#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 0.00 -2.14 5.31 1.13 -1.26 -4.87 117.38 115.55 2k1b n GLN 2 Ca 0.00 0.00 -0.39 0.00 -1.94 0.00 0.00 57.00 54.67 2k1b n GLN 2 Cb 0.00 -3.51 0.00 0.00 0.11 0.00 0.00 30.24 26.84 2k1b n GLN 2 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 2k1b n VAL 3 N -2.00 5.18 -2.40 5.09 0.24 -1.26 -4.91 118.33 118.27 2k1b n VAL 3 Ca 0.00 -4.71 -0.37 0.00 -2.04 0.00 0.00 64.34 57.22 2k1b n VAL 3 Cb 0.00 -1.78 -0.03 0.00 -1.47 0.00 0.00 33.84 30.57 2k1b n VAL 3 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2k1b s PHE 4 N -2.51 2.39 0.47 6.34 0.08 -1.26 -4.90 117.98 118.59 2k1b s PHE 4 Ca 0.50 -0.63 0.02 0.00 0.12 0.00 0.00 56.93 56.94 2k1b s PHE 4 Cb 0.23 -4.49 -0.02 0.00 -0.57 0.00 0.00 43.02 38.17 2k1b s PHE 4 CO -0.15 -1.74 0.06 0.00 -0.10 0.00 0.00 175.22 173.29 2k1b s ALA 5 N 6.59 3.59 0.63 5.36 0.00 -1.26 -4.98 121.76 131.69 2k1b s ALA 5 Ca 0.56 -0.77 -0.16 0.00 0.00 0.00 0.00 51.96 51.60 2k1b s ALA 5 Cb 0.00 0.35 -0.02 0.00 0.00 0.00 0.00 23.12 23.46 2k1b s ALA 5 CO 0.01 -0.16 1.11 0.54 0.00 0.00 0.00 175.76 177.26 2k1b s VAL 6 N -3.02 3.25 0.10 0.00 0.11 -1.26 -4.91 120.40 114.67 2k1b s VAL 6 Ca 0.14 0.63 -0.31 0.00 -2.93 0.00 0.00 61.98 59.50 2k1b s VAL 6 Cb 0.02 -3.16 -0.12 0.00 -1.53 0.00 0.00 36.38 31.59 2k1b s VAL 6 CO 0.08 -0.32 1.60 -0.08 -3.33 0.00 0.00 175.10 173.06 2k1b h GLU 7 N 0.33 -0.69 -1.60 1.54 4.22 -1.86 -3.47 114.58 113.06 2k1b h GLU 7 Ca -0.48 0.05 0.07 0.00 0.08 0.00 0.00 59.36 59.08 2k1b h GLU 7 Cb 1.25 0.16 -0.23 0.00 0.50 0.00 0.00 28.75 30.42 2k1b h GLU 7 CO 0.55 -0.46 0.51 0.45 -2.18 0.00 0.00 179.01 177.88 2k1b s SER 8 N -4.63 -0.40 -0.31 1.04 0.15 -1.24 -5.06 113.70 103.26 2k1b s SER 8 Ca -0.17 0.48 -0.29 0.00 0.70 0.00 0.00 55.95 56.67 2k1b s SER 8 Cb 0.06 0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.76 2k1b s SER 8 CO 0.63 -0.34 1.26 -0.63 1.20 0.00 0.00 173.24 175.36 2k1b s ILE 9 N -0.97 4.21 0.00 6.45 1.01 -1.26 -1.24 121.20 129.40 2k1b s ILE 9 Ca -0.02 1.37 -0.02 0.00 0.00 0.00 0.00 60.65 61.98 2k1b s ILE 9 Cb -0.01 -4.21 -0.01 0.00 0.01 0.00 0.00 42.46 38.24 2k1b s ILE 9 CO 0.01 -0.48 0.75 -0.09 0.00 0.00 0.00 174.94 175.13 2k1b h ARG 10 N 9.05 -0.07 -3.16 2.79 1.12 -1.10 -3.45 114.38 119.57 2k1b h ARG 10 Ca -0.25 0.00 -0.12 0.00 -1.11 0.00 0.00 59.98 58.50 2k1b h ARG 10 Cb 1.09 0.02 -0.20 0.00 -0.01 0.00 0.00 29.97 30.87 2k1b h ARG 10 CO 1.03 -0.05 -0.32 -1.59 -3.11 0.00 0.00 179.97 175.94 2k1b s LYS 11 N -2.61 0.64 0.26 0.20 -2.85 -1.22 -5.01 119.74 109.15 2k1b s LYS 11 Ca -0.01 -0.26 0.10 0.00 -1.00 0.00 0.00 55.97 54.80 2k1b s LYS 11 Cb 0.00 0.28 -0.05 0.00 -2.06 0.00 0.00 37.83 36.00 2k1b s LYS 11 CO 0.03 -0.17 -0.17 -1.59 0.10 0.00 0.00 175.35 173.55 2k1b s LYS 12 N -1.42 1.58 -0.22 1.78 -2.85 -1.26 -0.66 119.74 116.68 2k1b s LYS 12 Ca -0.13 -1.73 -0.23 0.00 -1.00 0.00 0.00 55.97 52.88 2k1b s LYS 12 Cb -0.05 -1.55 0.06 0.00 -2.06 0.00 0.00 37.83 34.23 2k1b s LYS 12 CO 0.03 0.26 0.63 0.50 0.10 0.00 0.00 175.35 176.88 2k1b s ARG 13 N -3.56 0.77 -0.36 1.78 3.52 -0.81 -5.02 118.95 115.27 2k1b s ARG 13 Ca 0.28 0.81 -0.24 0.00 -0.13 0.00 0.00 55.73 56.44 2k1b s ARG 13 Cb -0.03 0.37 0.01 0.00 -1.56 0.00 0.00 34.95 33.74 2k1b s ARG 13 CO 0.13 -0.11 0.84 0.08 -0.81 0.00 0.00 175.30 175.42 2k1b s VAL 14 N 0.17 4.69 -0.04 7.11 1.01 -1.26 -1.47 120.40 130.61 2k1b s VAL 14 Ca -0.01 1.05 0.01 0.00 0.00 0.00 0.00 61.98 63.02 2k1b s VAL 14 Cb -0.04 -4.25 0.02 0.00 0.00 0.00 0.00 36.38 32.12 2k1b s VAL 14 CO 0.02 -0.44 -0.02 -0.60 0.00 0.00 0.00 175.10 174.05 2k1b s ARG 15 N 3.21 0.62 -1.24 2.72 3.00 -0.51 -4.79 118.95 121.97 2k1b s ARG 15 Ca 0.34 -0.02 0.00 0.00 -1.00 0.00 0.00 55.73 55.05 2k1b s ARG 15 Cb -0.13 -0.72 0.00 0.00 0.00 0.00 0.00 34.95 34.10 2k1b s ARG 15 CO 0.17 -0.12 0.00 0.36 0.00 0.00 0.00 175.30 175.71 2k1b n LYS 16 N 4.17 -1.87 -0.60 5.12 2.85 -1.26 -1.04 118.16 125.53 2k1b n LYS 16 Ca -0.24 0.70 0.00 0.00 -1.05 0.00 0.00 58.31 57.72 2k1b n LYS 16 Cb 0.51 -5.18 0.00 0.00 -0.65 0.00 0.00 35.03 29.70 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 -0.64 1.05 3.41 2.58 0.00 -1.26 -5.03 105.19 105.30 2k1b n GLY 17 Ca -0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.29 3.45 -0.46 1.61 2.47 -0.21 -5.07 119.74 121.24 2k1b s LYS 18 Ca 0.00 -0.62 -0.29 0.00 -1.56 0.00 0.00 55.97 53.50 2k1b s LYS 18 Cb 0.00 -3.37 0.03 0.00 -1.46 0.00 0.00 37.83 33.03 2k1b s LYS 18 CO 0.00 -0.29 1.19 0.08 0.16 0.00 0.00 175.35 176.49 2k1b s VAL 19 N 1.58 4.15 -0.06 4.02 1.01 -1.26 -1.42 120.40 128.41 2k1b s VAL 19 Ca 0.05 1.18 -0.04 0.00 0.00 0.00 0.00 61.98 63.17 2k1b s VAL 19 Cb -0.16 -4.52 -0.04 0.00 0.00 0.00 0.00 36.38 31.66 2k1b s VAL 19 CO 0.04 -0.94 0.14 -1.61 0.00 0.00 0.00 175.10 172.72 2k1b s GLU 20 N 4.53 3.36 -0.28 2.72 2.02 -0.54 -2.38 118.70 128.12 2k1b s GLU 20 Ca 0.51 -0.27 0.02 0.00 0.02 0.00 0.00 54.97 55.25 2k1b s GLU 20 Cb -0.09 -3.08 0.08 0.00 0.10 0.00 0.00 34.13 31.14 2k1b s GLU 20 CO 0.31 0.72 -0.02 0.71 0.02 0.00 0.00 175.26 177.00 2k1b s TYR 21 N -1.15 3.06 -0.37 1.61 1.51 -0.18 -1.92 117.35 119.91 2k1b s TYR 21 Ca 0.20 -2.35 -0.27 0.00 -1.01 0.00 0.00 57.07 53.65 2k1b s TYR 21 Cb -0.12 -2.14 -0.05 0.00 -0.11 0.00 0.00 41.96 39.53 2k1b s TYR 21 CO 0.11 -0.87 2.26 -1.17 -1.11 0.00 0.00 175.55 174.76 2k1b s LEU 22 N 1.16 3.42 -0.30 -1.29 2.96 0.16 -0.72 118.68 124.07 2k1b s LEU 22 Ca 0.00 1.42 -0.18 0.00 -0.22 0.00 0.00 54.13 55.15 2k1b s LEU 22 Cb -0.19 -3.02 -0.02 0.00 0.50 0.00 0.00 46.19 43.46 2k1b s LEU 22 CO -0.08 -2.38 0.50 0.68 -1.32 0.00 0.00 176.35 173.75 2k1b s VAL 23 N 10.01 5.05 -0.59 1.68 -7.23 -0.61 -0.44 120.40 128.27 2k1b s VAL 23 Ca 0.96 0.62 -0.28 0.00 -1.81 0.00 0.00 61.98 61.48 2k1b s VAL 23 Cb -0.24 -3.88 0.02 0.00 0.56 0.00 0.00 36.38 32.84 2k1b s VAL 23 CO 0.30 -0.04 1.38 -0.75 -0.31 0.00 0.00 175.10 175.68 2k1b s LYS 24 N 2.33 3.28 0.57 4.82 2.36 -0.37 -3.39 119.74 129.35 2k1b s LYS 24 Ca 0.20 0.33 -0.20 0.00 -2.55 0.00 0.00 55.97 53.75 2k1b s LYS 24 Cb -0.15 -4.13 -0.04 0.00 -1.05 0.00 0.00 37.83 32.45 2k1b s LYS 24 CO 0.11 -1.97 1.21 -1.58 1.55 0.00 0.00 175.35 174.67 2k1b s TRP 25 N 6.00 2.44 -0.29 4.03 0.52 -1.26 -3.23 118.94 127.15 2k1b s TRP 25 Ca 0.49 1.50 -0.29 0.00 0.02 0.00 0.00 56.10 57.83 2k1b s TRP 25 Cb -0.10 -3.49 -0.02 0.00 -1.15 0.00 0.00 33.47 28.71 2k1b s TRP 25 CO 0.23 -2.18 1.73 0.15 0.02 0.00 0.00 176.95 176.90 2k1b s LYS 26 N -3.22 3.50 0.00 4.98 1.02 -1.26 -2.26 119.74 122.50 2k1b s LYS 26 Ca 0.75 1.50 0.00 0.00 0.02 0.00 0.00 55.97 58.24 2k1b s LYS 26 Cb -0.31 -4.14 0.00 0.00 -0.52 0.00 0.00 37.83 32.86 2k1b s LYS 26 CO 0.34 -1.66 0.00 0.41 -0.92 0.00 0.00 175.35 173.52 2k1b n GLY 27 N 5.18 2.97 3.70 -3.33 0.00 -1.26 -5.03 105.19 107.42 2k1b n GLY 27 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.19 3.49 0.90 1.61 0.52 -0.96 -5.08 118.94 117.24 2k1b s TRP 28 Ca 0.00 0.98 -0.10 0.00 0.02 0.00 0.00 56.10 57.00 2k1b s TRP 28 Cb 0.00 -2.68 0.14 0.00 -1.15 0.00 0.00 33.47 29.78 2k1b s TRP 28 CO 0.00 0.06 1.13 -1.25 0.02 0.00 0.00 176.95 176.91 2k1b s PRO 29 N 0.99 1.13 0.19 4.98 0.04 -1.26 -4.13 135.00 136.93 2k1b s PRO 29 Ca 0.29 1.44 0.06 0.00 0.04 0.00 0.00 61.00 62.84 2k1b s PRO 29 Cb -0.16 -1.75 0.35 0.00 0.04 0.00 0.00 34.50 32.98 2k1b s PRO 29 CO 0.12 -2.52 1.02 -2.30 0.04 0.00 0.00 177.00 173.37 2k1b n PRO 30 N -4.15 0.05 -0.01 0.56 -0.02 -1.26 -1.33 135.00 128.84 2k1b n PRO 30 Ca 0.11 0.43 -0.15 0.00 -2.02 0.00 0.00 63.50 61.86 2k1b n PRO 30 Cb 0.52 -1.96 -0.04 0.00 -0.02 0.00 0.00 33.50 32.00 2k1b n PRO 30 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2k1b h LYS 31 N 0.00 0.70 0.00 -0.52 2.10 -2.00 -3.22 116.57 113.64 2k1b h LYS 31 Ca 0.00 -0.57 0.00 0.00 -2.00 0.00 0.00 60.65 58.08 2k1b h LYS 31 Cb 0.62 0.12 0.00 0.00 -0.90 0.00 0.00 32.23 32.07 2k1b h LYS 31 CO 0.00 1.18 -0.09 0.66 -2.00 0.00 0.00 179.45 179.20 2k1b n TYR 32 N -3.92 0.56 -1.91 0.07 4.01 -0.44 -4.89 117.16 110.64 2k1b n TYR 32 Ca -0.06 0.16 -0.41 0.00 -0.16 0.00 0.00 57.90 57.43 2k1b n TYR 32 Cb 0.73 -0.74 -0.01 0.00 -0.31 0.00 0.00 39.34 39.01 2k1b n TYR 32 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2k1b s SER 33 N -3.94 6.50 0.08 7.72 0.01 -1.22 -4.90 113.70 117.94 2k1b s SER 33 Ca 0.11 2.88 0.10 0.00 1.31 0.00 0.00 55.95 60.35 2k1b s SER 33 Cb 0.15 -2.65 -0.03 0.00 0.21 0.00 0.00 66.02 63.70 2k1b s SER 33 CO 0.59 -0.77 -0.26 0.42 0.41 0.00 0.00 173.24 173.63 2k1b s THR 34 N -0.73 2.16 -0.65 1.44 -4.23 -1.22 -4.91 115.64 107.50 2k1b s THR 34 Ca 0.55 -1.52 -0.27 0.00 -1.18 0.00 0.00 61.69 59.27 2k1b s THR 34 Cb -0.44 -1.88 0.01 0.00 1.34 0.00 0.00 72.50 71.53 2k1b s THR 34 CO 0.55 0.26 1.51 0.26 -0.54 0.00 0.00 174.62 176.65 2k1b s TRP 35 N -0.90 2.07 -0.28 3.99 0.52 -1.26 -1.58 118.94 121.51 2k1b s TRP 35 Ca 0.12 0.35 -0.12 0.00 0.02 0.00 0.00 56.10 56.47 2k1b s TRP 35 Cb -0.10 -4.39 -0.05 0.00 -1.15 0.00 0.00 33.47 27.78 2k1b s TRP 35 CO 0.03 -2.14 0.25 -1.21 0.02 0.00 0.00 176.95 173.90 2k1b s GLU 36 N 6.12 3.96 0.62 4.98 0.41 0.10 -4.75 118.70 130.15 2k1b s GLU 36 Ca 0.50 -0.21 -0.10 0.00 -0.41 0.00 0.00 54.97 54.75 2k1b s GLU 36 Cb -0.10 -3.66 0.16 0.00 -1.78 0.00 0.00 34.13 28.74 2k1b s GLU 36 CO 0.19 -0.22 0.44 -0.35 -0.49 0.00 0.00 175.26 174.84 2k1b n PRO 37 N 5.15 -2.68 0.07 0.39 -0.04 -1.26 -1.01 135.00 135.61 2k1b n PRO 37 Ca -0.12 -0.73 0.14 0.00 -0.04 0.00 0.00 63.50 62.75 2k1b n PRO 37 Cb 0.52 -0.81 0.62 0.00 -0.04 0.00 0.00 33.50 33.79 2k1b n PRO 37 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2k1b h GLU 38 N 0.00 0.11 -0.00 0.54 5.08 -1.86 -1.09 114.58 117.35 2k1b h GLU 38 Ca -0.18 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 2k1b h GLU 38 Cb 0.59 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2k1b h GLU 38 CO 0.11 0.07 -0.21 -0.85 -1.00 0.00 0.00 179.01 177.14 2k1b n GLU 39 N -4.46 0.17 -0.59 2.33 0.28 -1.26 -3.60 120.64 113.51 2k1b n GLU 39 Ca 0.05 -0.06 0.02 0.00 -0.16 0.00 0.00 57.16 57.01 2k1b n GLU 39 Cb 0.36 -1.50 0.21 0.00 1.43 0.00 0.00 31.44 31.94 2k1b n GLU 39 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2k1b n HIS 40 N -1.36 0.87 -3.39 -1.84 8.25 -0.42 -4.98 115.22 112.35 2k1b n HIS 40 Ca 0.08 -1.29 -0.38 0.00 -0.26 0.00 0.00 57.72 55.87 2k1b n HIS 40 Cb 0.32 -0.38 -0.06 0.00 1.12 0.00 0.00 29.99 30.99 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 -3.07 4.98 -0.24 1.59 1.01 -1.20 -4.76 121.20 119.51 2k1b s ILE 41 Ca 0.42 0.98 0.18 0.00 0.00 0.00 0.00 60.65 62.23 2k1b s ILE 41 Cb 0.37 -3.79 0.13 0.00 0.01 0.00 0.00 42.46 39.18 2k1b s ILE 41 CO 0.03 0.52 1.45 -0.07 0.00 0.00 0.00 174.94 176.86 2k1b h LEU 42 N 5.11 0.00 -7.00 2.97 -0.00 -1.93 -3.47 115.31 110.98 2k1b h LEU 42 Ca -0.49 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.40 2k1b h LEU 42 Cb 1.21 0.00 -0.23 0.00 -0.00 0.00 0.00 40.66 41.64 2k1b h LEU 42 CO 0.65 0.34 0.31 -0.62 -0.00 0.00 0.00 178.44 179.12 2k1b s ASP 43 N -6.31 -0.58 0.33 -0.43 -1.08 -1.26 -5.01 116.67 102.34 2k1b s ASP 43 Ca 0.04 1.01 0.11 0.00 -0.52 0.00 0.00 52.55 53.19 2k1b s ASP 43 Cb 0.07 0.98 1.02 0.00 -1.46 0.00 0.00 42.92 43.53 2k1b s ASP 43 CO 0.73 -0.27 1.61 -0.65 0.52 0.00 0.00 175.17 177.11 2k1b h PRO 44 N 4.13 0.12 0.00 4.34 0.10 -2.01 -2.54 132.00 136.14 2k1b h PRO 44 Ca -0.27 -0.01 -0.01 0.00 0.10 0.00 0.00 66.00 65.81 2k1b h PRO 44 Cb 1.16 -0.03 -0.00 0.00 0.10 0.00 0.00 31.00 32.23 2k1b h PRO 44 CO 0.15 0.08 -0.04 0.07 0.10 0.00 0.00 178.00 178.36 2k1b h ARG 45 N 0.13 0.00 -0.01 1.05 0.11 -2.00 -2.85 114.38 110.81 2k1b h ARG 45 Ca 0.70 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 60.64 2k1b h ARG 45 Cb 1.64 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.74 2k1b h ARG 45 CO -0.74 0.04 -0.57 -0.07 0.10 0.00 0.00 179.97 178.73 2k1b h LEU 46 N 0.00 0.52 -0.79 0.08 3.38 -1.88 -2.43 115.31 114.19 2k1b h LEU 46 Ca -0.00 -0.75 -0.13 0.00 0.09 0.00 0.00 57.88 57.09 2k1b h LEU 46 Cb 0.38 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2k1b h LEU 46 CO 0.01 1.20 -0.49 1.62 0.09 0.00 0.00 178.44 180.86 2k1b h VAL 47 N -0.12 1.34 -0.07 1.22 3.04 -1.61 -2.38 116.25 117.68 2k1b h VAL 47 Ca -0.07 -1.71 -0.22 0.00 -1.01 0.00 0.00 66.70 63.69 2k1b h VAL 47 Cb 1.28 1.80 0.01 0.00 -2.01 0.00 0.00 31.29 32.37 2k1b h VAL 47 CO 0.11 0.51 -0.85 0.00 -1.01 0.00 0.00 177.57 176.34 2k1b h MET 48 N 0.22 0.57 0.00 4.17 -0.00 -1.63 -3.16 114.93 115.10 2k1b h MET 48 Ca 0.01 -0.52 -0.01 0.00 -0.00 0.00 0.00 59.70 59.18 2k1b h MET 48 Cb 0.95 0.13 -0.00 0.00 -0.00 0.00 0.00 31.60 32.67 2k1b h MET 48 CO 0.08 1.15 -0.05 0.00 -0.00 0.00 0.00 176.91 178.09 2k1b h ALA 49 N 0.69 1.12 0.50 -3.00 0.00 -1.19 0.90 119.26 118.29 2k1b h ALA 49 Ca -0.07 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2k1b h ALA 49 Cb 1.47 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 2k1b h ALA 49 CO 0.16 0.06 -0.39 -0.92 0.00 0.00 0.00 179.25 178.16 2k1b h TYR 50 N 0.00 -1.06 -0.00 0.00 3.20 -1.40 -1.86 116.97 115.85 2k1b h TYR 50 Ca -0.00 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2k1b h TYR 50 Cb 0.27 0.40 0.00 0.00 1.54 0.00 0.00 36.73 38.94 2k1b h TYR 50 CO 0.00 -0.55 -0.14 -0.85 -1.64 0.00 0.00 178.16 174.98 2k1b n GLU 51 N -4.81 0.76 0.03 1.82 0.28 -1.03 -3.64 120.64 114.05 2k1b n GLU 51 Ca -0.10 -0.32 -0.22 0.00 -0.16 0.00 0.00 57.16 56.36 2k1b n GLU 51 Cb 0.38 -1.49 -0.14 0.00 1.43 0.00 0.00 31.44 31.61 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 0.78 0.29 -6.76 3.44 4.57 -0.83 -3.47 114.58 112.60 2k1b h GLU 52 Ca 0.00 -0.50 -0.50 0.00 -1.18 0.00 0.00 59.36 57.18 2k1b h GLU 52 Cb 0.39 0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.16 2k1b h GLU 52 CO 0.00 1.24 0.07 0.15 -1.18 0.00 0.00 179.01 179.28 2k1b s LYS 53 N -2.50 3.79 0.20 1.92 -0.14 -0.70 -5.01 119.74 117.30 2k1b s LYS 53 Ca -0.18 0.43 0.01 0.00 -1.36 0.00 0.00 55.97 54.87 2k1b s LYS 53 Cb 0.04 -2.45 0.11 0.00 -1.68 0.00 0.00 37.83 33.86 2k1b s LYS 53 CO 0.80 0.05 1.47 1.49 -0.76 0.00 0.00 175.35 178.39 2k1b h GLU 54 N 1.54 0.30 0.00 1.68 4.81 -1.89 -3.47 114.58 117.56 2k1b h GLU 54 Ca -0.47 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 58.51 2k1b h GLU 54 Cb 1.18 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.62 2k1b h GLU 54 CO 0.65 0.89 0.00 -1.91 -0.73 0.00 0.00 179.01 177.91