#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kdz n VAL 2 N 0.00 0.10 -1.84 3.15 0.24 -1.26 -5.07 118.33 113.65 2kdz n VAL 2 Ca 0.00 -0.46 0.16 0.00 -2.04 0.00 0.00 64.34 62.01 2kdz n VAL 2 Cb 0.00 1.04 -0.04 0.00 -1.47 0.00 0.00 33.84 33.37 2kdz n VAL 2 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2kdz n LYS 3 N 0.96 -2.37 -1.21 7.34 5.02 -1.26 -5.03 118.16 121.60 2kdz n LYS 3 Ca 0.16 1.56 0.16 0.00 -2.02 0.00 0.00 58.31 58.18 2kdz n LYS 3 Cb 0.51 -2.90 -0.05 0.00 -0.02 0.00 0.00 35.03 32.57 2kdz n LYS 3 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2kdz n PHE 4 N -3.76 -3.11 0.00 2.13 -0.00 -1.26 -5.09 117.46 106.37 2kdz n PHE 4 Ca 0.01 1.61 0.00 0.00 -0.00 0.00 0.00 57.45 59.07 2kdz n PHE 4 Cb 0.54 -2.83 0.00 0.00 -0.00 0.00 0.00 39.48 37.19 2kdz n PHE 4 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.76 174.39 2kdz n THR 5 N -3.92 0.00 -0.20 -2.13 5.66 -1.26 -4.98 114.28 107.44 2kdz n THR 5 Ca -0.02 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.91 2kdz n THR 5 Cb 0.56 0.00 0.03 0.00 -1.55 0.00 0.00 70.33 69.37 2kdz n THR 5 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 2kdz h GLU 6 N 0.00 0.78 -0.01 1.09 5.08 -1.99 -1.69 114.58 117.84 2kdz h GLU 6 Ca 0.00 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.32 2kdz h GLU 6 Cb 0.00 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 2kdz h GLU 6 CO 0.00 0.55 -0.12 0.93 -1.00 0.00 0.00 179.01 179.37 2kdz h GLU 7 N 0.78 -0.18 -0.21 2.33 5.08 -1.99 -0.55 114.58 119.83 2kdz h GLU 7 Ca 0.21 0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.52 2kdz h GLU 7 Cb -0.03 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 2kdz h GLU 7 CO -0.04 -0.12 -0.12 0.93 -1.00 0.00 0.00 179.01 178.66 2kdz h GLU 8 N -0.19 0.34 -0.36 2.33 4.39 -1.92 -1.48 114.58 117.70 2kdz h GLU 8 Ca 0.05 -0.08 -0.06 0.00 0.34 0.00 0.00 59.36 59.61 2kdz h GLU 8 Cb 0.25 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 2kdz h GLU 8 CO -0.13 0.47 0.00 0.22 -1.16 0.00 0.00 179.01 178.42 2kdz h ASP 9 N 0.32 0.62 -0.61 1.42 3.58 -0.74 0.13 116.42 121.13 2kdz h ASP 9 Ca 0.06 -0.31 -0.06 0.00 0.42 0.00 0.00 57.03 57.15 2kdz h ASP 9 Cb 0.41 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 41.27 2kdz h ASP 9 CO 0.02 0.77 0.16 -0.07 -2.88 0.00 0.00 179.24 177.24 2kdz h LEU 10 N 0.44 0.95 -1.07 2.28 3.38 -0.80 -2.05 115.31 118.44 2kdz h LEU 10 Ca 0.10 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 2kdz h LEU 10 Cb 0.45 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2kdz h LEU 10 CO 0.02 0.91 -0.16 0.11 0.09 0.00 0.00 178.44 179.41 2kdz h LYS 11 N 0.96 0.47 -0.06 1.13 1.57 -1.01 -2.97 116.57 116.65 2kdz h LYS 11 Ca 0.20 -0.14 0.02 0.00 -1.87 0.00 0.00 60.65 58.86 2kdz h LYS 11 Cb 0.34 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 2kdz h LYS 11 CO -0.00 0.62 -0.07 1.25 -0.57 0.00 0.00 179.45 180.68 2kdz h LEU 12 N 0.43 -0.22 -1.03 2.94 5.85 -0.24 0.29 115.31 123.33 2kdz h LEU 12 Ca 0.08 0.04 0.08 0.00 0.84 0.00 0.00 57.88 58.92 2kdz h LEU 12 Cb 0.53 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.60 2kdz h LEU 12 CO 0.03 -0.10 0.64 -0.61 -0.34 0.00 0.00 178.44 178.06 2kdz h GLN 13 N -0.09 1.07 -0.06 1.25 5.75 -1.36 0.29 115.11 121.96 2kdz h GLN 13 Ca 0.05 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.46 2kdz h GLN 13 Cb 0.17 -0.24 -0.00 0.00 1.07 0.00 0.00 27.48 28.47 2kdz h GLN 13 CO -0.12 0.71 -0.07 1.96 -2.65 0.00 0.00 178.83 178.66 2kdz h GLN 14 N 1.10 0.15 -0.72 1.69 1.08 -1.24 -2.68 115.11 114.50 2kdz h GLN 14 Ca 0.45 -0.08 -0.07 0.00 -1.45 0.00 0.00 58.65 57.49 2kdz h GLN 14 Cb 0.27 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.67 2kdz h GLN 14 CO -0.19 0.62 0.17 -0.07 -0.95 0.00 0.00 178.83 178.41 2kdz h LEU 15 N -0.31 1.09 -1.18 1.46 4.07 -0.07 -2.67 115.31 117.70 2kdz h LEU 15 Ca 0.01 -0.23 0.01 0.00 0.08 0.00 0.00 57.88 57.74 2kdz h LEU 15 Cb 0.60 -0.29 -0.04 0.00 1.08 0.00 0.00 40.66 42.01 2kdz h LEU 15 CO 0.02 1.04 0.55 0.58 -1.08 0.00 0.00 178.44 179.55 2kdz h VAL 16 N 1.09 1.22 -0.19 1.22 2.07 -0.47 0.59 116.25 121.77 2kdz h VAL 16 Ca 0.23 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 2kdz h VAL 16 Cb 0.38 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 2kdz h VAL 16 CO 0.00 0.21 0.05 -0.03 0.02 0.00 0.00 177.57 177.82 2kdz h MET 17 N 1.14 0.27 0.04 1.57 1.85 -1.12 0.41 114.93 119.08 2kdz h MET 17 Ca 0.31 -0.03 -0.31 0.00 -0.61 0.00 0.00 59.70 59.06 2kdz h MET 17 Cb -0.13 -0.05 -0.04 0.00 0.43 0.00 0.00 31.60 31.81 2kdz h MET 17 CO -0.07 0.25 -1.76 0.00 -0.40 0.00 0.00 176.91 174.94 2kdz h ARG 18 N 0.27 0.08 0.00 0.39 3.08 -1.20 -3.38 114.38 113.62 2kdz h ARG 18 Ca 0.07 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2kdz h ARG 18 Cb 0.10 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.20 2kdz h ARG 18 CO -0.00 0.71 -1.27 0.66 -1.07 0.00 0.00 179.97 179.00 2kdz n TYR 19 N -3.18 0.42 0.00 3.04 4.01 0.09 -5.06 117.16 116.48 2kdz n TYR 19 Ca -0.20 0.12 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 2kdz n TYR 19 Cb 1.05 -0.61 0.00 0.00 -0.31 0.00 0.00 39.34 39.46 2kdz n TYR 19 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2kdz n GLY 20 N 1.28 1.01 0.82 2.72 0.00 0.14 -4.16 105.19 107.01 2kdz n GLY 20 Ca -0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 46.02 45.08 2kdz n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kdz n ALA 21 N 2.64 3.09 0.00 4.61 0.00 -1.26 -4.60 120.51 124.99 2kdz n ALA 21 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.98 2kdz n ALA 21 Cb 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 19.45 19.24 2kdz n ALA 21 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2kdz n LYS 22 N 0.01 0.00 -1.02 0.00 4.81 -1.26 -4.89 118.16 115.80 2kdz n LYS 22 Ca -0.17 0.00 -0.26 0.00 -0.87 0.00 0.00 58.31 57.01 2kdz n LYS 22 Cb 0.63 -0.43 -0.06 0.00 0.02 0.00 0.00 35.03 35.20 2kdz n LYS 22 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2kdz n ASP 23 N -2.00 6.50 0.22 3.14 2.03 -1.26 -4.46 116.55 120.72 2kdz n ASP 23 Ca 0.00 -2.43 0.15 0.00 0.52 0.00 0.00 54.79 53.03 2kdz n ASP 23 Cb 0.10 -1.33 0.53 0.00 -0.72 0.00 0.00 41.12 39.71 2kdz n ASP 23 CO 0.00 0.00 0.00 -0.50 -1.92 0.00 0.00 177.20 174.78 2kdz h TRP 24 N 4.96 0.00 0.00 -0.67 4.06 -1.92 -2.93 115.95 119.45 2kdz h TRP 24 Ca 0.57 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 61.46 2kdz h TRP 24 Cb 0.52 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.67 2kdz h TRP 24 CO 1.85 0.00 -0.31 -0.84 -3.56 0.00 0.00 178.44 175.57 2kdz h ILE 25 N 0.00 1.20 0.00 1.49 3.07 -1.93 -0.49 117.51 120.85 2kdz h ILE 25 Ca 0.00 -1.08 -0.04 0.00 1.55 0.00 0.00 64.86 65.29 2kdz h ILE 25 Cb 0.59 1.59 -0.01 0.00 -0.27 0.00 0.00 36.82 38.72 2kdz h ILE 25 CO 0.00 0.31 -0.20 -0.09 -1.05 0.00 0.00 178.15 177.12 2kdz h ARG 26 N 0.00 0.00 0.00 0.16 9.65 -1.90 -1.35 114.38 120.94 2kdz h ARG 26 Ca -0.00 0.00 -0.22 0.00 -1.10 0.00 0.00 59.98 58.66 2kdz h ARG 26 Cb 0.56 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.11 2kdz h ARG 26 CO 0.04 0.20 -1.21 0.82 2.80 0.00 0.00 179.97 182.61 2kdz h ILE 27 N 0.00 1.23 0.00 1.20 2.04 -1.30 -3.25 117.51 117.42 2kdz h ILE 27 Ca -0.00 -2.92 0.00 0.00 1.00 0.00 0.00 64.86 62.93 2kdz h ILE 27 Cb 0.43 2.59 0.00 0.00 -0.74 0.00 0.00 36.82 39.10 2kdz h ILE 27 CO 0.03 0.70 0.00 -1.20 0.00 0.00 0.00 178.15 177.67 2kdz n SER 28 N -3.19 0.40 0.05 1.72 7.64 -0.34 -0.45 113.62 119.44 2kdz n SER 28 Ca -0.06 0.63 -0.13 0.00 1.01 0.00 0.00 58.87 60.32 2kdz n SER 28 Cb 0.94 -0.71 -0.09 0.00 -1.01 0.00 0.00 64.21 63.35 2kdz n SER 28 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2kdz h GLN 29 N 0.00 -0.12 0.06 1.43 4.20 -1.54 -2.91 115.11 116.23 2kdz h GLN 29 Ca 0.00 0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.61 2kdz h GLN 29 Cb 0.19 0.03 0.01 0.00 0.30 0.00 0.00 27.48 28.01 2kdz h GLN 29 CO 0.00 0.22 -0.46 -0.07 -0.67 0.00 0.00 178.83 177.85 2kdz h LEU 30 N -0.47 0.30 -7.75 1.46 3.38 -1.66 -3.38 115.31 107.19 2kdz h LEU 30 Ca -0.01 -0.91 -0.77 0.00 0.09 0.00 0.00 57.88 56.29 2kdz h LEU 30 Cb 0.39 -0.10 -0.24 0.00 0.09 0.00 0.00 40.66 40.81 2kdz h LEU 30 CO 0.02 1.18 0.59 -0.04 0.09 0.00 0.00 178.44 180.29 2kdz s MET 31 N -2.61 3.90 0.02 1.13 -1.94 0.40 -4.76 119.30 115.45 2kdz s MET 31 Ca -0.15 -2.62 0.22 0.00 -1.71 0.00 0.00 55.69 51.43 2kdz s MET 31 Cb 0.00 -4.68 -0.16 0.00 2.01 0.00 0.00 34.83 32.00 2kdz s MET 31 CO 0.77 -1.45 0.79 1.51 -0.01 0.00 0.00 175.02 176.63 2kdz n ILE 32 N 3.93 0.11 0.45 2.53 3.06 -1.10 -4.02 119.36 124.32 2kdz n ILE 32 Ca 0.23 -0.32 0.03 0.00 -2.50 0.00 0.00 62.75 60.19 2kdz n ILE 32 Cb 0.44 0.24 0.14 0.00 0.54 0.00 0.00 39.64 41.00 2kdz n ILE 32 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 2kdz n THR 33 N -2.05 0.90 -3.90 9.51 -2.24 -1.26 -4.82 114.28 110.42 2kdz n THR 33 Ca -0.00 -0.48 -0.14 0.00 -2.27 0.00 0.00 64.05 61.16 2kdz n THR 33 Cb 0.48 -0.32 -0.15 0.00 -2.10 0.00 0.00 70.33 68.24 2kdz n THR 33 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2kdz s ARG 34 N -1.64 0.09 0.13 -0.78 3.52 -1.26 -5.08 118.95 113.94 2kdz s ARG 34 Ca 0.20 0.02 -0.32 0.00 -0.13 0.00 0.00 55.73 55.49 2kdz s ARG 34 Cb 0.14 -0.17 -0.12 0.00 -1.56 0.00 0.00 34.95 33.25 2kdz s ARG 34 CO 0.07 -0.03 1.77 -1.71 -0.81 0.00 0.00 175.30 174.59 2kdz n ASN 35 N 3.40 3.83 -0.32 -2.12 2.85 -1.26 -4.88 115.26 116.76 2kdz n ASN 35 Ca -0.17 1.02 0.18 0.00 -0.11 0.00 0.00 54.58 55.50 2kdz n ASN 35 Cb 0.57 -1.52 0.37 0.00 1.24 0.00 0.00 39.78 40.44 2kdz n ASN 35 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2kdz h PRO 36 N 7.75 0.28 0.00 1.20 0.11 -1.93 0.36 132.00 139.76 2kdz h PRO 36 Ca -0.46 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2kdz h PRO 36 Cb 1.23 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 2kdz h PRO 36 CO 0.94 0.18 -0.06 0.00 -0.21 0.00 0.00 178.00 178.85 2kdz h ARG 37 N 0.28 0.00 -0.27 1.05 3.08 -1.98 -2.79 114.38 113.76 2kdz h ARG 37 Ca 0.63 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.59 2kdz h ARG 37 Cb 1.35 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.38 2kdz h ARG 37 CO -0.62 0.06 -0.23 1.96 -1.07 0.00 0.00 179.97 180.07 2kdz h GLN 38 N 0.00 0.51 -0.69 0.04 7.50 -0.62 0.25 115.11 122.09 2kdz h GLN 38 Ca -0.00 -0.19 -0.07 0.00 0.50 0.00 0.00 58.65 58.90 2kdz h GLN 38 Cb 0.52 -0.03 -0.03 0.00 0.05 0.00 0.00 27.48 27.99 2kdz h GLN 38 CO 0.01 0.71 0.18 0.00 -1.50 0.00 0.00 178.83 178.22 2kdz h ARG 40 N 1.04 0.66 -0.99 0.00 2.43 -1.46 -2.00 114.38 114.06 2kdz h ARG 40 Ca 0.22 -0.39 0.01 0.00 -0.81 0.00 0.00 59.98 59.01 2kdz h ARG 40 Cb 0.35 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.89 2kdz h ARG 40 CO 0.00 1.00 0.65 1.49 -1.51 0.00 0.00 179.97 181.61 2kdz h GLU 41 N 0.52 1.31 -0.09 0.20 4.81 0.04 0.19 114.58 121.56 2kdz h GLU 41 Ca 0.02 -0.08 -0.10 0.00 -0.13 0.00 0.00 59.36 59.07 2kdz h GLU 41 Cb 1.05 -0.29 0.00 0.00 0.63 0.00 0.00 28.75 30.14 2kdz h GLU 41 CO 0.10 0.87 -0.34 0.00 -0.73 0.00 0.00 179.01 178.90 2kdz h ARG 42 N 1.35 0.38 -0.34 1.92 2.47 -0.93 -2.02 114.38 117.21 2kdz h ARG 42 Ca 0.36 -0.30 -0.00 0.00 -1.26 0.00 0.00 59.98 58.78 2kdz h ARG 42 Cb -0.15 0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 28.21 2kdz h ARG 42 CO -0.08 0.93 0.21 2.35 0.56 0.00 0.00 179.97 183.94 2kdz h TRP 43 N -0.08 0.44 0.00 3.04 2.91 -1.08 -1.64 115.95 119.54 2kdz h TRP 43 Ca -0.02 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.00 2kdz h TRP 43 Cb 0.98 -0.15 0.00 0.00 -0.51 0.00 0.00 29.16 29.49 2kdz h TRP 43 CO 0.12 0.31 0.00 -0.97 -1.03 0.00 0.00 178.44 176.88 2kdz h ASN 44 N 0.44 0.00 -0.23 2.65 -1.24 -0.69 0.93 115.58 117.44 2kdz h ASN 44 Ca 0.12 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.13 2kdz h ASN 44 Cb -0.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.05 2kdz h ASN 44 CO -0.02 0.00 0.00 0.59 -1.29 0.00 0.00 177.43 176.71 2kdz n ASN 45 N -2.66 3.33 0.00 1.15 3.02 -0.76 -4.29 115.26 115.05 2kdz n ASN 45 Ca 0.04 -2.72 0.00 0.00 -0.03 0.00 0.00 54.58 51.86 2kdz n ASN 45 Cb 0.40 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 39.15 2kdz n ASN 45 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kdz n TYR 46 N -0.39 -1.79 0.03 3.10 9.36 -0.64 -4.91 117.16 121.91 2kdz n TYR 46 Ca 0.17 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.39 2kdz n TYR 46 Cb 0.71 0.46 -0.09 0.00 -0.63 0.00 0.00 39.34 39.79 2kdz n TYR 46 CO 0.00 0.00 0.00 -0.89 0.22 0.00 0.00 176.86 176.19 2kdz n ILE 47 N -2.41 1.14 -0.07 2.97 5.41 -0.90 -4.45 119.36 121.05 2kdz n ILE 47 Ca 0.00 -0.69 -0.08 0.00 1.00 0.00 0.00 62.75 62.98 2kdz n ILE 47 Cb 0.00 -0.69 -0.06 0.00 -0.71 0.00 0.00 39.64 38.17 2kdz n ILE 47 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 176.55 175.42 2kdz h ASN 48 N 0.00 0.00 -3.33 4.38 -1.24 -1.09 -3.49 115.58 110.81 2kdz h ASN 48 Ca -0.17 -0.45 0.00 0.00 0.71 0.00 0.00 56.30 56.38 2kdz h ASN 48 Cb 1.58 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.63 2kdz h ASN 48 CO 0.04 0.82 0.00 -0.81 -1.29 0.00 0.00 177.43 176.19 2kdz n PRO 49 N -4.66 1.30 -3.46 6.67 -0.04 -1.26 -5.09 135.00 128.45 2kdz n PRO 49 Ca -0.08 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.10 2kdz n PRO 49 Cb 0.28 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.64 2kdz n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kdz s ALA 50 N -2.23 1.42 -1.00 0.55 0.00 -1.26 -4.72 121.76 114.52 2kdz s ALA 50 Ca 0.00 -2.35 -0.22 0.00 0.00 0.00 0.00 51.96 49.40 2kdz s ALA 50 Cb 0.00 -1.64 0.08 0.00 0.00 0.00 0.00 23.12 21.55 2kdz s ALA 50 CO 0.00 -2.03 1.36 -0.48 0.00 0.00 0.00 175.76 174.61 2kdz s LEU 51 N 0.32 3.98 0.00 0.00 2.34 -1.26 -4.86 118.68 119.20 2kdz s LEU 51 Ca 0.27 -1.65 0.00 0.00 0.06 0.00 0.00 54.13 52.81 2kdz s LEU 51 Cb -0.07 -2.52 0.00 0.00 -0.56 0.00 0.00 46.19 43.05 2kdz s LEU 51 CO -0.12 -1.37 0.00 -2.11 -1.06 0.00 0.00 176.35 171.69 2kdz n ARG 52 N 8.16 0.00 -4.27 1.48 1.85 -1.26 -4.98 116.66 117.63 2kdz n ARG 52 Ca 0.31 0.00 -0.33 0.00 -1.00 0.00 0.00 57.85 56.83 2kdz n ARG 52 Cb 0.50 0.00 -0.09 0.00 -1.05 0.00 0.00 32.46 31.82 2kdz n ARG 52 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 2kdz n THR 53 N 0.00 -0.65 -0.75 8.89 -2.24 -1.26 -4.55 114.28 113.72 2kdz n THR 53 Ca 0.00 -0.32 0.09 0.00 -2.27 0.00 0.00 64.05 61.55 2kdz n THR 53 Cb 0.00 -0.79 -0.04 0.00 -2.10 0.00 0.00 70.33 67.39 2kdz n THR 53 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2kdz n ASP 54 N -2.57 -4.29 -3.59 3.42 8.00 -1.26 -4.97 116.55 111.29 2kdz n ASP 54 Ca -0.18 0.64 0.00 0.00 0.71 0.00 0.00 54.79 55.96 2kdz n ASP 54 Cb 0.59 -2.49 0.00 0.00 -0.02 0.00 0.00 41.12 39.20 2kdz n ASP 54 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2kdz n PRO 55 N -3.34 1.61 -1.80 -0.24 -0.04 -1.26 -5.02 135.00 124.91 2kdz n PRO 55 Ca -0.03 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.13 2kdz n PRO 55 Cb 0.35 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 33.88 2kdz n PRO 55 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2kdz s TRP 56 N 0.00 3.14 0.55 0.54 0.51 -1.26 -5.07 118.94 117.35 2kdz s TRP 56 Ca 0.00 1.02 -0.02 0.00 -2.12 0.00 0.00 56.10 54.98 2kdz s TRP 56 Cb 0.00 -3.15 0.02 0.00 -0.81 0.00 0.00 33.47 29.53 2kdz s TRP 56 CO 0.00 -1.43 0.81 -1.12 -0.51 0.00 0.00 176.95 174.71 2kdz s SER 57 N -4.28 5.48 0.61 2.95 0.01 -1.26 -4.90 113.70 112.32 2kdz s SER 57 Ca 0.59 0.37 0.31 0.00 1.31 0.00 0.00 55.95 58.53 2kdz s SER 57 Cb -0.12 -1.37 1.71 0.00 0.21 0.00 0.00 66.02 66.46 2kdz s SER 57 CO 0.52 -1.04 2.07 -0.65 0.41 0.00 0.00 173.24 174.54 2kdz h PRO 58 N 0.00 0.00 -0.27 12.44 0.11 -1.99 -0.98 132.00 141.31 2kdz h PRO 58 Ca -0.45 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 2kdz h PRO 58 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 2kdz h PRO 58 CO 0.58 0.00 -0.03 0.93 -0.21 0.00 0.00 178.00 179.26 2kdz h GLU 59 N 0.00 0.50 -0.35 1.05 5.08 -1.99 -1.66 114.58 117.21 2kdz h GLU 59 Ca 0.08 -0.18 -0.17 0.00 -1.00 0.00 0.00 59.36 58.09 2kdz h GLU 59 Cb 0.57 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 2kdz h GLU 59 CO -0.00 0.69 -0.44 0.93 -1.00 0.00 0.00 179.01 179.19 2kdz h GLU 60 N 0.27 0.92 -0.58 2.33 3.07 -1.58 -0.65 114.58 118.35 2kdz h GLU 60 Ca 0.07 -0.51 0.02 0.00 -0.50 0.00 0.00 59.36 58.44 2kdz h GLU 60 Cb 0.48 0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 28.39 2kdz h GLU 60 CO 0.02 1.16 0.36 0.22 -1.40 0.00 0.00 179.01 179.37 2kdz h ASP 61 N 0.74 0.60 0.68 1.42 3.58 -1.26 0.55 116.42 122.72 2kdz h ASP 61 Ca 0.05 -0.00 -0.23 0.00 0.42 0.00 0.00 57.03 57.26 2kdz h ASP 61 Cb 1.04 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.94 2kdz h ASP 61 CO 0.10 0.43 -1.04 0.24 -2.88 0.00 0.00 179.24 176.09 2kdz h MET 62 N 0.72 0.19 0.12 0.28 2.86 -1.26 -3.04 114.93 114.80 2kdz h MET 62 Ca 0.22 -0.27 -0.27 0.00 -2.06 0.00 0.00 59.70 57.33 2kdz h MET 62 Cb -0.02 0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.74 2kdz h MET 62 CO -0.08 1.07 -1.21 1.25 1.06 0.00 0.00 176.91 178.99 2kdz h LEU 63 N 0.08 0.42 -1.19 1.22 5.85 -0.90 -3.26 115.31 117.52 2kdz h LEU 63 Ca -0.07 -0.44 -0.04 0.00 0.84 0.00 0.00 57.88 58.17 2kdz h LEU 63 Cb 1.74 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.61 2kdz h LEU 63 CO 0.16 1.33 0.12 0.25 -0.34 0.00 0.00 178.44 179.97 2kdz h LEU 64 N 0.08 0.63 -1.62 2.25 6.46 0.02 -1.30 115.31 121.83 2kdz h LEU 64 Ca -0.13 -0.10 0.12 0.00 -0.12 0.00 0.00 57.88 57.66 2kdz h LEU 64 Cb 1.94 -0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 41.66 2kdz h LEU 64 CO 0.20 0.62 0.45 -0.78 -0.62 0.00 0.00 178.44 178.31 2kdz h ASP 65 N 0.67 0.37 0.06 1.25 3.58 -1.57 0.51 116.42 121.29 2kdz h ASP 65 Ca 0.15 0.01 -0.17 0.00 0.42 0.00 0.00 57.03 57.45 2kdz h ASP 65 Cb 0.23 -0.06 -0.00 0.00 1.72 0.00 0.00 39.33 41.22 2kdz h ASP 65 CO -0.00 0.21 -0.85 -0.61 -2.88 0.00 0.00 179.24 175.10 2kdz h GLN 66 N 0.40 0.13 -0.46 0.28 4.15 -1.47 -2.78 115.11 115.36 2kdz h GLN 66 Ca 0.32 -0.22 -0.02 0.00 0.77 0.00 0.00 58.65 59.50 2kdz h GLN 66 Cb 0.70 0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.45 2kdz h GLN 66 CO -0.09 1.11 0.22 0.87 -1.93 0.00 0.00 178.83 179.01 2kdz h LYS 67 N -0.67 0.64 0.00 1.69 1.79 -0.79 -1.39 116.57 117.84 2kdz h LYS 67 Ca -0.19 -0.07 -0.17 0.00 -2.18 0.00 0.00 60.65 58.03 2kdz h LYS 67 Cb 1.42 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 31.91 2kdz h LYS 67 CO 0.00 0.50 -0.83 -0.92 -1.08 0.00 0.00 179.45 177.12 2kdz h TYR 68 N 0.65 0.00 0.00 -1.35 3.20 -0.11 -0.78 116.97 118.57 2kdz h TYR 68 Ca 0.16 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2kdz h TYR 68 Cb 0.07 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.34 2kdz h TYR 68 CO 0.00 0.83 0.00 0.00 -1.64 0.00 0.00 178.16 177.35 2kdz h ALA 69 N 1.17 1.00 0.00 1.82 0.00 -1.02 -0.09 119.26 122.14 2kdz h ALA 69 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.55 2kdz h ALA 69 Cb 1.50 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.23 2kdz h ALA 69 CO 0.11 0.00 -2.31 0.39 0.00 0.00 0.00 179.25 177.44 2kdz n GLU 70 N -2.87 0.57 -0.00 0.00 -0.58 -0.61 -4.65 120.64 112.49 2kdz n GLU 70 Ca 0.03 0.14 -0.16 0.00 -0.42 0.00 0.00 57.16 56.76 2kdz n GLU 70 Cb 0.44 -1.45 -0.14 0.00 -0.57 0.00 0.00 31.44 29.72 2kdz n GLU 70 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2kdz n TYR 71 N -3.22 1.17 0.00 -0.32 4.01 -0.31 -5.09 117.16 113.39 2kdz n TYR 71 Ca -0.41 0.31 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 2kdz n TYR 71 Cb 0.93 -1.18 0.00 0.00 -0.31 0.00 0.00 39.34 38.78 2kdz n TYR 71 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2kdz n GLY 72 N 1.80 -1.12 1.55 2.72 0.00 -0.05 -4.56 105.19 105.54 2kdz n GLY 72 Ca -0.25 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.65 2kdz n GLY 72 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2kdz n PRO 73 N 0.00 0.82 -2.06 1.61 -0.04 -1.26 -4.59 135.00 129.47 2kdz n PRO 73 Ca 0.00 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.06 2kdz n PRO 73 Cb 0.00 -1.09 -0.00 0.00 -0.04 0.00 0.00 33.50 32.37 2kdz n PRO 73 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2kdz n LYS 74 N 1.52 4.59 0.06 0.54 5.02 -1.26 -4.72 118.16 123.91 2kdz n LYS 74 Ca 0.00 -3.55 0.21 0.00 -2.02 0.00 0.00 58.31 52.95 2kdz n LYS 74 Cb 0.41 -2.64 0.73 0.00 -0.02 0.00 0.00 35.03 33.51 2kdz n LYS 74 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 2kdz h TRP 75 N 4.66 0.00 -0.81 2.13 4.06 -1.96 0.77 115.95 124.79 2kdz h TRP 75 Ca 0.67 0.00 0.09 0.00 2.06 0.00 0.00 58.89 61.71 2kdz h TRP 75 Cb 0.33 0.00 -0.07 0.00 -1.00 0.00 0.00 29.16 28.41 2kdz h TRP 75 CO 1.56 0.00 0.46 -0.97 -3.56 0.00 0.00 178.44 175.93 2kdz h ASN 76 N 0.00 0.65 0.27 -3.49 -0.73 -1.95 0.19 115.58 110.52 2kdz h ASN 76 Ca 0.22 0.05 -0.34 0.00 1.87 0.00 0.00 56.30 58.10 2kdz h ASN 76 Cb 1.17 -0.08 0.03 0.00 0.27 0.00 0.00 38.32 39.71 2kdz h ASN 76 CO -0.00 0.37 -1.56 0.11 -0.37 0.00 0.00 177.43 175.98 2kdz h LYS 77 N 0.77 0.48 -0.65 6.67 6.56 -1.28 -3.35 116.57 125.77 2kdz h LYS 77 Ca 0.39 -0.81 0.03 0.00 -1.06 0.00 0.00 60.65 59.20 2kdz h LYS 77 Cb 0.36 0.30 -0.04 0.00 -0.57 0.00 0.00 32.23 32.28 2kdz h LYS 77 CO -0.25 1.38 0.40 0.82 -2.06 0.00 0.00 179.45 179.75 2kdz h ILE 78 N 0.13 1.08 0.00 1.86 1.08 -0.88 -1.28 117.51 119.51 2kdz h ILE 78 Ca -0.28 -0.27 0.00 0.00 -0.39 0.00 0.00 64.86 63.92 2kdz h ILE 78 Cb 2.14 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 36.12 2kdz h ILE 78 CO 0.24 0.14 0.00 -1.54 -0.69 0.00 0.00 178.15 176.30 2kdz n SER 79 N -4.70 0.54 0.06 1.72 3.41 0.63 -1.21 113.62 114.06 2kdz n SER 79 Ca 0.06 0.70 0.05 0.00 -0.26 0.00 0.00 58.87 59.43 2kdz n SER 79 Cb 0.08 -0.79 -0.05 0.00 -0.26 0.00 0.00 64.21 63.20 2kdz n SER 79 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2kdz n LYS 80 N -2.17 0.61 0.07 4.33 5.02 -0.50 -3.84 118.16 121.69 2kdz n LYS 80 Ca 0.00 0.17 -0.00 0.00 -2.02 0.00 0.00 58.31 56.46 2kdz n LYS 80 Cb 0.11 -1.81 -0.05 0.00 -0.02 0.00 0.00 35.03 33.25 2kdz n LYS 80 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 2kdz h PHE 81 N 0.00 0.00 -3.47 2.13 0.04 -0.99 -3.40 116.94 111.26 2kdz h PHE 81 Ca -0.09 0.00 -0.66 0.00 2.80 0.00 0.00 57.97 60.02 2kdz h PHE 81 Cb 1.31 0.00 -0.39 0.00 2.20 0.00 0.00 35.95 39.07 2kdz h PHE 81 CO 0.00 0.62 -0.56 -0.51 -0.60 0.00 0.00 178.31 177.26 2kdz s LEU 82 N -6.18 4.67 -1.04 1.54 2.01 -0.81 -5.03 118.68 113.84 2kdz s LEU 82 Ca 0.00 -2.84 -0.24 0.00 0.01 0.00 0.00 54.13 51.07 2kdz s LEU 82 Cb 0.08 -1.71 -0.06 0.00 0.01 0.00 0.00 46.19 44.51 2kdz s LEU 82 CO 0.79 -0.30 1.93 -0.75 1.01 0.00 0.00 176.35 179.03 2kdz s LYS 83 N -0.04 2.56 0.00 1.70 2.20 -1.26 -3.38 119.74 121.52 2kdz s LYS 83 Ca 0.16 -0.72 0.00 0.00 -0.36 0.00 0.00 55.97 55.05 2kdz s LYS 83 Cb -0.23 -5.15 0.00 0.00 -1.51 0.00 0.00 37.83 30.93 2kdz s LYS 83 CO -0.02 -3.63 0.00 -1.71 -0.36 0.00 0.00 175.35 169.63 2kdz n ASN 84 N 14.04 0.00 -4.75 1.43 2.85 -1.26 -5.15 115.26 122.42 2kdz n ASN 84 Ca 0.42 0.00 -0.33 0.00 -0.11 0.00 0.00 54.58 54.56 2kdz n ASN 84 Cb 0.47 0.02 -0.08 0.00 1.24 0.00 0.00 39.78 41.43 2kdz n ASN 84 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 2kdz s ARG 85 N -1.34 3.02 0.32 1.20 1.81 -1.22 -4.57 118.95 118.17 2kdz s ARG 85 Ca 0.00 -0.47 0.07 0.00 -1.72 0.00 0.00 55.73 53.60 2kdz s ARG 85 Cb 0.00 -2.83 -0.01 0.00 -0.45 0.00 0.00 34.95 31.65 2kdz s ARG 85 CO 0.00 0.66 0.43 -1.12 -0.68 0.00 0.00 175.30 174.59 2kdz s SER 86 N -1.51 5.89 0.00 0.23 0.01 -1.26 -4.61 113.70 112.46 2kdz s SER 86 Ca 0.20 -0.21 0.00 0.00 1.31 0.00 0.00 55.95 57.25 2kdz s SER 86 Cb -0.12 -1.25 0.00 0.00 0.21 0.00 0.00 66.02 64.86 2kdz s SER 86 CO 0.11 -0.38 0.58 -0.90 0.41 0.00 0.00 173.24 173.06 2kdz n ASP 87 N -1.57 0.00 0.17 2.44 5.68 -1.26 0.12 116.55 122.13 2kdz n ASP 87 Ca -0.01 0.58 0.19 0.00 -0.50 0.00 0.00 54.79 55.04 2kdz n ASP 87 Cb 0.58 -0.08 0.77 0.00 -1.14 0.00 0.00 41.12 41.25 2kdz n ASP 87 CO 0.00 0.00 0.00 -1.13 -1.33 0.00 0.00 177.20 174.74 2kdz h ASN 88 N 0.00 0.00 0.05 -1.12 -1.24 -1.96 -1.26 115.58 110.05 2kdz h ASN 88 Ca 0.00 0.00 -0.09 0.00 0.71 0.00 0.00 56.30 56.92 2kdz h ASN 88 Cb 0.00 0.00 0.01 0.00 0.73 0.00 0.00 38.32 39.06 2kdz h ASN 88 CO 0.00 0.00 -0.39 -1.13 -1.29 0.00 0.00 177.43 174.62 2kdz h ASN 89 N 0.00 0.25 -0.18 1.15 -0.73 -1.81 -2.98 115.58 111.27 2kdz h ASN 89 Ca 0.13 -0.92 0.01 0.00 1.87 0.00 0.00 56.30 57.40 2kdz h ASN 89 Cb 0.93 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 39.43 2kdz h ASN 89 CO -0.00 1.15 0.09 0.40 -0.37 0.00 0.00 177.43 178.69 2kdz h ILE 90 N -0.60 1.00 -0.57 2.57 2.04 0.83 -0.47 117.51 122.30 2kdz h ILE 90 Ca -0.06 -0.07 0.07 0.00 1.00 0.00 0.00 64.86 65.80 2kdz h ILE 90 Cb 1.25 0.78 -0.06 0.00 -0.74 0.00 0.00 36.82 38.06 2kdz h ILE 90 CO 0.07 0.04 0.27 -0.09 0.00 0.00 0.00 178.15 178.44 2kdz h ARG 91 N 0.19 0.48 -0.26 2.37 9.65 -1.53 0.59 114.38 125.88 2kdz h ARG 91 Ca 0.07 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.92 2kdz h ARG 91 Cb 0.02 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.48 2kdz h ARG 91 CO -0.05 0.32 0.14 -0.91 2.80 0.00 0.00 179.97 182.27 2kdz h ASN 92 N 0.50 0.32 -0.23 -3.80 4.21 -1.30 -1.97 115.58 113.31 2kdz h ASN 92 Ca 0.27 -0.08 -0.13 0.00 1.21 0.00 0.00 56.30 57.57 2kdz h ASN 92 Cb 0.23 -0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 37.34 2kdz h ASN 92 CO -0.22 0.31 -0.33 0.03 -1.29 0.00 0.00 177.43 175.93 2kdz h ARG 93 N 0.31 0.74 -0.54 0.81 2.47 -0.52 -2.27 114.38 115.38 2kdz h ARG 93 Ca 0.09 -0.35 0.01 0.00 -1.26 0.00 0.00 59.98 58.47 2kdz h ARG 93 Cb 0.05 -0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 28.34 2kdz h ARG 93 CO -0.02 0.97 0.36 2.35 0.56 0.00 0.00 179.97 184.19 2kdz h TRP 94 N 0.63 0.67 -0.44 3.04 2.91 0.36 0.35 115.95 123.47 2kdz h TRP 94 Ca 0.07 0.02 -0.07 0.00 1.13 0.00 0.00 58.89 60.03 2kdz h TRP 94 Cb 0.86 -0.23 -0.02 0.00 -0.51 0.00 0.00 29.16 29.26 2kdz h TRP 94 CO 0.04 0.42 -0.01 1.98 -1.03 0.00 0.00 178.44 179.84 2kdz h MET 95 N 0.72 0.79 -0.07 2.65 4.05 -1.30 -0.15 114.93 121.62 2kdz h MET 95 Ca 0.20 -0.26 -0.01 0.00 -0.28 0.00 0.00 59.70 59.35 2kdz h MET 95 Cb -0.07 -0.07 -0.00 0.00 -0.80 0.00 0.00 31.60 30.65 2kdz h MET 95 CO -0.05 0.86 0.01 1.98 0.23 0.00 0.00 176.91 179.95 2kdz h MET 96 N 0.63 0.12 -0.15 0.39 1.85 -1.01 -2.81 114.93 113.95 2kdz h MET 96 Ca 0.12 -0.03 -0.09 0.00 -0.61 0.00 0.00 59.70 59.09 2kdz h MET 96 Cb 0.51 -0.01 -0.01 0.00 0.43 0.00 0.00 31.60 32.52 2kdz h MET 96 CO 0.03 0.33 -0.30 0.97 -0.40 0.00 0.00 176.91 177.53 2kdz h ILE 97 N -0.11 1.27 -0.42 1.77 6.09 -0.28 -2.68 117.51 123.14 2kdz h ILE 97 Ca 0.02 -1.28 -0.04 0.00 -1.37 0.00 0.00 64.86 62.19 2kdz h ILE 97 Cb 0.27 1.49 -0.02 0.00 0.47 0.00 0.00 36.82 39.03 2kdz h ILE 97 CO 0.00 0.39 0.11 0.00 -3.07 0.00 0.00 178.15 175.58 2kdz h ALA 98 N 1.43 1.40 0.00 0.18 0.00 -0.93 0.11 119.26 121.45 2kdz h ALA 98 Ca 0.04 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2kdz h ALA 98 Cb 0.67 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2kdz h ALA 98 CO 0.05 0.43 -0.16 -0.09 0.00 0.00 0.00 179.25 179.49 2kdz h ARG 99 N 0.61 0.00 0.03 0.00 2.43 -1.21 0.12 114.38 116.37 2kdz h ARG 99 Ca 0.14 0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 59.02 2kdz h ARG 99 Cb 0.22 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.73 2kdz h ARG 99 CO -0.00 0.16 -1.59 1.25 -1.51 0.00 0.00 179.97 178.28 2kdz h HIS 100 N 0.00 0.13 0.00 2.20 2.76 -1.10 -3.33 115.15 115.80 2kdz h HIS 100 Ca -0.00 -0.10 -0.17 0.00 -2.20 0.00 0.00 60.37 57.90 2kdz h HIS 100 Cb 0.64 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.57 2kdz h HIS 100 CO 0.00 1.15 -0.81 -0.09 -1.30 0.00 0.00 177.93 176.88 2kdz h ARG 101 N 0.02 0.00 0.00 5.26 9.65 -0.53 -3.19 114.38 125.59 2kdz h ARG 101 Ca -0.25 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.63 2kdz h ARG 101 Cb 1.97 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.55 2kdz h ARG 101 CO 0.10 0.81 0.00 0.00 2.80 0.00 0.00 179.97 183.69 2kdz n ALA 102 N -2.35 1.89 -0.84 2.80 0.00 0.39 -4.97 120.51 117.42 2kdz n ALA 102 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2kdz n ALA 102 Cb 0.81 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 19.06 2kdz n ALA 102 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2kdz n LYS 103 N -1.10 0.00 -3.62 0.00 4.76 -1.21 -4.87 118.16 112.13 2kdz n LYS 103 Ca 0.08 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.38 2kdz n LYS 103 Cb 0.06 0.00 -0.13 0.00 -1.84 0.00 0.00 35.03 33.12 2kdz n LYS 103 CO 0.00 0.00 0.00 -3.38 -1.37 0.00 0.00 177.40 172.65 2kdz s HIS 104 N 0.00 -0.40 0.01 2.13 -3.43 -1.26 -4.90 115.29 107.43 2kdz s HIS 104 Ca 0.00 0.81 -0.00 0.00 -0.80 0.00 0.00 55.06 55.07 2kdz s HIS 104 Cb 0.00 -0.10 -0.04 0.00 -1.43 0.00 0.00 32.58 31.01 2kdz s HIS 104 CO 0.00 -0.41 0.10 -0.65 -2.00 0.00 0.00 174.74 171.78 2kdz s GLN 105 N 2.40 3.12 0.00 -0.38 -0.21 -1.26 -4.94 119.66 118.39 2kdz s GLN 105 Ca 0.03 -0.48 0.00 0.00 0.02 0.00 0.00 55.36 54.93 2kdz s GLN 105 Cb -0.13 -2.89 0.00 0.00 1.00 0.00 0.00 33.01 30.99 2kdz s GLN 105 CO -0.09 0.64 0.00 1.17 -2.12 0.00 0.00 175.29 174.89 2kdz n LYS 106 N 1.03 0.00 0.00 2.91 4.81 -1.26 -5.33 118.16 120.31 2kdz n LYS 106 Ca -0.12 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.32 2kdz n LYS 106 Cb 0.52 -0.01 0.00 0.00 0.02 0.00 0.00 35.03 35.57 2kdz n LYS 106 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00