#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 0.07 -1.30 3.15 0.24 -1.26 -5.03 118.33 114.20 2kdz n VAL 2 Ca 0.00 -0.15 0.17 0.00 -2.04 0.00 0.00 64.34 62.32 2kdz n VAL 2 Cb 0.00 -0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.31 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 -0.33 -2.78 -0.24 7.34 5.02 -1.26 -5.00 118.16 120.91 2kdz n LYS 3 Ca 0.17 2.03 0.03 0.00 -2.02 0.00 0.00 58.31 58.52 2kdz n LYS 3 Cb 0.20 -3.33 -0.01 0.00 -0.02 0.00 0.00 35.03 31.87 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 -4.09 -2.21 0.00 2.13 7.35 -1.26 -5.06 117.46 114.32 2kdz n PHE 4 Ca -0.03 0.30 0.00 0.00 -0.76 0.00 0.00 57.45 56.97 2kdz n PHE 4 Cb 0.60 -0.33 0.00 0.00 0.35 0.00 0.00 39.48 40.10 2kdz n PHE 4 CO 0.00 0.00 0.00 -2.37 -0.76 0.00 0.00 176.76 173.63 2kdz n THR 5 N -2.23 0.00 -0.24 -2.13 5.66 -1.26 -4.98 114.28 109.11 2kdz n THR 5 Ca 0.00 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.93 2kdz n THR 5 Cb 0.11 0.00 0.06 0.00 -1.55 0.00 0.00 70.33 68.95 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 1.10 -0.42 1.09 5.08 -1.99 -1.68 114.58 117.76 2kdz h GLU 6 Ca 0.00 -0.28 -0.04 0.00 -1.00 0.00 0.00 59.36 58.05 2kdz h GLU 6 Cb 0.00 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 2kdz h GLU 6 CO 0.00 0.99 0.11 0.93 -1.00 0.00 0.00 179.01 180.04 2kdz h GLU 7 N 1.04 0.63 0.00 2.33 5.08 -2.01 -2.11 114.58 119.54 2kdz h GLU 7 Ca 0.21 -0.11 -0.15 0.00 -1.00 0.00 0.00 59.36 58.31 2kdz h GLU 7 Cb 0.40 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 2kdz h GLU 7 CO 0.01 0.57 -0.72 0.93 -1.00 0.00 0.00 179.01 178.79 2kdz h GLU 8 N 0.61 0.00 -0.49 2.33 4.39 -1.86 -3.13 114.58 116.43 2kdz h GLU 8 Ca 0.14 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.87 2kdz h GLU 8 Cb 0.22 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.84 2kdz h GLU 8 CO -0.00 0.72 0.28 0.22 -1.16 0.00 0.00 179.01 179.07 2kdz h ASP 9 N 0.00 0.45 -0.36 1.42 1.82 -0.62 -0.80 116.42 118.33 2kdz h ASP 9 Ca -0.01 0.01 -0.06 0.00 -0.39 0.00 0.00 57.03 56.58 2kdz h ASP 9 Cb 1.40 -0.08 -0.02 0.00 0.68 0.00 0.00 39.33 41.30 2kdz h ASP 9 CO 0.09 0.32 0.03 -0.07 -1.61 0.00 0.00 179.24 178.00 2kdz h LEU 10 N 0.56 0.67 -1.02 2.28 3.38 -1.51 -2.40 115.31 117.27 2kdz h LEU 10 Ca 0.20 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 2kdz h LEU 10 Cb 0.04 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2kdz h LEU 10 CO -0.10 0.72 -0.18 0.11 0.09 0.00 0.00 178.44 179.08 2kdz h LYS 11 N 0.67 0.49 -0.06 1.13 1.57 -1.30 -2.89 116.57 116.19 2kdz h LYS 11 Ca 0.14 -0.16 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2kdz h LYS 11 Cb 0.38 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2kdz h LYS 11 CO 0.01 0.66 0.02 1.25 -0.57 0.00 0.00 179.45 180.82 2kdz h LEU 12 N 0.45 0.02 -1.03 2.94 5.85 -0.66 0.12 115.31 123.00 2kdz h LEU 12 Ca 0.08 0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.90 2kdz h LEU 12 Cb 0.57 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.53 2kdz h LEU 12 CO 0.04 0.02 0.63 -0.61 -0.34 0.00 0.00 178.44 178.19 2kdz h GLN 13 N 0.05 1.02 -0.19 1.25 5.75 -1.40 0.28 115.11 121.88 2kdz h GLN 13 Ca 0.02 -0.06 -0.06 0.00 -0.15 0.00 0.00 58.65 58.40 2kdz h GLN 13 Cb 0.01 -0.23 -0.00 0.00 1.07 0.00 0.00 27.48 28.33 2kdz h GLN 13 CO -0.03 0.68 -0.13 1.96 -2.65 0.00 0.00 178.83 178.66 2kdz h GLN 14 N 1.05 0.42 -0.59 1.69 1.08 -1.23 -1.94 115.11 115.59 2kdz h GLN 14 Ca 0.47 -0.20 -0.06 0.00 -1.45 0.00 0.00 58.65 57.41 2kdz h GLN 14 Cb 0.37 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.77 2kdz h GLN 14 CO -0.22 0.75 0.15 -0.07 -0.95 0.00 0.00 178.83 178.49 2kdz h LEU 15 N 0.10 0.90 -1.39 1.46 4.07 -0.05 -1.89 115.31 118.51 2kdz h LEU 15 Ca 0.04 -0.23 -0.05 0.00 0.08 0.00 0.00 57.88 57.71 2kdz h LEU 15 Cb 0.65 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 2kdz h LEU 15 CO 0.04 0.89 -0.17 0.58 -1.08 0.00 0.00 178.44 178.70 2kdz h VAL 16 N 0.86 1.19 -0.21 1.22 2.07 -0.46 0.27 116.25 121.18 2kdz h VAL 16 Ca 0.19 -0.85 -0.17 0.00 0.82 0.00 0.00 66.70 66.69 2kdz h VAL 16 Cb 0.34 1.29 -0.00 0.00 -1.52 0.00 0.00 31.29 31.40 2kdz h VAL 16 CO 0.00 0.26 -0.57 -0.03 0.02 0.00 0.00 177.57 177.25 2kdz h MET 17 N 0.18 0.64 0.14 1.57 1.85 -0.85 0.20 114.93 118.67 2kdz h MET 17 Ca 0.03 -0.41 -0.30 0.00 -0.61 0.00 0.00 59.70 58.41 2kdz h MET 17 Cb 0.42 0.05 0.00 0.00 0.43 0.00 0.00 31.60 32.50 2kdz h MET 17 CO 0.03 1.03 -1.49 0.00 -0.40 0.00 0.00 176.91 176.08 2kdz h ARG 18 N 0.49 0.30 0.16 0.39 -0.00 -0.94 -3.39 114.38 111.38 2kdz h ARG 18 Ca 0.01 -0.52 -0.32 0.00 -0.50 0.00 0.00 59.98 58.65 2kdz h ARG 18 Cb 1.13 0.19 0.00 0.00 0.00 0.00 0.00 29.97 31.30 2kdz h ARG 18 CO 0.11 1.25 -1.64 1.88 0.00 0.00 0.00 179.97 181.57 2kdz h TYR 19 N -0.17 0.60 0.00 3.04 0.05 -0.59 -3.51 116.97 116.39 2kdz h TYR 19 Ca -0.31 -0.44 0.00 0.00 0.05 0.00 0.00 58.73 58.04 2kdz h TYR 19 Cb 1.87 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 39.59 2kdz h TYR 19 CO 0.12 1.64 0.00 0.41 -1.05 0.00 0.00 178.16 179.28 2kdz n GLY 20 N 1.83 0.40 0.61 3.88 0.00 0.06 -4.62 105.19 107.34 2kdz n GLY 20 Ca -0.25 -2.28 0.06 0.00 0.00 0.00 0.00 46.02 43.55 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 -0.94 3.22 0.00 4.61 0.00 -1.26 -4.51 120.51 121.63 2kdz n ALA 21 Ca 0.00 -2.86 0.00 0.00 0.00 0.00 0.00 53.44 50.58 2kdz n ALA 21 Cb 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 19.45 18.93 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 -1.11 0.00 -1.48 0.00 3.00 -1.26 -4.87 118.16 112.44 2kdz n LYS 22 Ca 0.22 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 58.13 2kdz n LYS 22 Cb 0.79 -0.47 -0.02 0.00 0.00 0.00 0.00 35.03 35.33 2kdz n LYS 22 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2kdz n ASP 23 N -2.66 7.40 0.17 3.14 -0.08 -1.26 -4.52 116.55 118.75 2kdz n ASP 23 Ca 0.00 -2.68 0.14 0.00 -1.51 0.00 0.00 54.79 50.73 2kdz n ASP 23 Cb 0.34 -1.57 0.48 0.00 2.34 0.00 0.00 41.12 42.71 2kdz n ASP 23 CO 0.00 0.00 0.00 -0.50 0.12 0.00 0.00 177.20 176.82 2kdz h TRP 24 N 5.25 0.00 -0.88 -0.67 4.06 -1.89 -3.07 115.95 118.75 2kdz h TRP 24 Ca 0.78 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.73 2kdz h TRP 24 Cb 0.38 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.50 2kdz h TRP 24 CO 1.75 0.00 0.56 0.82 -3.56 0.00 0.00 178.44 178.01 2kdz h ILE 25 N 0.00 1.24 -0.41 1.49 2.04 -1.95 0.10 117.51 120.01 2kdz h ILE 25 Ca 0.00 -0.47 -0.00 0.00 1.00 0.00 0.00 64.86 65.38 2kdz h ILE 25 Cb 0.56 -0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 2kdz h ILE 25 CO 0.00 0.24 0.24 -0.09 0.00 0.00 0.00 178.15 178.54 2kdz h ARG 26 N 1.21 0.56 0.01 2.37 9.65 -1.93 -1.29 114.38 124.95 2kdz h ARG 26 Ca 0.32 -0.04 -0.20 0.00 -1.10 0.00 0.00 59.98 58.95 2kdz h ARG 26 Cb -0.10 -0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 28.34 2kdz h ARG 26 CO -0.06 0.40 -0.96 0.82 2.80 0.00 0.00 179.97 182.96 2kdz h ILE 27 N 0.57 1.66 0.00 1.20 2.04 -1.42 -3.11 117.51 118.45 2kdz h ILE 27 Ca 0.15 -3.19 0.00 0.00 1.00 0.00 0.00 64.86 62.82 2kdz h ILE 27 Cb -0.01 2.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.81 2kdz h ILE 27 CO -0.03 0.91 0.00 0.28 0.00 0.00 0.00 178.15 179.32 2kdz h SER 28 N 0.01 0.00 1.25 1.72 0.02 0.15 0.18 113.55 116.88 2kdz h SER 28 Ca -0.02 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.88 2kdz h SER 28 Cb 1.68 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.21 2kdz h SER 28 CO 0.13 0.00 -0.26 1.56 -1.14 0.00 0.00 176.83 177.12 2kdz h GLN 29 N 0.00 0.00 0.02 3.45 4.20 -1.37 -3.06 115.11 118.35 2kdz h GLN 29 Ca 0.00 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.35 2kdz h GLN 29 Cb 0.32 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.05 2kdz h GLN 29 CO 0.00 0.26 -2.03 1.28 -0.67 0.00 0.00 178.83 177.67 2kdz n LEU 30 N -3.28 2.18 -4.33 1.46 4.77 -0.44 -4.66 117.00 112.69 2kdz n LEU 30 Ca 0.01 0.28 -0.47 0.00 -0.03 0.00 0.00 56.01 55.80 2kdz n LEU 30 Cb 0.53 -0.93 -0.02 0.00 -2.33 0.00 0.00 43.42 40.67 2kdz n LEU 30 CO 0.35 0.57 0.44 -0.04 -1.33 0.00 0.00 177.39 177.39 2kdz s MET 31 N -2.47 3.58 -0.01 3.23 -1.94 0.50 -4.81 119.30 117.38 2kdz s MET 31 Ca -0.33 -2.40 0.21 0.00 -1.71 0.00 0.00 55.69 51.46 2kdz s MET 31 Cb 0.10 -4.44 -0.27 0.00 2.01 0.00 0.00 34.83 32.23 2kdz s MET 31 CO 0.58 -1.31 0.74 1.51 -0.01 0.00 0.00 175.02 176.53 2kdz n ILE 32 N 4.08 0.00 0.69 2.53 0.13 -1.16 -4.14 119.36 121.50 2kdz n ILE 32 Ca 0.13 -0.18 0.08 0.00 -1.10 0.00 0.00 62.75 61.68 2kdz n ILE 32 Cb 0.47 0.64 0.22 0.00 -0.84 0.00 0.00 39.64 40.12 2kdz n ILE 32 CO 0.00 0.00 0.00 0.41 2.80 0.00 0.00 176.55 179.76 2kdz n THR 33 N -1.77 0.52 -4.24 9.51 -1.04 -1.26 -4.86 114.28 111.14 2kdz n THR 33 Ca 0.01 -0.55 -0.17 0.00 -2.04 0.00 0.00 64.05 61.30 2kdz n THR 33 Cb 0.41 0.33 -0.14 0.00 -1.82 0.00 0.00 70.33 69.12 2kdz n THR 33 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 2kdz s ARG 34 N -1.48 0.63 0.04 -2.82 3.52 -1.26 -5.06 118.95 112.52 2kdz s ARG 34 Ca 0.30 -0.45 -0.30 0.00 -0.13 0.00 0.00 55.73 55.15 2kdz s ARG 34 Cb 0.16 -0.57 -0.09 0.00 -1.56 0.00 0.00 34.95 32.89 2kdz s ARG 34 CO 0.21 0.15 1.90 1.21 -0.81 0.00 0.00 175.30 177.96 2kdz s ASN 35 N -0.65 6.48 0.32 -2.12 3.84 -1.26 -4.87 114.94 116.68 2kdz s ASN 35 Ca -0.00 2.62 0.10 0.00 0.21 0.00 0.00 52.86 55.79 2kdz s ASN 35 Cb -0.05 -2.54 0.94 0.00 -0.55 0.00 0.00 41.25 39.05 2kdz s ASN 35 CO 0.00 -1.03 1.68 -0.65 -2.79 0.00 0.00 177.10 174.32 2kdz h PRO 36 N 10.11 0.37 0.00 0.43 0.11 -1.94 0.38 132.00 141.46 2kdz h PRO 36 Ca -0.48 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 2kdz h PRO 36 Cb 1.23 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 2kdz h PRO 36 CO 0.94 0.25 -0.01 0.00 -0.21 0.00 0.00 178.00 178.97 2kdz h ARG 37 N 0.39 0.00 -0.00 1.05 3.08 -1.97 -2.67 114.38 114.26 2kdz h ARG 37 Ca 0.66 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.57 2kdz h ARG 37 Cb 1.40 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.43 2kdz h ARG 37 CO -0.57 0.01 -0.68 1.96 -1.07 0.00 0.00 179.97 179.62 2kdz h GLN 38 N 0.00 0.01 -0.07 0.04 1.08 -0.60 0.21 115.11 115.78 2kdz h GLN 38 Ca -0.00 -0.01 -0.09 0.00 -1.45 0.00 0.00 58.65 57.10 2kdz h GLN 38 Cb 0.52 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.94 2kdz h GLN 38 CO 0.00 0.69 -0.36 0.00 -0.95 0.00 0.00 178.83 178.21 2kdz h ARG 40 N 0.12 0.47 0.00 0.00 2.43 -1.38 -1.84 114.38 114.18 2kdz h ARG 40 Ca 0.01 -0.43 -0.03 0.00 -0.81 0.00 0.00 59.98 58.73 2kdz h ARG 40 Cb 0.71 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.36 2kdz h ARG 40 CO 0.05 1.07 -0.12 1.49 -1.51 0.00 0.00 179.97 180.95 2kdz h GLU 41 N 0.01 0.00 0.11 0.20 4.81 -0.25 -0.05 114.58 119.42 2kdz h GLU 41 Ca -0.05 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 2kdz h GLU 41 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 2kdz h GLU 41 CO 0.11 0.12 -0.05 -0.09 -0.73 0.00 0.00 179.01 178.37 2kdz h ARG 42 N 0.00 -0.14 -0.98 1.92 2.43 -0.62 -2.90 114.38 114.10 2kdz h ARG 42 Ca -0.00 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.24 2kdz h ARG 42 Cb 0.34 0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.86 2kdz h ARG 42 CO 0.02 0.20 0.63 2.35 -1.51 0.00 0.00 179.97 181.65 2kdz h TRP 43 N -0.98 1.16 0.00 2.20 2.91 -1.20 0.12 115.95 120.16 2kdz h TRP 43 Ca -0.01 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 60.03 2kdz h TRP 43 Cb 0.40 -0.38 -0.00 0.00 -0.51 0.00 0.00 29.16 28.67 2kdz h TRP 43 CO 0.08 0.60 -0.03 -0.97 -1.03 0.00 0.00 178.44 177.09 2kdz h ASN 44 N 1.14 0.00 0.00 2.65 -1.24 -1.10 -1.89 115.58 115.13 2kdz h ASN 44 Ca 0.42 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.43 2kdz h ASN 44 Cb 0.17 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.22 2kdz h ASN 44 CO -0.17 0.03 0.00 0.59 -1.29 0.00 0.00 177.43 176.59 2kdz n ASN 45 N -3.19 1.67 0.02 1.15 3.02 -0.39 -4.07 115.26 113.47 2kdz n ASN 45 Ca -0.01 -1.73 0.00 0.00 -0.03 0.00 0.00 54.58 52.82 2kdz n ASN 45 Cb 0.23 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.40 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 -0.36 -0.09 0.55 3.10 9.36 0.27 -4.81 117.16 125.17 2kdz n TYR 46 Ca 0.00 0.02 0.06 0.00 3.32 0.00 0.00 57.90 61.30 2kdz n TYR 46 Cb 0.20 0.07 0.01 0.00 -0.63 0.00 0.00 39.34 38.99 2kdz n TYR 46 CO 0.00 0.00 0.00 0.44 0.22 0.00 0.00 176.86 177.52 2kdz n ILE 47 N -3.10 0.00 -0.08 2.97 -0.00 -1.12 -4.65 119.36 113.38 2kdz n ILE 47 Ca 0.00 -0.39 -0.12 0.00 -0.00 0.00 0.00 62.75 62.25 2kdz n ILE 47 Cb 0.31 1.16 -0.06 0.00 -0.00 0.00 0.00 39.64 41.05 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 1.52 0.00 -5.39 7.28 -1.24 -1.58 -3.49 115.58 112.68 2kdz h ASN 48 Ca 0.00 -0.29 -0.32 0.00 0.71 0.00 0.00 56.30 56.40 2kdz h ASN 48 Cb 0.44 0.00 0.03 0.00 0.73 0.00 0.00 38.32 39.52 2kdz h ASN 48 CO 0.00 1.04 -0.00 -0.81 -1.29 0.00 0.00 177.43 176.37 2kdz n PRO 49 N -4.56 0.52 -3.08 6.67 -0.04 -1.26 -5.06 135.00 128.19 2kdz n PRO 49 Ca -0.17 -1.98 -0.25 0.00 -0.04 0.00 0.00 63.50 61.06 2kdz n PRO 49 Cb 0.42 -0.26 -0.05 0.00 -0.04 0.00 0.00 33.50 33.57 2kdz n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kdz n ALA 50 N -2.69 4.02 -2.14 0.55 0.00 -1.26 -4.81 120.51 114.17 2kdz n ALA 50 Ca -0.10 -4.44 -0.35 0.00 0.00 0.00 0.00 53.44 48.56 2kdz n ALA 50 Cb 0.40 -0.80 -0.04 0.00 0.00 0.00 0.00 19.45 19.01 2kdz n ALA 50 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2kdz n LEU 51 N 0.12 3.89 0.00 0.00 -0.00 -1.26 -4.78 117.00 114.98 2kdz n LEU 51 Ca 0.29 -3.43 0.00 0.00 -0.00 0.00 0.00 56.01 52.87 2kdz n LEU 51 Cb 0.45 -1.69 0.00 0.00 -0.00 0.00 0.00 43.42 42.17 2kdz n LEU 51 CO 0.32 -0.97 0.00 -2.11 -0.00 0.00 0.00 177.39 174.63 2kdz n ARG 52 N 8.13 0.00 -4.05 1.47 1.85 -1.26 -4.99 116.66 117.81 2kdz n ARG 52 Ca 0.47 0.00 -0.33 0.00 -1.00 0.00 0.00 57.85 56.99 2kdz n ARG 52 Cb 0.46 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.83 2kdz n ARG 52 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2kdz n THR 53 N 0.00 -1.47 -0.90 8.89 -1.04 -1.26 -4.56 114.28 113.94 2kdz n THR 53 Ca 0.00 -0.46 0.11 0.00 -2.04 0.00 0.00 64.05 61.66 2kdz n THR 53 Cb 0.00 -1.32 -0.05 0.00 -1.82 0.00 0.00 70.33 67.14 2kdz n THR 53 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2kdz n ASP 54 N -2.08 -5.06 -3.40 8.00 9.92 -1.26 -4.98 116.55 117.69 2kdz n ASP 54 Ca -0.20 0.81 0.00 0.00 -0.53 0.00 0.00 54.79 54.88 2kdz n ASP 54 Cb 0.54 -3.02 0.00 0.00 -0.64 0.00 0.00 41.12 38.00 2kdz n ASP 54 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 2kdz n PRO 55 N -3.52 2.27 -2.72 -0.24 -0.04 -1.26 -5.05 135.00 124.43 2kdz n PRO 55 Ca -0.05 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.17 2kdz n PRO 55 Cb 0.42 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.91 2kdz n PRO 55 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 2kdz s TRP 56 N 0.00 3.16 0.54 0.54 1.48 -1.26 -5.09 118.94 118.31 2kdz s TRP 56 Ca 0.00 0.32 -0.05 0.00 -1.06 0.00 0.00 56.10 55.32 2kdz s TRP 56 Cb 0.00 -2.54 -0.00 0.00 -1.16 0.00 0.00 33.47 29.76 2kdz s TRP 56 CO 0.00 -0.62 0.84 -1.54 -4.06 0.00 0.00 176.95 171.57 2kdz s SER 57 N -4.29 5.78 0.58 -2.66 1.04 -1.26 -4.92 113.70 107.98 2kdz s SER 57 Ca 0.52 0.70 0.33 0.00 0.48 0.00 0.00 55.95 57.97 2kdz s SER 57 Cb -0.10 -1.80 1.79 0.00 0.10 0.00 0.00 66.02 66.00 2kdz s SER 57 CO 0.40 -0.90 1.99 -0.65 0.98 0.00 0.00 173.24 175.07 2kdz h PRO 58 N 0.00 0.00 -0.26 4.02 0.11 -1.98 -0.70 132.00 133.19 2kdz h PRO 58 Ca -0.46 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.55 2kdz h PRO 58 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2kdz h PRO 58 CO 0.60 0.00 -0.23 0.93 -0.21 0.00 0.00 178.00 179.09 2kdz h GLU 59 N 0.00 0.62 -0.16 1.05 5.08 -2.00 -1.80 114.58 117.37 2kdz h GLU 59 Ca 0.00 -0.32 -0.14 0.00 -1.00 0.00 0.00 59.36 57.91 2kdz h GLU 59 Cb 0.31 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2kdz h GLU 59 CO 0.00 0.91 -0.48 0.93 -1.00 0.00 0.00 179.01 179.37 2kdz h GLU 60 N 0.35 0.43 -0.64 2.33 3.07 -1.53 -2.28 114.58 116.31 2kdz h GLU 60 Ca 0.05 -0.24 0.03 0.00 -0.50 0.00 0.00 59.36 58.70 2kdz h GLU 60 Cb 0.78 0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 28.67 2kdz h GLU 60 CO 0.06 0.82 0.38 0.22 -1.40 0.00 0.00 179.01 179.09 2kdz h ASP 61 N 0.34 0.62 0.10 1.42 3.58 -1.17 0.70 116.42 122.01 2kdz h ASP 61 Ca 0.02 0.01 -0.21 0.00 0.42 0.00 0.00 57.03 57.26 2kdz h ASP 61 Cb 0.97 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.90 2kdz h ASP 61 CO 0.08 0.42 -0.81 0.24 -2.88 0.00 0.00 179.24 176.30 2kdz h MET 62 N 0.75 0.57 0.04 0.28 2.86 -1.20 -2.75 114.93 115.48 2kdz h MET 62 Ca 0.26 -0.50 -0.27 0.00 -2.06 0.00 0.00 59.70 57.14 2kdz h MET 62 Cb 0.05 0.11 0.02 0.00 0.06 0.00 0.00 31.60 31.84 2kdz h MET 62 CO -0.12 1.12 -1.08 1.25 1.06 0.00 0.00 176.91 179.14 2kdz h LEU 63 N 0.37 0.78 -0.52 1.22 5.85 -1.11 -3.18 115.31 118.71 2kdz h LEU 63 Ca -0.05 -0.66 -0.00 0.00 0.84 0.00 0.00 57.88 58.01 2kdz h LEU 63 Cb 1.42 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.18 2kdz h LEU 63 CO 0.15 1.46 0.32 0.25 -0.34 0.00 0.00 178.44 180.29 2kdz h LEU 64 N 0.30 0.63 -1.41 2.25 6.46 0.37 0.16 115.31 124.06 2kdz h LEU 64 Ca -0.13 -0.05 0.03 0.00 -0.12 0.00 0.00 57.88 57.61 2kdz h LEU 64 Cb 1.74 -0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 41.48 2kdz h LEU 64 CO 0.20 0.49 0.42 -0.78 -0.62 0.00 0.00 178.44 178.16 2kdz h ASP 65 N 0.71 0.66 -0.00 1.25 3.58 -1.55 0.58 116.42 121.65 2kdz h ASP 65 Ca 0.19 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.63 2kdz h ASP 65 Cb -0.02 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.87 2kdz h ASP 65 CO -0.04 0.46 -0.00 -0.61 -2.88 0.00 0.00 179.24 176.17 2kdz h GLN 66 N 0.77 0.00 0.00 0.28 4.15 -1.35 -2.47 115.11 116.50 2kdz h GLN 66 Ca 0.25 -0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.64 2kdz h GLN 66 Cb 0.06 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.74 2kdz h GLN 66 CO -0.07 0.56 -0.14 0.87 -1.93 0.00 0.00 178.83 178.12 2kdz h LYS 67 N -0.56 0.00 0.00 1.69 1.79 -0.50 -1.29 116.57 117.71 2kdz h LYS 67 Ca 0.00 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.41 2kdz h LYS 67 Cb 0.56 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.20 2kdz h LYS 67 CO 0.00 0.14 -0.28 -0.92 -1.08 0.00 0.00 179.45 177.31 2kdz h TYR 68 N 0.00 0.00 -0.01 -1.35 3.20 0.25 0.17 116.97 119.24 2kdz h TYR 68 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2kdz h TYR 68 Cb 0.38 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.65 2kdz h TYR 68 CO 0.00 0.28 -0.34 0.00 -1.64 0.00 0.00 178.16 176.46 2kdz n ALA 69 N -2.20 3.25 -0.07 1.82 0.00 -0.52 -2.19 120.51 120.60 2kdz n ALA 69 Ca 0.01 -0.43 -0.13 0.00 0.00 0.00 0.00 53.44 52.89 2kdz n ALA 69 Cb 0.54 -1.08 -0.05 0.00 0.00 0.00 0.00 19.45 18.86 2kdz n ALA 69 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2kdz n GLU 70 N -0.71 0.30 -0.03 0.00 -0.58 -0.99 -4.75 120.64 113.88 2kdz n GLU 70 Ca 0.11 0.11 -0.16 0.00 -0.42 0.00 0.00 57.16 56.79 2kdz n GLU 70 Cb 0.36 -1.07 -0.14 0.00 -0.57 0.00 0.00 31.44 30.02 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 -3.35 0.93 0.00 -0.32 4.02 0.58 -5.10 117.16 113.93 2kdz n TYR 71 Ca -0.25 0.24 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 2kdz n TYR 71 Cb 0.71 -1.14 0.00 0.00 -0.02 0.00 0.00 39.34 38.89 2kdz n TYR 71 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2kdz n GLY 72 N 1.88 -1.32 1.26 2.72 0.00 -0.93 -4.51 105.19 104.29 2kdz n GLY 72 Ca -0.29 -2.08 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 0.98 -1.68 1.61 -0.04 -1.26 -4.55 135.00 130.07 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 -1.01 -0.01 0.00 -0.04 0.00 0.00 33.50 32.44 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 1.03 3.68 -0.34 0.54 5.02 -1.26 -4.74 118.16 122.08 2kdz n LYS 74 Ca 0.00 -2.72 0.26 0.00 -2.02 0.00 0.00 58.31 53.84 2kdz n LYS 74 Cb 0.49 -2.90 0.56 0.00 -0.02 0.00 0.00 35.03 33.17 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 5.25 0.55 0.00 2.13 -0.00 -1.96 0.34 115.95 122.25 2kdz h TRP 75 Ca 0.71 0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 59.61 2kdz h TRP 75 Cb 0.41 -0.15 -0.00 0.00 -0.00 0.00 0.00 29.16 29.42 2kdz h TRP 75 CO 1.65 0.02 -0.06 -0.97 -0.00 0.00 0.00 178.44 179.08 2kdz h ASN 76 N 0.30 0.00 0.32 -3.49 -0.73 -1.95 -0.04 115.58 109.99 2kdz h ASN 76 Ca 0.62 0.00 -0.33 0.00 1.87 0.00 0.00 56.30 58.46 2kdz h ASN 76 Cb 1.76 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 40.33 2kdz h ASN 76 CO -0.27 0.06 -1.75 0.11 -0.37 0.00 0.00 177.43 175.20 2kdz h LYS 77 N 0.00 0.22 -0.81 6.67 6.56 -0.79 -3.36 116.57 125.05 2kdz h LYS 77 Ca -0.00 -0.37 -0.03 0.00 -1.06 0.00 0.00 60.65 59.19 2kdz h LYS 77 Cb 0.10 0.14 -0.04 0.00 -0.57 0.00 0.00 32.23 31.86 2kdz h LYS 77 CO 0.01 1.04 0.37 0.82 -2.06 0.00 0.00 179.45 179.62 2kdz h ILE 78 N 0.06 1.25 0.00 1.86 1.08 -0.62 -1.76 117.51 119.38 2kdz h ILE 78 Ca -0.32 -0.74 0.00 0.00 -0.39 0.00 0.00 64.86 63.40 2kdz h ILE 78 Cb 2.03 0.24 0.00 0.00 -3.07 0.00 0.00 36.82 36.02 2kdz h ILE 78 CO 0.12 0.31 0.00 0.77 -0.69 0.00 0.00 178.15 178.66 2kdz h SER 79 N 1.16 0.00 1.84 1.72 4.64 -1.17 -0.53 113.55 121.20 2kdz h SER 79 Ca 0.28 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.57 2kdz h SER 79 Cb 0.14 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2kdz h SER 79 CO -0.03 0.00 -0.16 0.11 -0.87 0.00 0.00 176.83 175.87 2kdz h LYS 80 N 0.00 0.00 0.00 4.77 1.57 -1.46 -3.11 116.57 118.33 2kdz h LYS 80 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2kdz h LYS 80 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 2kdz h LYS 80 CO 0.00 0.13 -1.16 1.19 -0.57 0.00 0.00 179.45 179.04 2kdz n PHE 81 N -3.12 0.42 -3.88 -1.35 3.72 -0.25 -4.63 117.46 108.38 2kdz n PHE 81 Ca 0.03 0.12 -0.32 0.00 -0.05 0.00 0.00 57.45 57.23 2kdz n PHE 81 Cb 0.59 -0.59 -0.13 0.00 -0.94 0.00 0.00 39.48 38.40 2kdz n PHE 81 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 2kdz s LEU 82 N -4.41 4.64 -1.06 4.37 1.98 -0.95 -5.02 118.68 118.23 2kdz s LEU 82 Ca 0.01 -2.92 -0.21 0.00 -2.89 0.00 0.00 54.13 48.12 2kdz s LEU 82 Cb 0.13 -1.71 -0.09 0.00 0.66 0.00 0.00 46.19 45.18 2kdz s LEU 82 CO 0.81 -0.28 1.93 1.17 -1.89 0.00 0.00 176.35 178.09 2kdz n LYS 83 N 3.29 1.82 0.00 1.98 4.81 -1.26 -3.14 118.16 125.66 2kdz n LYS 83 Ca 0.06 -2.33 0.00 0.00 -0.87 0.00 0.00 58.31 55.17 2kdz n LYS 83 Cb 0.34 -3.36 0.00 0.00 0.02 0.00 0.00 35.03 32.03 2kdz n LYS 83 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2kdz n ASN 84 N 10.53 0.00 -4.86 3.14 4.05 -1.26 -5.13 115.26 121.73 2kdz n ASN 84 Ca 0.48 0.00 -0.37 0.00 0.45 0.00 0.00 54.58 55.14 2kdz n ASN 84 Cb 0.44 0.00 -0.06 0.00 1.23 0.00 0.00 39.78 41.39 2kdz n ASN 84 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2kdz s ARG 85 N 0.00 3.76 0.53 1.20 1.81 -1.19 -4.16 118.95 120.90 2kdz s ARG 85 Ca 0.00 0.21 0.07 0.00 -1.72 0.00 0.00 55.73 54.29 2kdz s ARG 85 Cb 0.00 -3.16 0.05 0.00 -0.45 0.00 0.00 34.95 31.39 2kdz s ARG 85 CO 0.00 0.68 0.54 -1.54 -0.68 0.00 0.00 175.30 174.30 2kdz s SER 86 N -1.27 4.89 0.00 0.23 1.04 -1.26 -4.62 113.70 112.72 2kdz s SER 86 Ca 0.24 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 55.67 2kdz s SER 86 Cb -0.15 0.19 0.00 0.00 0.10 0.00 0.00 66.02 66.16 2kdz s SER 86 CO 0.13 -1.11 0.88 -0.90 0.98 0.00 0.00 173.24 173.22 2kdz n ASP 87 N -1.90 0.00 0.22 7.02 5.75 -1.26 -0.12 116.55 126.26 2kdz n ASP 87 Ca 0.06 0.88 0.18 0.00 -0.01 0.00 0.00 54.79 55.90 2kdz n ASP 87 Cb 0.63 -0.38 0.85 0.00 -1.03 0.00 0.00 41.12 41.19 2kdz n ASP 87 CO 0.00 0.00 0.00 -1.13 -0.11 0.00 0.00 177.20 175.96 2kdz h ASN 88 N 0.00 0.00 0.00 -1.12 -1.24 -1.96 -0.40 115.58 110.86 2kdz h ASN 88 Ca 0.00 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.01 2kdz h ASN 88 Cb 0.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.05 2kdz h ASN 88 CO 0.00 0.00 -0.00 -1.13 -1.29 0.00 0.00 177.43 175.01 2kdz h ASN 89 N 0.00 -0.00 -0.64 1.15 -0.73 -1.86 -2.67 115.58 110.84 2kdz h ASN 89 Ca 0.08 -0.98 -0.03 0.00 1.87 0.00 0.00 56.30 57.24 2kdz h ASN 89 Cb 0.57 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.13 2kdz h ASN 89 CO -0.00 0.98 0.28 0.40 -0.37 0.00 0.00 177.43 178.72 2kdz h ILE 90 N -0.98 1.23 -0.18 2.57 2.04 0.07 0.48 117.51 122.74 2kdz h ILE 90 Ca -0.00 -0.67 0.00 0.00 1.00 0.00 0.00 64.86 65.19 2kdz h ILE 90 Cb 0.98 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 2kdz h ILE 90 CO 0.00 0.27 0.12 -0.09 0.00 0.00 0.00 178.15 178.45 2kdz h ARG 91 N 0.88 0.23 -0.30 2.37 9.65 -1.22 0.45 114.38 126.45 2kdz h ARG 91 Ca 0.22 -0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 59.07 2kdz h ARG 91 Cb 0.16 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.67 2kdz h ARG 91 CO -0.02 0.16 0.16 -0.97 2.80 0.00 0.00 179.97 182.09 2kdz h ASN 92 N 0.24 0.38 -0.15 -3.80 -0.73 -1.23 -1.79 115.58 108.50 2kdz h ASN 92 Ca 0.06 -0.10 -0.02 0.00 1.87 0.00 0.00 56.30 58.12 2kdz h ASN 92 Cb -0.02 -0.10 -0.01 0.00 0.27 0.00 0.00 38.32 38.46 2kdz h ASN 92 CO -0.01 0.37 0.03 -0.09 -0.37 0.00 0.00 177.43 177.36 2kdz h ARG 93 N 0.36 0.25 -0.77 6.67 9.65 -0.64 -1.58 114.38 128.31 2kdz h ARG 93 Ca 0.10 -0.06 -0.00 0.00 -1.10 0.00 0.00 59.98 58.92 2kdz h ARG 93 Cb 0.08 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 28.60 2kdz h ARG 93 CO -0.02 0.41 0.47 2.35 2.80 0.00 0.00 179.97 185.99 2kdz h TRP 94 N 0.04 1.01 -0.25 2.20 2.91 -0.07 0.43 115.95 122.21 2kdz h TRP 94 Ca 0.05 -0.00 -0.10 0.00 1.13 0.00 0.00 58.89 59.96 2kdz h TRP 94 Cb 0.28 -0.33 -0.01 0.00 -0.51 0.00 0.00 29.16 28.59 2kdz h TRP 94 CO 0.01 0.67 -0.28 1.98 -1.03 0.00 0.00 178.44 179.79 2kdz h MET 95 N 1.05 0.51 0.01 2.65 4.05 -1.27 -1.63 114.93 120.30 2kdz h MET 95 Ca 0.28 -0.20 -0.02 0.00 -0.28 0.00 0.00 59.70 59.47 2kdz h MET 95 Cb -0.05 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 30.73 2kdz h MET 95 CO -0.05 0.74 -0.10 1.98 0.23 0.00 0.00 176.91 179.71 2kdz h MET 96 N 0.44 0.05 0.00 0.39 1.85 -0.76 -3.33 114.93 113.57 2kdz h MET 96 Ca 0.06 -0.06 -0.04 0.00 -0.61 0.00 0.00 59.70 59.05 2kdz h MET 96 Cb 0.72 0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.77 2kdz h MET 96 CO 0.06 0.94 -0.18 0.97 -0.40 0.00 0.00 176.91 178.30 2kdz h ILE 97 N -0.82 1.05 -0.18 1.77 6.09 -0.19 -2.40 117.51 122.84 2kdz h ILE 97 Ca -0.02 -0.63 -0.00 0.00 -1.37 0.00 0.00 64.86 62.84 2kdz h ILE 97 Cb 0.98 1.35 -0.01 0.00 0.47 0.00 0.00 36.82 39.61 2kdz h ILE 97 CO 0.02 0.18 0.10 0.00 -3.07 0.00 0.00 178.15 175.37 2kdz h ALA 98 N 1.82 1.84 0.00 0.18 0.00 -1.39 0.24 119.26 121.95 2kdz h ALA 98 Ca -0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2kdz h ALA 98 Cb 0.33 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2kdz h ALA 98 CO 0.02 0.14 -0.23 -0.09 0.00 0.00 0.00 179.25 179.10 2kdz h ARG 99 N 0.24 0.00 0.01 0.00 2.43 -1.55 -1.09 114.38 114.42 2kdz h ARG 99 Ca 0.06 0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 58.93 2kdz h ARG 99 Cb 0.00 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.51 2kdz h ARG 99 CO -0.01 0.23 -1.75 1.58 -1.51 0.00 0.00 179.97 178.51 2kdz n HIS 100 N -3.30 1.02 -0.12 2.20 -0.00 -0.22 -3.77 115.22 111.04 2kdz n HIS 100 Ca 0.01 0.35 -0.12 0.00 0.46 0.00 0.00 57.72 58.41 2kdz n HIS 100 Cb 0.48 -1.18 -0.01 0.00 -0.12 0.00 0.00 29.99 29.16 2kdz n HIS 100 CO 0.00 0.00 0.00 -0.09 0.46 0.00 0.00 176.34 176.71 2kdz h ARG 101 N 0.01 0.92 0.00 1.57 9.65 -0.46 -2.74 114.38 123.34 2kdz h ARG 101 Ca -0.30 -0.47 0.00 0.00 -1.10 0.00 0.00 59.98 58.10 2kdz h ARG 101 Cb 2.02 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 30.61 2kdz h ARG 101 CO 0.08 1.13 0.00 0.00 2.80 0.00 0.00 179.97 183.98 2kdz n ALA 102 N -2.54 2.56 -0.59 2.80 0.00 -0.43 -4.99 120.51 117.33 2kdz n ALA 102 Ca -0.02 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2kdz n ALA 102 Cb 0.53 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.73 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 -0.75 0.00 -3.15 0.00 4.76 -1.03 -4.77 118.16 113.21 2kdz n LYS 103 Ca 0.12 0.00 0.04 0.00 -2.87 0.00 0.00 58.31 55.60 2kdz n LYS 103 Cb 0.05 0.00 -0.00 0.00 -1.84 0.00 0.00 35.03 33.24 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 -1.63 0.62 2.13 -3.43 -1.26 -4.78 115.29 106.93 2kdz s HIS 104 Ca 0.00 1.09 -0.19 0.00 -0.80 0.00 0.00 55.06 55.16 2kdz s HIS 104 Cb 0.00 0.33 -0.03 0.00 -1.43 0.00 0.00 32.58 31.45 2kdz s HIS 104 CO 0.00 -0.94 1.19 1.04 -2.00 0.00 0.00 174.74 174.03 2kdz n GLN 105 N 5.39 1.13 0.06 -0.38 6.02 -1.26 -4.89 117.38 123.45 2kdz n GLN 105 Ca 0.04 0.44 0.00 0.00 -0.01 0.00 0.00 57.00 57.47 2kdz n GLN 105 Cb 0.54 -2.41 0.00 0.00 1.02 0.00 0.00 30.24 29.39 2kdz n GLN 105 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 2kdz n LYS 106 N -1.46 0.00 0.00 -1.09 4.81 -1.26 -5.33 118.16 113.84 2kdz n LYS 106 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.58 2kdz n LYS 106 Cb 0.47 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.52 2kdz n LYS 106 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00