 CO 0.19 0.73 -0.29 -0.78 -2.88 0.00 0.00 179.24 176.21 2kk7 h ASP 18 N 0.90 -0.69 -0.75 2.28 3.58 0.10 0.23 116.42 122.05 2kk7 h ASP 18 Ca 0.22 -0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.62 2kk7 h ASP 18 Cb 0.14 0.18 -0.04 0.00 1.72 0.00 0.00 39.33 41.34 2kk7 h ASP 18 CO -0.02 -0.36 0.39 0.00 -2.88 0.00 0.00 179.24 176.37 2kk7 h ALA 19 N -0.82 0.97 -0.63 -0.78 0.00 -0.34 -1.02 119.26 116.64 2kk7 h ALA 19 Ca -0.08 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 2kk7 h ALA 19 Cb 0.68 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2kk7 h ALA 19 CO 0.14 0.51 0.11 0.87 0.00 0.00 0.00 179.25 180.87 2kk7 h LYS 20 N 1.05 1.03 -0.59 0.00 1.57 -0.56 -2.46 116.57 116.61 2kk7 h LYS 20 Ca 0.26 -0.27 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 2kk7 h LYS 20 Cb 0.07 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 2kk7 h LYS 20 CO -0.04 0.96 0.04 0.00 -0.57 0.00 0.00 179.45 179.84 2kk7 h ALA 21 N 1.03 0.79 -0.90 3.86 0.00 -0.22 0.55 119.26 124.37 2kk7 h ALA 21 Ca 0.19 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2kk7 h ALA 21 Cb 0.42 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 2kk7 h ALA 21 CO 0.01 0.59 0.56 1.49 0.00 0.00 0.00 179.25 181.90 2kk7 h GLU 22 N 0.91 1.21 0.00 0.00 4.81 -1.02 0.26 114.58 120.75 2kk7 h GLU 22 Ca 0.17 -0.10 -0.04 0.00 -0.13 0.00 0.00 59.36 59.27 2kk7 h GLU 22 Cb 0.50 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 2kk7 h GLU 22 CO 0.02 0.84 -0.20 0.00 -0.73 0.00 0.00 179.01 178.94 2kk7 h ALA 23 N 1.31 0.88 0.00 2.92 0.00 -1.26 -2.51 119.26 120.59 2kk7 h ALA 23 Ca 0.33 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 2kk7 h ALA 23 Cb -0.08 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2kk7 h ALA 23 CO -0.06 0.22 -0.93 -0.91 0.00 0.00 0.00 179.25 177.57 2kk7 h ASN 24 N 0.00 0.00 0.95 0.00 2.35 -0.12 -2.95 115.58 115.82 2kk7 h ASN 24 Ca -0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 2kk7 h ASN 24 Cb 1.13 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.50 2kk7 h ASN 24 CO 0.02 0.59 -1.05 1.17 -1.65 0.00 0.00 177.43 176.51 2kk7 n LYS 25 N -3.10 0.61 0.05 0.81 3.00 0.84 -3.53 118.16 116.83 2kk7 n LYS 25 Ca -0.03 0.12 -0.02 0.00 -0.00 0.00 0.00 58.31 58.38 2kk7 n LYS 25 Cb 0.80 -1.82 -0.07 0.00 0.00 0.00 0.00 35.03 33.94 2kk7 n LYS 25 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.40 178.37 2kk7 h ILE 26 N 0.00 0.81 0.03 3.15 6.09 -1.53 -2.66 117.51 123.40 2kk7 h ILE 26 Ca -0.01 -2.35 -0.21 0.00 -1.37 0.00 0.00 64.86 60.92 2kk7 h ILE 26 Cb 1.03 2.30 -0.02 0.00 0.47 0.00 0.00 36.82 40.60 2kk7 h ILE 26 CO 0.00 0.46 -0.98 0.16 -3.07 0.00 0.00 178.15 174.72 2kk7 h ILE 27 N 0.00 1.59 0.00 2.19 -0.00 -1.64 -2.83 117.51 116.82 2kk7 h ILE 27 Ca -0.12 -3.03 -0.05 0.00 -0.00 0.00 0.00 64.86 61.66 2kk7 h ILE 27 Cb 1.63 2.71 -0.01 0.00 -0.00 0.00 0.00 36.82 41.15 2kk7 h ILE 27 CO 0.07 0.87 -0.33 0.77 -0.00 0.00 0.00 178.15 179.53 2kk7 h SER 28 N 0.04 0.00 -0.03 2.16 4.64 -1.67 -2.71 113.55 115.99 2kk7 h SER 28 Ca -0.04 -0.66 0.01 0.00 -0.47 0.00 0.00 61.79 60.62 2kk7 h SER 28 Cb 1.68 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.77 2kk7 h SER 28 CO 0.14 1.02 0.04 -0.08 -0.87 0.00 0.00 176.83 177.09 2kk7 h GLU 29 N -1.00 0.00 0.00 4.77 4.57 -1.62 0.00 114.58 121.30 2kk7 h GLU 29 Ca -0.08 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 2kk7 h GLU 29 Cb 0.88 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.47 2kk7 h GLU 29 CO -0.05 0.00 -0.04 0.00 -1.18 0.00 0.00 179.01 177.74 2kk7 h ALA 30 N 1.93 0.00 -0.75 2.92 0.00 -1.60 -3.08 119.26 118.68 2kk7 h ALA 30 Ca 0.01 -0.10 0.22 0.00 0.00 0.00 0.00 54.91 55.04 2kk7 h ALA 30 Cb 0.10 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2kk7 h ALA 30 CO -0.00 0.04 0.59 0.93 0.00 0.00 0.00 179.25 180.82 2kk7 h GLU 31 N -0.27 0.00 0.00 0.00 4.39 -1.44 0.24 114.58 117.50 2kk7 h GLU 31 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2kk7 h GLU 31 Cb 0.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 2kk7 h GLU 31 CO 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.85 2kk7 n ALA 32 N -2.60 -0.22 -0.29 3.43 0.00 -0.02 -1.74 120.51 119.07 2kk7 n ALA 32 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.70 2kk7 n ALA 32 Cb 0.87 0.00 0.35 0.00 0.00 0.00 0.00 19.45 20.67 2kk7 n ALA 32 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2kk7 h GLU 33 N 0.00 0.73 0.65 0.00 -0.00 -1.40 -0.66 114.58 113.90 2kk7 h GLU 33 Ca 0.00 -0.04 -0.03 0.00 -0.00 0.00 0.00 59.36 59.28 2kk7 h GLU 33 Cb 0.00 -0.16 0.00 0.00 -0.00 0.00 0.00 28.75 28.59 2kk7 h GLU 33 CO 0.00 0.48 -0.33 -0.22 -0.00 0.00 0.00 179.01 178.94 2kk7 h LYS 34 N 0.75 -0.86 0.00 1.06 3.64 -0.64 0.23 116.57 120.76 2kk7 h LYS 34 Ca 0.47 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.91 2kk7 h LYS 34 Cb 0.70 0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 2kk7 h LYS 34 CO -0.23 -0.57 0.05 0.00 -2.27 0.00 0.00 179.45 176.43 2kk7 h ALA 35 N -1.54 1.04 0.00 5.00 0.00 -1.02 0.41 119.26 123.15 2kk7 h ALA 35 Ca -0.09 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2kk7 h ALA 35 Cb 0.69 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2kk7 h ALA 35 CO 0.14 -0.04 -0.30 -0.22 0.00 0.00 0.00 179.25 178.83 2kk7 h LYS 36 N 0.00 0.00 0.00 0.00 3.64 -0.54 -3.18 116.57 116.49 2kk7 h LYS 36 Ca 0.00 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.24 2kk7 h LYS 36 Cb 0.10 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 2kk7 h LYS 36 CO 0.00 0.80 -0.65 -0.84 -2.27 0.00 0.00 179.45 176.49 2kk7 h ILE 37 N -1.00 1.40 -0.55 2.00 3.07 0.01 0.95 117.51 123.39 2kk7 h ILE 37 Ca -0.08 -2.29 -0.08 0.00 1.55 0.00 0.00 64.86 63.97 2kk7 h ILE 37 Cb 0.89 2.26 -0.02 0.00 -0.27 0.00 0.00 36.82 39.68 2kk7 h ILE 37 CO -0.05 0.64 0.03 -0.07 -1.05 0.00 0.00 178.15 177.65 2kk7 h LEU 38 N 0.00 0.88 0.00 0.16 -0.00 -0.36 0.38 115.31 116.37 2kk7 h LEU 38 Ca -0.01 -0.22 -0.30 0.00 -0.00 0.00 0.00 57.88 57.36 2kk7 h LEU 38 Cb 1.20 -0.23 -0.05 0.00 -0.00 0.00 0.00 40.66 41.58 2kk7 h LEU 38 CO 0.08 0.92 -1.74 -1.84 -0.00 0.00 0.00 178.44 175.87 2kk7 n GLU 39 N -4.21 0.63 -0.02 1.13 -0.00 -1.19 -3.23 120.64 113.75 2kk7 n GLU 39 Ca 0.03 0.29 -0.15 0.00 -0.00 0.00 0.00 57.16 57.32 2kk7 n GLU 39 Cb 0.30 -1.78 -0.10 0.00 -0.00 0.00 0.00 31.44 29.86 2kk7 n GLU 39 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 2kk7 h LYS 40 N 0.00 0.28 0.50 3.44 3.64 -0.73 -2.55 116.57 121.15 2kk7 h LYS 40 Ca -0.30 -0.26 -0.02 0.00 -1.27 0.00 0.00 60.65 58.80 2kk7 h LYS 40 Cb 2.03 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.91 2kk7 h LYS 40 CO 0.08 0.94 -0.24 0.00 -2.27 0.00 0.00 179.45 177.95 2kk7 h ALA 41 N 0.35 -0.68 -0.56 5.00 0.00 -0.43 0.28 119.26 123.22 2kk7 h ALA 41 Ca -0.03 -0.19 0.15 0.00 0.00 0.00 0.00 54.91 54.83 2kk7 h ALA 41 Cb 1.03 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 2kk7 h ALA 41 CO 0.07 -0.75 0.40 0.87 0.00 0.00 0.00 179.25 179.83 2kk7 h LYS 42 N -0.94 0.08 0.01 0.00 6.56 -1.69 0.38 116.57 120.97 2kk7 h LYS 42 Ca -0.07 -0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.52 2kk7 h LYS 42 Cb 0.60 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.25 2kk7 h LYS 42 CO 0.11 0.05 -0.00 1.49 -2.06 0.00 0.00 179.45 179.04 2kk7 h GLU 43 N 0.08 -0.01 -0.97 3.15 4.81 -1.28 -2.34 114.58 118.02 2kk7 h GLU 43 Ca 0.27 0.00 0.20 0.00 -0.13 0.00 0.00 59.36 59.70 2kk7 h GLU 43 Cb 0.96 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 30.25 2kk7 h GLU 43 CO -0.02 -0.01 0.62 1.05 -0.73 0.00 0.00 179.01 179.92 2kk7 h GLU 44 N -0.49 0.57 -0.24 1.92 4.11 -0.31 0.17 114.58 120.31 2kk7 h GLU 44 Ca -0.00 -0.03 -0.17 0.00 0.07 0.00 0.00 59.36 59.22 2kk7 h GLU 44 Cb 0.01 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.13 2kk7 h GLU 44 CO 0.00 0.38 -0.54 0.00 0.07 0.00 0.00 179.01 178.92 2kk7 h ALA 45 N 1.62 0.59 0.03 1.06 0.00 -0.30 0.29 119.26 122.54 2kk7 h ALA 45 Ca 0.53 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2kk7 h ALA 45 Cb 1.07 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2kk7 h ALA 45 CO -0.28 0.68 -0.01 0.93 0.00 0.00 0.00 179.25 180.57 2kk7 h GLU 46 N 0.55 -0.03 -0.19 0.00 4.39 -0.26 -3.30 114.58 115.74 2kk7 h GLU 46 Ca 0.01 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.61 2kk7 h GLU 46 Cb 1.12 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.77 2kk7 h GLU 46 CO 0.11 0.39 -0.28 1.57 -1.16 0.00 0.00 179.01 179.63 2kk7 h LYS 47 N -0.46 0.54 -6.00 2.33 2.10 -0.85 -3.44 116.57 110.78 2kk7 h LYS 47 Ca -0.00 -0.32 -0.69 0.00 -2.00 0.00 0.00 60.65 57.64 2kk7 h LYS 47 Cb 0.44 0.03 -0.31 0.00 -0.90 0.00 0.00 32.23 31.48 2kk7 h LYS 47 CO 0.01 0.92 -0.89 1.03 -2.00 0.00 0.00 179.45 178.52 2kk7 s ARG 48 N -4.17 2.55 0.52 0.07 0.52 0.10 -5.09 118.95 113.46 2kk7 s ARG 48 Ca -0.13 -0.91 -0.21 0.00 -0.52 0.00 0.00 55.73 53.97 2kk7 s ARG 48 Cb 0.07 -2.16 -0.08 0.00 0.52 0.00 0.00 34.95 33.30 2kk7 s ARG 48 CO 0.80 0.38 0.92 0.36 0.02 0.00 0.00 175.30 177.78 2kk7 n LYS 49 N 2.95 1.03 0.00 3.54 2.85 -1.25 -3.60 118.16 123.68 2kk7 n LYS 49 Ca -0.17 0.38 0.00 0.00 -1.05 0.00 0.00 58.31 57.47 2kk7 n LYS 49 Cb 0.52 -2.05 0.00 0.00 -0.65 0.00 0.00 35.03 32.85 2kk7 n LYS 49 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2kk7 n ALA 50 N -1.20 1.58 -0.07 0.58 0.00 -1.26 -4.90 120.51 115.23 2kk7 n ALA 50 Ca 0.11 0.00 0.23 0.00 0.00 0.00 0.00 53.44 53.78 2kk7 n ALA 50 Cb 0.44 0.00 0.69 0.00 0.00 0.00 0.00 19.45 20.58 2kk7 n ALA 50 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2kk7 h GLU 51 N 0.00 0.02 -0.02 0.00 4.39 -1.91 -3.53 114.58 113.53 2kk7 h GLU 51 Ca 0.00 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2kk7 h GLU 51 Cb 0.00 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 2kk7 h GLU 51 CO 0.00 0.02 0.00 -0.89 -1.16 0.00 0.00 179.01 176.98