#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k1b n GLN 2 N 0.00 0.17 -3.10 3.44 3.00 -1.26 -4.61 117.38 115.02 2k1b n GLN 2 Ca 0.00 0.09 -0.45 0.00 -0.01 0.00 0.00 57.00 56.63 2k1b n GLN 2 Cb 0.00 -1.65 -0.03 0.00 0.00 0.00 0.00 30.24 28.56 2k1b n GLN 2 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 2k1b s VAL 3 N -3.08 4.93 -0.74 5.09 1.01 -1.26 -4.99 120.40 121.36 2k1b s VAL 3 Ca 0.10 -1.40 -0.21 0.00 0.00 0.00 0.00 61.98 60.47 2k1b s VAL 3 Cb 0.15 -4.57 0.10 0.00 0.00 0.00 0.00 36.38 32.06 2k1b s VAL 3 CO 0.64 -1.22 0.97 -0.36 0.00 0.00 0.00 175.10 175.13 2k1b s PHE 4 N 2.25 2.88 0.26 5.22 0.40 -1.26 -5.04 117.98 122.69 2k1b s PHE 4 Ca 0.18 -0.91 0.06 0.00 -0.60 0.00 0.00 56.93 55.67 2k1b s PHE 4 Cb -0.16 -4.24 -0.03 0.00 0.51 0.00 0.00 43.02 39.10 2k1b s PHE 4 CO -0.01 -1.53 0.31 0.00 0.70 0.00 0.00 175.22 174.69 2k1b s ALA 5 N 3.34 3.83 0.55 5.36 0.00 -1.26 -5.03 121.76 128.56 2k1b s ALA 5 Ca 0.24 -1.36 -0.21 0.00 0.00 0.00 0.00 51.96 50.62 2k1b s ALA 5 Cb -0.14 -1.52 -0.05 0.00 0.00 0.00 0.00 23.12 21.42 2k1b s ALA 5 CO 0.03 0.19 1.34 0.54 0.00 0.00 0.00 175.76 177.86 2k1b s VAL 6 N -2.09 2.12 0.03 0.00 0.11 -1.26 -4.96 120.40 114.35 2k1b s VAL 6 Ca 0.36 0.09 -0.12 0.00 -2.93 0.00 0.00 61.98 59.37 2k1b s VAL 6 Cb -0.08 -3.04 -0.06 0.00 -1.53 0.00 0.00 36.38 31.67 2k1b s VAL 6 CO 0.28 -0.00 1.19 -0.08 -3.33 0.00 0.00 175.10 173.16 2k1b h GLU 7 N 1.38 -0.31 -2.55 1.54 4.57 -1.80 -3.47 114.58 113.94 2k1b h GLU 7 Ca -0.51 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 57.76 2k1b h GLU 7 Cb 1.30 0.07 -0.14 0.00 -0.16 0.00 0.00 28.75 29.83 2k1b h GLU 7 CO 0.57 -0.21 0.39 0.45 -1.18 0.00 0.00 179.01 179.03 2k1b s SER 8 N -3.07 -0.43 -0.27 1.04 0.15 -1.25 -5.00 113.70 104.87 2k1b s SER 8 Ca -0.06 -0.03 -0.11 0.00 0.70 0.00 0.00 55.95 56.45 2k1b s SER 8 Cb 0.02 0.47 -0.05 0.00 -1.71 0.00 0.00 66.02 64.75 2k1b s SER 8 CO 0.21 -0.77 0.17 -0.63 1.20 0.00 0.00 173.24 173.42 2k1b s ILE 9 N -3.37 5.21 -0.05 6.45 1.01 -1.26 -0.43 121.20 128.76 2k1b s ILE 9 Ca 0.04 0.14 -0.13 0.00 0.00 0.00 0.00 60.65 60.69 2k1b s ILE 9 Cb -0.01 -3.47 -0.08 0.00 0.01 0.00 0.00 42.46 38.90 2k1b s ILE 9 CO -0.10 0.27 0.54 -0.09 0.00 0.00 0.00 174.94 175.56 2k1b h ARG 10 N 8.25 -0.35 -3.80 2.79 1.12 -1.19 -3.44 114.38 117.76 2k1b h ARG 10 Ca -0.36 0.02 -0.09 0.00 -1.11 0.00 0.00 59.98 58.45 2k1b h ARG 10 Cb 1.19 0.08 -0.13 0.00 -0.01 0.00 0.00 29.97 31.09 2k1b h ARG 10 CO 0.57 -0.15 -0.33 -1.59 -3.11 0.00 0.00 179.97 175.36 2k1b s LYS 11 N -2.94 0.97 0.42 0.20 -2.85 -1.22 -5.04 119.74 109.29 2k1b s LYS 11 Ca -0.07 -1.02 0.07 0.00 -1.00 0.00 0.00 55.97 53.95 2k1b s LYS 11 Cb 0.00 0.37 -0.05 0.00 -2.06 0.00 0.00 37.83 36.09 2k1b s LYS 11 CO 0.24 -0.34 0.14 -1.59 0.10 0.00 0.00 175.35 173.90 2k1b s LYS 12 N -3.89 2.16 -0.19 1.78 -2.85 -1.26 -0.65 119.74 114.84 2k1b s LYS 12 Ca 0.09 -1.93 -0.28 0.00 -1.00 0.00 0.00 55.97 52.85 2k1b s LYS 12 Cb 0.04 -1.89 0.09 0.00 -2.06 0.00 0.00 37.83 34.01 2k1b s LYS 12 CO -0.07 -0.12 0.80 0.50 0.10 0.00 0.00 175.35 176.55 2k1b s ARG 13 N -3.87 0.82 -0.29 1.78 3.52 -0.57 -4.93 118.95 115.41 2k1b s ARG 13 Ca 0.38 0.57 -0.06 0.00 -0.13 0.00 0.00 55.73 56.50 2k1b s ARG 13 Cb 0.05 0.39 0.01 0.00 -1.56 0.00 0.00 34.95 33.85 2k1b s ARG 13 CO 0.21 -0.18 0.06 0.08 -0.81 0.00 0.00 175.30 174.65 2k1b s VAL 14 N -0.36 3.77 -0.04 7.11 1.01 -1.26 -0.98 120.40 129.66 2k1b s VAL 14 Ca -0.03 -0.76 -0.10 0.00 0.00 0.00 0.00 61.98 61.09 2k1b s VAL 14 Cb -0.03 -2.95 0.02 0.00 0.00 0.00 0.00 36.38 33.42 2k1b s VAL 14 CO 0.03 0.10 0.23 -0.60 0.00 0.00 0.00 175.10 174.85 2k1b s ARG 15 N 1.47 0.47 -1.58 2.72 3.00 -0.47 -4.86 118.95 119.69 2k1b s ARG 15 Ca 0.02 -0.06 0.00 0.00 -1.00 0.00 0.00 55.73 54.69 2k1b s ARG 15 Cb -0.17 0.21 0.00 0.00 0.00 0.00 0.00 34.95 34.99 2k1b s ARG 15 CO 0.01 -0.11 0.00 0.36 0.00 0.00 0.00 175.30 175.57 2k1b n LYS 16 N 1.94 -1.65 -1.93 5.12 2.85 -1.26 -1.20 118.16 122.03 2k1b n LYS 16 Ca -0.19 0.88 -0.09 0.00 -1.05 0.00 0.00 58.31 57.87 2k1b n LYS 16 Cb 0.57 -5.34 -0.01 0.00 -0.65 0.00 0.00 35.03 29.59 2k1b n LYS 16 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2k1b n GLY 17 N -0.59 0.27 2.83 2.58 0.00 -1.26 -5.04 105.19 103.98 2k1b n GLY 17 Ca -0.18 -0.56 -0.20 0.00 0.00 0.00 0.00 46.02 45.08 2k1b n GLY 17 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k1b s LYS 18 N -4.00 0.61 -0.46 1.61 2.47 -0.34 -5.11 119.74 114.51 2k1b s LYS 18 Ca 0.00 0.02 -0.29 0.00 -1.56 0.00 0.00 55.97 54.14 2k1b s LYS 18 Cb 0.00 -0.80 0.03 0.00 -1.46 0.00 0.00 37.83 35.60 2k1b s LYS 18 CO 0.00 -0.18 1.13 0.08 0.16 0.00 0.00 175.35 176.54 2k1b s VAL 19 N 1.34 4.24 0.15 4.02 1.01 -1.26 -1.37 120.40 128.52 2k1b s VAL 19 Ca -0.05 1.26 0.09 0.00 0.00 0.00 0.00 61.98 63.29 2k1b s VAL 19 Cb -0.13 -4.59 -0.04 0.00 0.00 0.00 0.00 36.38 31.62 2k1b s VAL 19 CO -0.02 -0.96 -0.16 -1.83 0.00 0.00 0.00 175.10 172.12 2k1b s GLU 20 N 4.38 1.82 -0.12 2.72 -1.05 -0.15 -1.35 118.70 124.96 2k1b s GLU 20 Ca 0.48 -1.26 -0.00 0.00 -0.15 0.00 0.00 54.97 54.03 2k1b s GLU 20 Cb -0.08 -2.08 0.02 0.00 -0.44 0.00 0.00 34.13 31.55 2k1b s GLU 20 CO 0.30 0.45 -0.09 0.71 0.95 0.00 0.00 175.26 177.59 2k1b s TYR 21 N -1.39 1.60 -0.44 4.83 1.51 -0.24 -1.51 117.35 121.70 2k1b s TYR 21 Ca 0.20 -0.81 -0.28 0.00 -1.01 0.00 0.00 57.07 55.18 2k1b s TYR 21 Cb -0.10 -1.29 -0.02 0.00 -0.11 0.00 0.00 41.96 40.45 2k1b s TYR 21 CO 0.12 -0.53 1.82 -1.17 -1.11 0.00 0.00 175.55 174.67 2k1b s LEU 22 N 1.64 3.43 0.22 -1.29 2.96 0.18 -1.88 118.68 123.94 2k1b s LEU 22 Ca 0.04 0.92 0.05 0.00 -0.22 0.00 0.00 54.13 54.92 2k1b s LEU 22 Cb -0.13 -3.12 -0.03 0.00 0.50 0.00 0.00 46.19 43.41 2k1b s LEU 22 CO -0.08 -1.98 0.33 0.68 -1.32 0.00 0.00 176.35 173.98 2k1b s VAL 23 N 7.78 5.20 -0.01 1.68 -7.23 -0.54 -0.62 120.40 126.66 2k1b s VAL 23 Ca 0.75 -0.95 0.01 0.00 -1.81 0.00 0.00 61.98 59.97 2k1b s VAL 23 Cb -0.18 -3.79 -0.04 0.00 0.56 0.00 0.00 36.38 32.94 2k1b s VAL 23 CO 0.29 -0.27 0.02 -0.75 -0.31 0.00 0.00 175.10 174.07 2k1b s LYS 24 N -3.78 2.88 0.30 4.82 2.20 0.43 -3.29 119.74 123.30 2k1b s LYS 24 Ca 0.34 -0.55 -0.16 0.00 -0.36 0.00 0.00 55.97 55.23 2k1b s LYS 24 Cb -0.09 -2.73 -0.09 0.00 -1.51 0.00 0.00 37.83 33.40 2k1b s LYS 24 CO 0.28 0.64 0.74 -1.58 -0.36 0.00 0.00 175.35 175.08 2k1b s TRP 25 N -1.09 3.43 0.16 4.03 0.52 -1.26 -2.47 118.94 122.26 2k1b s TRP 25 Ca 0.19 1.27 0.22 0.00 0.02 0.00 0.00 56.10 57.81 2k1b s TRP 25 Cb -0.12 -2.57 0.86 0.00 -1.15 0.00 0.00 33.47 30.50 2k1b s TRP 25 CO 0.10 0.14 1.81 0.87 0.02 0.00 0.00 176.95 179.89 2k1b h LYS 26 N 2.50 0.00 0.00 4.98 1.57 -1.96 -3.30 116.57 120.36 2k1b h LYS 26 Ca -0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 2k1b h LYS 26 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2k1b h LYS 26 CO 0.65 0.27 0.00 0.41 -0.57 0.00 0.00 179.45 180.21 2k1b n GLY 27 N 0.14 0.30 3.19 3.86 0.00 -1.26 -5.07 105.19 106.35 2k1b n GLY 27 Ca -0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2k1b n GLY 27 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2k1b s TRP 28 N -0.51 1.49 0.84 1.61 0.52 -1.24 -5.15 118.94 116.50 2k1b s TRP 28 Ca 0.00 -0.35 -0.12 0.00 0.02 0.00 0.00 56.10 55.65 2k1b s TRP 28 Cb 0.00 -0.90 0.10 0.00 -1.15 0.00 0.00 33.47 31.53 2k1b s TRP 28 CO 0.00 0.05 1.19 -1.25 0.02 0.00 0.00 176.95 176.96 2k1b s PRO 29 N -1.07 1.45 0.00 4.98 0.04 -1.26 -4.40 135.00 134.74 2k1b s PRO 29 Ca 0.05 1.68 0.06 0.00 0.04 0.00 0.00 61.00 62.83 2k1b s PRO 29 Cb -0.08 -1.76 0.35 0.00 0.04 0.00 0.00 34.50 33.05 2k1b s PRO 29 CO 0.01 -2.34 0.74 -0.35 0.04 0.00 0.00 177.00 175.11 2k1b n PRO 30 N -3.59 0.33 0.13 0.56 -0.04 -1.26 -1.85 135.00 129.28 2k1b n PRO 30 Ca 0.13 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.57 2k1b n PRO 30 Cb 0.51 -1.28 0.16 0.00 -0.04 0.00 0.00 33.50 32.86 2k1b n PRO 30 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 2k1b h LYS 31 N 0.00 0.02 -0.00 0.54 2.10 -1.99 -3.12 116.57 114.12 2k1b h LYS 31 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2k1b h LYS 31 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2k1b h LYS 31 CO 0.00 0.64 -0.15 0.66 -2.00 0.00 0.00 179.45 178.59 2k1b n TYR 32 N -3.80 0.00 -1.57 0.07 4.01 -0.77 -4.89 117.16 110.20 2k1b n TYR 32 Ca -0.01 0.00 -0.49 0.00 -0.16 0.00 0.00 57.90 57.24 2k1b n TYR 32 Cb 0.62 -0.40 -0.05 0.00 -0.31 0.00 0.00 39.34 39.20 2k1b n TYR 32 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2k1b n SER 33 N -1.46 2.86 -4.81 7.72 7.64 -1.18 -4.92 113.62 119.48 2k1b n SER 33 Ca 0.07 0.59 -0.22 0.00 1.01 0.00 0.00 58.87 60.33 2k1b n SER 33 Cb 0.33 -1.36 -0.05 0.00 -1.01 0.00 0.00 64.21 62.13 2k1b n SER 33 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2k1b s THR 34 N 6.24 3.55 -0.52 0.44 -4.23 -1.21 -4.86 115.64 115.04 2k1b s THR 34 Ca 1.01 -1.48 -0.18 0.00 -1.18 0.00 0.00 61.69 59.86 2k1b s THR 34 Cb -0.69 -3.15 0.08 0.00 1.34 0.00 0.00 72.50 70.07 2k1b s THR 34 CO 0.48 -0.21 0.59 0.26 -0.54 0.00 0.00 174.62 175.19 2k1b s TRP 35 N -2.31 3.09 -0.17 3.99 0.52 -1.26 -1.46 118.94 121.34 2k1b s TRP 35 Ca 0.38 -0.79 -0.09 0.00 0.02 0.00 0.00 56.10 55.63 2k1b s TRP 35 Cb -0.05 -3.61 -0.05 0.00 -1.15 0.00 0.00 33.47 28.61 2k1b s TRP 35 CO 0.25 -1.05 0.14 -1.83 0.02 0.00 0.00 176.95 174.48 2k1b s GLU 36 N 2.37 3.91 1.03 4.98 -1.05 -0.79 -4.83 118.70 124.32 2k1b s GLU 36 Ca 0.11 -0.17 -0.12 0.00 -0.15 0.00 0.00 54.97 54.64 2k1b s GLU 36 Cb -0.22 -3.33 0.21 0.00 -0.44 0.00 0.00 34.13 30.34 2k1b s GLU 36 CO 0.09 0.48 1.07 -1.25 0.95 0.00 0.00 175.26 176.60 2k1b s PRO 37 N -0.18 0.13 0.55 -4.83 0.04 -1.26 -1.08 135.00 128.37 2k1b s PRO 37 Ca 0.11 0.88 0.25 0.00 0.04 0.00 0.00 61.00 62.29 2k1b s PRO 37 Cb -0.12 -1.67 1.47 0.00 0.04 0.00 0.00 34.50 34.22 2k1b s PRO 37 CO 0.01 -3.03 2.05 1.49 0.04 0.00 0.00 177.00 177.55 2k1b h GLU 38 N -2.12 0.00 -0.26 4.56 4.22 -1.57 -1.07 114.58 118.33 2k1b h GLU 38 Ca -0.55 0.00 -0.19 0.00 0.08 0.00 0.00 59.36 58.70 2k1b h GLU 38 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 2k1b h GLU 38 CO 0.51 0.00 -0.58 1.05 -2.18 0.00 0.00 179.01 177.81 2k1b h GLU 39 N 0.00 0.85 0.00 1.92 4.11 -1.91 -3.28 114.58 116.27 2k1b h GLU 39 Ca 0.16 -0.57 0.00 0.00 0.07 0.00 0.00 59.36 59.01 2k1b h GLU 39 Cb 0.69 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.02 2k1b h GLU 39 CO -0.00 1.20 0.00 0.72 0.07 0.00 0.00 179.01 181.00 2k1b n HIS 40 N -4.01 0.01 -1.89 2.06 8.25 -0.41 -4.81 115.22 114.42 2k1b n HIS 40 Ca -0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.99 2k1b n HIS 40 Cb 0.65 -0.51 -0.03 0.00 1.12 0.00 0.00 29.99 31.22 2k1b n HIS 40 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2k1b s ILE 41 N -3.00 2.52 0.07 1.59 1.01 -1.22 -4.90 121.20 117.27 2k1b s ILE 41 Ca 0.10 0.35 0.22 0.00 0.00 0.00 0.00 60.65 61.32 2k1b s ILE 41 Cb 0.13 -3.22 0.21 0.00 0.01 0.00 0.00 42.46 39.58 2k1b s ILE 41 CO 0.37 0.03 1.75 -0.07 0.00 0.00 0.00 174.94 177.02 2k1b h LEU 42 N 6.93 0.00 -7.16 2.97 -0.00 -1.93 -3.43 115.31 112.69 2k1b h LEU 42 Ca -0.43 0.00 -0.13 0.00 -0.00 0.00 0.00 57.88 57.32 2k1b h LEU 42 Cb 1.20 0.00 -0.29 0.00 -0.00 0.00 0.00 40.66 41.58 2k1b h LEU 42 CO 0.93 0.27 -0.40 -0.62 -0.00 0.00 0.00 178.44 178.61 2k1b s ASP 43 N -6.25 -0.15 0.20 -0.43 2.15 -1.26 -5.00 116.67 105.94 2k1b s ASP 43 Ca 0.01 0.87 -0.10 0.00 0.43 0.00 0.00 52.55 53.76 2k1b s ASP 43 Cb 0.10 1.09 0.25 0.00 -0.30 0.00 0.00 42.92 44.06 2k1b s ASP 43 CO 0.66 -0.23 1.74 1.55 -0.17 0.00 0.00 175.17 178.72 2k1b h PRO 44 N 8.03 0.35 0.00 4.34 0.13 -1.98 -2.29 132.00 140.58 2k1b h PRO 44 Ca -0.19 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 2k1b h PRO 44 Cb 1.12 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.17 2k1b h PRO 44 CO 0.15 0.23 0.22 0.07 -0.23 0.00 0.00 178.00 178.45 2k1b h ARG 45 N 0.36 0.00 -0.23 0.86 0.11 -2.00 -0.33 114.38 113.16 2k1b h ARG 45 Ca 0.29 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 60.17 2k1b h ARG 45 Cb 0.36 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.45 2k1b h ARG 45 CO -0.31 0.00 -0.65 -0.07 0.10 0.00 0.00 179.97 179.04 2k1b h LEU 46 N 0.00 0.97 -0.95 0.08 3.38 -1.82 -1.09 115.31 115.88 2k1b h LEU 46 Ca 0.00 -0.58 -0.07 0.00 0.09 0.00 0.00 57.88 57.33 2k1b h LEU 46 Cb 0.45 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2k1b h LEU 46 CO 0.00 1.38 0.04 1.62 0.09 0.00 0.00 178.44 181.57 2k1b h VAL 47 N 0.62 1.24 0.02 1.22 3.04 -1.21 -1.74 116.25 119.44 2k1b h VAL 47 Ca -0.02 -0.94 -0.21 0.00 -1.01 0.00 0.00 66.70 64.52 2k1b h VAL 47 Cb 1.27 0.81 -0.02 0.00 -2.01 0.00 0.00 31.29 31.34 2k1b h VAL 47 CO 0.14 0.34 -0.98 0.00 -1.01 0.00 0.00 177.57 176.06 2k1b h MET 48 N 0.76 0.08 0.00 4.17 -0.00 -1.63 -3.27 114.93 115.04 2k1b h MET 48 Ca 0.15 -0.12 -0.02 0.00 -0.00 0.00 0.00 59.70 59.71 2k1b h MET 48 Cb 0.40 0.04 -0.00 0.00 -0.00 0.00 0.00 31.60 32.04 2k1b h MET 48 CO 0.01 0.99 -0.12 0.00 -0.00 0.00 0.00 176.91 177.80 2k1b h ALA 49 N 0.96 1.23 -0.40 -3.00 0.00 -0.57 -0.58 119.26 116.90 2k1b h ALA 49 Ca -0.04 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 54.85 2k1b h ALA 49 Cb 1.69 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 19.38 2k1b h ALA 49 CO 0.14 0.15 -0.17 -0.92 0.00 0.00 0.00 179.25 178.45 2k1b h TYR 50 N 0.00 -0.40 0.00 0.00 3.20 -1.39 -1.03 116.97 117.35 2k1b h TYR 50 Ca -0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2k1b h TYR 50 Cb 0.37 0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.88 2k1b h TYR 50 CO 0.00 -0.25 -0.99 -0.85 -1.64 0.00 0.00 178.16 174.44 2k1b n GLU 51 N -5.36 0.14 0.07 1.82 0.28 -1.02 -4.29 120.64 112.29 2k1b n GLU 51 Ca 0.02 -0.02 -0.17 0.00 -0.16 0.00 0.00 57.16 56.83 2k1b n GLU 51 Cb 0.27 -1.53 -0.14 0.00 1.43 0.00 0.00 31.44 31.46 2k1b n GLU 51 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 2k1b h GLU 52 N 0.00 0.27 -7.28 3.44 4.57 -0.89 -3.47 114.58 111.23 2k1b h GLU 52 Ca 0.00 -0.46 -0.50 0.00 -1.18 0.00 0.00 59.36 57.22 2k1b h GLU 52 Cb 0.61 0.17 0.06 0.00 -0.16 0.00 0.00 28.75 29.43 2k1b h GLU 52 CO 0.00 1.15 0.33 0.15 -1.18 0.00 0.00 179.01 179.45 2k1b s LYS 53 N -2.62 3.28 -0.08 1.92 -0.14 -0.41 -5.03 119.74 116.67 2k1b s LYS 53 Ca -0.09 0.46 -0.27 0.00 -1.36 0.00 0.00 55.97 54.70 2k1b s LYS 53 Cb 0.07 -2.15 -0.23 0.00 -1.68 0.00 0.00 37.83 33.84 2k1b s LYS 53 CO 0.86 -0.65 1.04 1.49 -0.76 0.00 0.00 175.35 177.32 2k1b h GLU 54 N -0.29 -0.00 -0.00 1.68 4.57 -1.90 -3.48 114.58 115.15 2k1b h GLU 54 Ca -0.45 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 2k1b h GLU 54 Cb 1.22 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.81 2k1b h GLU 54 CO 0.62 0.72 0.00 0.39 -1.18 0.00 0.00 179.01 179.56