#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 -0.32 -3.02 5.31 6.02 -1.26 -4.93 117.38 119.18 2k1b n GLN 2 Ca 0.00 0.08 -0.44 0.00 -0.01 0.00 0.00 57.00 56.63 2k1b n GLN 2 Cb 0.00 -4.10 -0.03 0.00 1.02 0.00 0.00 30.24 27.13 2k1b n GLN 2 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2k1b s VAL 3 N -1.65 4.80 -0.80 5.09 1.01 -1.26 -4.99 120.40 122.60 2k1b s VAL 3 Ca 0.00 -1.32 -0.21 0.00 0.00 0.00 0.00 61.98 60.45 2k1b s VAL 3 Cb 0.00 -4.64 0.09 0.00 0.00 0.00 0.00 36.38 31.83 2k1b s VAL 3 CO 0.00 -1.33 1.08 -0.36 0.00 0.00 0.00 175.10 174.49 2k1b s PHE 4 N 2.60 2.83 0.39 5.22 0.08 -1.26 -4.97 117.98 122.86 2k1b s PHE 4 Ca 0.23 -0.90 0.06 0.00 0.12 0.00 0.00 56.93 56.43 2k1b s PHE 4 Cb -0.13 -4.34 -0.02 0.00 -0.57 0.00 0.00 43.02 37.96 2k1b s PHE 4 CO -0.02 -1.62 0.21 0.00 -0.10 0.00 0.00 175.22 173.69 2k1b s ALA 5 N 3.64 2.55 0.62 5.36 0.00 -1.26 -5.11 121.76 127.56 2k1b s ALA 5 Ca 0.29 -1.54 -0.19 0.00 0.00 0.00 0.00 51.96 50.52 2k1b s ALA 5 Cb -0.10 1.08 -0.02 0.00 0.00 0.00 0.00 23.12 24.07 2k1b s ALA 5 CO 0.00 -0.49 1.28 0.54 0.00 0.00 0.00 175.76 177.10 2k1b s VAL 6 N -3.27 2.20 0.08 0.00 0.11 -1.26 -4.91 120.40 113.35 2k1b s VAL 6 Ca 0.30 0.13 -0.26 0.00 -2.93 0.00 0.00 61.98 59.22 2k1b s VAL 6 Cb 0.02 -3.05 -0.16 0.00 -1.53 0.00 0.00 36.38 31.65 2k1b s VAL 6 CO 0.21 -0.02 1.68 -0.08 -3.33 0.00 0.00 175.10 173.56 2k1b h GLU 7 N 0.79 -0.26 -1.68 1.54 4.57 -1.83 -3.46 114.58 114.24 2k1b h GLU 7 Ca -0.51 0.02 0.04 0.00 -1.18 0.00 0.00 59.36 57.73 2k1b h GLU 7 Cb 1.32 0.06 -0.24 0.00 -0.16 0.00 0.00 28.75 29.73 2k1b h GLU 7 CO 0.54 -0.15 0.40 -1.54 -1.18 0.00 0.00 179.01 177.08 2k1b s SER 8 N -4.98 -0.50 -0.37 1.04 1.04 -1.24 -5.06 113.70 103.64 2k1b s SER 8 Ca -0.14 0.87 -0.29 0.00 0.48 0.00 0.00 55.95 56.87 2k1b s SER 8 Cb 0.05 0.85 0.02 0.00 0.10 0.00 0.00 66.02 67.04 2k1b s SER 8 CO 0.65 -0.23 1.13 -0.63 0.98 0.00 0.00 173.24 175.14 2k1b s ILE 9 N -0.07 4.35 -0.00 -1.02 1.01 -1.26 -1.62 121.20 122.59 2k1b s ILE 9 Ca 0.01 1.50 -0.01 0.00 0.00 0.00 0.00 60.65 62.14 2k1b s ILE 9 Cb -0.04 -4.44 -0.01 0.00 0.01 0.00 0.00 42.46 37.98 2k1b s ILE 9 CO -0.03 -0.66 0.62 -0.09 0.00 0.00 0.00 174.94 174.79 2k1b h ARG 10 N 8.68 -0.05 -4.64 2.79 1.12 -1.31 -3.38 114.38 117.59 2k1b h ARG 10 Ca -0.22 0.00 -0.24 0.00 -1.11 0.00 0.00 59.98 58.41 2k1b h ARG 10 Cb 1.07 0.01 -0.15 0.00 -0.01 0.00 0.00 29.97 30.89 2k1b h ARG 10 CO 1.07 -0.03 -0.66 -1.59 -3.11 0.00 0.00 179.97 175.64 2k1b s LYS 11 N -2.33 1.02 0.15 0.20 -2.85 -1.24 -4.89 119.74 109.79 2k1b s LYS 11 Ca -0.01 -1.48 0.06 0.00 -1.00 0.00 0.00 55.97 53.54 2k1b s LYS 11 Cb 0.00 -0.06 -0.04 0.00 -2.06 0.00 0.00 37.83 35.67 2k1b s LYS 11 CO 0.02 -0.17 -0.13 -1.59 0.10 0.00 0.00 175.35 173.58 2k1b s LYS 12 N -3.96 1.10 -0.21 1.78 -2.85 -1.26 -0.69 119.74 113.66 2k1b s LYS 12 Ca 0.23 -1.39 -0.09 0.00 -1.00 0.00 0.00 55.97 53.72 2k1b s LYS 12 Cb 0.07 -0.85 0.09 0.00 -2.06 0.00 0.00 37.83 35.07 2k1b s LYS 12 CO 0.02 0.14 0.46 0.50 0.10 0.00 0.00 175.35 176.58 2k1b s ARG 13 N -3.28 0.40 -0.35 1.78 3.52 -0.40 -4.99 118.95 115.64 2k1b s ARG 13 Ca 0.15 1.03 -0.25 0.00 -0.13 0.00 0.00 55.73 56.53 2k1b s ARG 13 Cb -0.01 0.28 0.01 0.00 -1.56 0.00 0.00 34.95 33.67 2k1b s ARG 13 CO 0.03 -0.21 0.87 0.08 -0.81 0.00 0.00 175.30 175.26 2k1b s VAL 14 N 2.25 4.66 0.02 7.11 1.01 -1.26 -0.99 120.40 133.19 2k1b s VAL 14 Ca -0.05 1.15 -0.03 0.00 0.00 0.00 0.00 61.98 63.05 2k1b s VAL 14 Cb -0.10 -4.27 -0.01 0.00 0.00 0.00 0.00 36.38 31.99 2k1b s VAL 14 CO -0.14 -0.45 0.04 -0.60 0.00 0.00 0.00 175.10 173.96 2k1b s ARG 15 N 3.28 0.43 -2.07 2.72 3.52 -0.07 -4.91 118.95 121.86 2k1b s ARG 15 Ca 0.36 -0.62 0.00 0.00 -0.13 0.00 0.00 55.73 55.34 2k1b s ARG 15 Cb -0.13 0.16 0.00 0.00 -1.56 0.00 0.00 34.95 33.43 2k1b s ARG 15 CO 0.17 -0.09 0.00 0.36 -0.81 0.00 0.00 175.30 174.93 2k1b n LYS 16 N 1.30 -1.54 -0.98 5.12 2.85 -1.26 -1.10 118.16 122.55 2k1b n LYS 16 Ca -0.22 1.16 0.00 0.00 -1.05 0.00 0.00 58.31 58.20 2k1b n LYS 16 Cb 0.56 -5.65 0.00 0.00 -0.65 0.00 0.00 35.03 29.29 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 -0.63 0.86 3.45 2.58 0.00 -1.26 -5.03 105.19 105.17 2k1b n GLY 17 Ca -0.23 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.02 1.63 -0.21 1.61 2.47 -0.25 -5.13 119.74 119.83 2k1b s LYS 18 Ca 0.00 -1.75 -0.13 0.00 -1.56 0.00 0.00 55.97 52.53 2k1b s LYS 18 Cb 0.00 -1.65 -0.05 0.00 -1.46 0.00 0.00 37.83 34.67 2k1b s LYS 18 CO 0.00 0.29 0.27 0.08 0.16 0.00 0.00 175.35 176.15 2k1b s VAL 19 N -2.60 5.29 0.02 4.02 1.01 -1.26 -0.89 120.40 126.00 2k1b s VAL 19 Ca 0.29 0.44 -0.05 0.00 0.00 0.00 0.00 61.98 62.66 2k1b s VAL 19 Cb -0.04 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 2k1b s VAL 19 CO 0.14 0.32 0.26 -1.61 0.00 0.00 0.00 175.10 174.20 2k1b s GLU 20 N 1.03 3.55 -0.21 2.72 0.41 -0.17 -0.34 118.70 125.69 2k1b s GLU 20 Ca 0.13 -0.15 -0.02 0.00 -0.41 0.00 0.00 54.97 54.53 2k1b s GLU 20 Cb -0.14 -3.06 0.06 0.00 -1.78 0.00 0.00 34.13 29.21 2k1b s GLU 20 CO 0.05 0.64 0.01 0.71 -0.49 0.00 0.00 175.26 176.17 2k1b s TYR 21 N -1.35 1.53 -0.41 1.61 1.51 0.63 -1.27 117.35 119.59 2k1b s TYR 21 Ca 0.29 -1.20 -0.28 0.00 -1.01 0.00 0.00 57.07 54.88 2k1b s TYR 21 Cb -0.13 -1.24 -0.02 0.00 -0.11 0.00 0.00 41.96 40.46 2k1b s TYR 21 CO 0.18 -0.67 1.83 -1.17 -1.11 0.00 0.00 175.55 174.60 2k1b s LEU 22 N 1.69 3.45 -0.29 -1.29 2.96 0.14 -1.34 118.68 123.99 2k1b s LEU 22 Ca -0.02 1.03 -0.09 0.00 -0.22 0.00 0.00 54.13 54.83 2k1b s LEU 22 Cb -0.18 -3.21 -0.01 0.00 0.50 0.00 0.00 46.19 43.29 2k1b s LEU 22 CO -0.08 -1.92 0.12 0.68 -1.32 0.00 0.00 176.35 173.83 2k1b s VAL 23 N 7.63 4.41 -0.11 1.68 -7.23 -0.09 -0.84 120.40 125.84 2k1b s VAL 23 Ca 0.77 -0.43 -0.29 0.00 -1.81 0.00 0.00 61.98 60.22 2k1b s VAL 23 Cb -0.19 -3.21 -0.01 0.00 0.56 0.00 0.00 36.38 33.52 2k1b s VAL 23 CO 0.30 0.13 1.00 -0.75 -0.31 0.00 0.00 175.10 175.46 2k1b s LYS 24 N 1.59 4.41 0.22 4.82 2.36 -0.64 -3.48 119.74 129.02 2k1b s LYS 24 Ca 0.05 1.36 -0.20 0.00 -2.55 0.00 0.00 55.97 54.63 2k1b s LYS 24 Cb -0.17 -3.55 -0.08 0.00 -1.05 0.00 0.00 37.83 32.98 2k1b s LYS 24 CO 0.05 -0.32 0.72 -1.58 1.55 0.00 0.00 175.35 175.77 2k1b s TRP 25 N 2.05 3.65 -0.40 4.03 0.52 -1.26 -2.59 118.94 124.95 2k1b s TRP 25 Ca 0.47 1.39 -0.27 0.00 0.02 0.00 0.00 56.10 57.71 2k1b s TRP 25 Cb -0.18 -2.62 -0.03 0.00 -1.15 0.00 0.00 33.47 29.49 2k1b s TRP 25 CO 0.17 0.34 2.00 0.15 0.02 0.00 0.00 176.95 179.64 2k1b s LYS 26 N -1.95 2.92 0.00 4.98 1.02 -1.26 -1.98 119.74 123.47 2k1b s LYS 26 Ca 0.43 1.37 0.00 0.00 0.02 0.00 0.00 55.97 57.79 2k1b s LYS 26 Cb -0.17 -4.34 0.00 0.00 -0.52 0.00 0.00 37.83 32.80 2k1b s LYS 26 CO 0.21 -2.35 0.00 0.41 -0.92 0.00 0.00 175.35 172.70 2k1b n GLY 27 N 5.65 0.83 3.63 -3.33 0.00 -1.26 -5.06 105.19 105.66 2k1b n GLY 27 Ca 0.26 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.22 3.26 0.82 1.61 0.52 -0.84 -5.10 118.94 116.99 2k1b s TRP 28 Ca 0.00 0.08 -0.13 0.00 0.02 0.00 0.00 56.10 56.07 2k1b s TRP 28 Cb 0.00 -2.12 0.07 0.00 -1.15 0.00 0.00 33.47 30.27 2k1b s TRP 28 CO 0.00 0.12 1.04 -0.35 0.02 0.00 0.00 176.95 177.78 2k1b n PRO 29 N 3.72 0.10 0.00 4.98 -0.04 -1.26 -4.32 135.00 138.17 2k1b n PRO 29 Ca -0.16 0.10 0.03 0.00 -0.04 0.00 0.00 63.50 63.43 2k1b n PRO 29 Cb 0.52 -2.30 0.15 0.00 -0.04 0.00 0.00 33.50 31.83 2k1b n PRO 29 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2k1b n PRO 30 N -2.88 0.13 0.22 0.54 -0.04 -1.26 -1.30 135.00 130.42 2k1b n PRO 30 Ca 0.12 0.09 0.07 0.00 -0.04 0.00 0.00 63.50 63.74 2k1b n PRO 30 Cb 0.51 -1.50 0.51 0.00 -0.04 0.00 0.00 33.50 32.97 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 0.00 0.00 0.54 2.10 -2.02 -2.94 116.57 114.25 2k1b h LYS 31 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2k1b h LYS 31 Cb 0.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.35 2k1b h LYS 31 CO 0.00 0.25 -0.56 1.88 -2.00 0.00 0.00 179.45 179.01 2k1b h TYR 32 N 0.00 0.00 -2.23 0.07 0.05 -1.52 -3.46 116.97 109.88 2k1b h TYR 32 Ca -0.00 0.00 -0.58 0.00 0.05 0.00 0.00 58.73 58.19 2k1b h TYR 32 Cb 0.50 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.23 2k1b h TYR 32 CO 0.00 0.00 1.42 -1.54 -1.05 0.00 0.00 178.16 176.99 2k1b s SER 33 N -4.97 5.60 0.62 3.88 1.04 -1.11 -4.90 113.70 113.85 2k1b s SER 33 Ca 0.05 1.68 0.04 0.00 0.48 0.00 0.00 55.95 58.19 2k1b s SER 33 Cb 0.11 -2.52 0.09 0.00 0.10 0.00 0.00 66.02 63.80 2k1b s SER 33 CO 0.72 -1.88 0.85 0.42 0.98 0.00 0.00 173.24 174.33 2k1b s THR 34 N 7.85 2.30 -0.30 2.02 -4.23 -1.23 -4.79 115.64 117.26 2k1b s THR 34 Ca 0.93 -0.78 -0.09 0.00 -1.18 0.00 0.00 61.69 60.57 2k1b s THR 34 Cb -0.29 -2.52 -0.01 0.00 1.34 0.00 0.00 72.50 71.02 2k1b s THR 34 CO 0.34 0.00 0.14 0.26 -0.54 0.00 0.00 174.62 174.83 2k1b s TRP 35 N -2.85 3.17 0.02 3.99 0.52 -1.26 -0.91 118.94 121.62 2k1b s TRP 35 Ca 0.62 -0.56 -0.18 0.00 0.02 0.00 0.00 56.10 56.00 2k1b s TRP 35 Cb -0.07 -2.34 -0.06 0.00 -1.15 0.00 0.00 33.47 29.86 2k1b s TRP 35 CO 0.41 -0.44 0.53 -1.83 0.02 0.00 0.00 176.95 175.63 2k1b s GLU 36 N 1.61 4.17 1.00 4.98 -1.05 -0.45 -4.82 118.70 124.14 2k1b s GLU 36 Ca 0.05 0.63 -0.14 0.00 -0.15 0.00 0.00 54.97 55.35 2k1b s GLU 36 Cb -0.17 -3.28 0.19 0.00 -0.44 0.00 0.00 34.13 30.44 2k1b s GLU 36 CO 0.06 0.55 1.14 -1.25 0.95 0.00 0.00 175.26 176.71 2k1b s PRO 37 N -0.73 0.39 0.56 -4.83 0.04 -1.26 -0.27 135.00 128.90 2k1b s PRO 37 Ca 0.28 0.18 0.31 0.00 0.04 0.00 0.00 61.00 61.80 2k1b s PRO 37 Cb -0.18 -1.76 1.69 0.00 0.04 0.00 0.00 34.50 34.29 2k1b s PRO 37 CO 0.16 -2.68 2.16 1.49 0.04 0.00 0.00 177.00 178.17 2k1b h GLU 38 N -1.85 0.00 0.00 4.56 4.22 -1.05 -1.47 114.58 118.99 2k1b h GLU 38 Ca -0.50 0.00 0.00 0.00 0.08 0.00 0.00 59.36 58.94 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 0.52 0.06 0.00 -0.85 -2.18 0.00 0.00 179.01 176.57 2k1b n GLU 39 N -3.58 0.63 -0.03 1.92 0.28 -1.26 -3.48 120.64 115.12 2k1b n GLU 39 Ca -0.02 0.01 0.01 0.00 -0.16 0.00 0.00 57.16 57.00 2k1b n GLU 39 Cb 0.18 -1.50 0.02 0.00 1.43 0.00 0.00 31.44 31.57 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 -1.15 0.07 -2.21 -1.84 8.25 -0.55 -5.03 115.22 112.76 2k1b n HIS 40 Ca 0.17 -0.49 -0.42 0.00 -0.26 0.00 0.00 57.72 56.72 2k1b n HIS 40 Cb 0.16 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 31.20 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 -0.98 3.77 0.01 1.59 1.01 -1.23 -4.92 121.20 120.44 2k1b s ILE 41 Ca 0.04 1.08 0.17 0.00 0.00 0.00 0.00 60.65 61.93 2k1b s ILE 41 Cb 0.02 -3.69 0.09 0.00 0.01 0.00 0.00 42.46 38.89 2k1b s ILE 41 CO 0.02 -0.04 1.59 -0.07 0.00 0.00 0.00 174.94 176.44 2k1b h LEU 42 N 8.96 0.00 -7.00 2.97 -0.00 -1.96 -3.46 115.31 114.82 2k1b h LEU 42 Ca -0.36 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 57.47 2k1b h LEU 42 Cb 1.17 0.00 -0.20 0.00 -0.00 0.00 0.00 40.66 41.63 2k1b h LEU 42 CO 0.92 0.45 0.16 -0.62 -0.00 0.00 0.00 178.44 179.36 2k1b s ASP 43 N -6.44 -0.70 0.34 -0.43 -1.08 -1.26 -5.05 116.67 102.05 2k1b s ASP 43 Ca 0.02 1.06 0.13 0.00 -0.52 0.00 0.00 52.55 53.24 2k1b s ASP 43 Cb 0.09 0.97 1.08 0.00 -1.46 0.00 0.00 42.92 43.61 2k1b s ASP 43 CO 0.72 -0.44 1.59 -0.65 0.52 0.00 0.00 175.17 176.91 2k1b h PRO 44 N 3.93 0.06 0.00 4.34 0.10 -2.01 -1.46 132.00 136.95 2k1b h PRO 44 Ca -0.28 -0.00 -0.01 0.00 0.10 0.00 0.00 66.00 65.81 2k1b h PRO 44 Cb 1.15 -0.01 -0.00 0.00 0.10 0.00 0.00 31.00 32.24 2k1b h PRO 44 CO 0.23 0.04 -0.03 0.07 0.10 0.00 0.00 178.00 178.41 2k1b h ARG 45 N 0.06 0.00 0.07 1.05 0.11 -1.98 -2.06 114.38 111.64 2k1b h ARG 45 Ca 0.74 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 60.72 2k1b h ARG 45 Cb 1.78 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.87 2k1b h ARG 45 CO -0.79 0.03 -0.43 -0.07 0.10 0.00 0.00 179.97 178.81 2k1b h LEU 46 N 0.00 0.25 -0.69 0.08 3.38 -1.69 -2.56 115.31 114.09 2k1b h LEU 46 Ca -0.00 -0.97 -0.10 0.00 0.09 0.00 0.00 57.88 56.90 2k1b h LEU 46 Cb 0.19 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2k1b h LEU 46 CO 0.00 1.21 -0.04 1.62 0.09 0.00 0.00 178.44 181.32 2k1b h VAL 47 N -0.66 1.26 0.00 1.22 3.04 -1.48 -2.21 116.25 117.43 2k1b h VAL 47 Ca -0.08 -1.16 0.00 0.00 -1.01 0.00 0.00 66.70 64.45 2k1b h VAL 47 Cb 1.34 0.88 0.00 0.00 -2.01 0.00 0.00 31.29 31.50 2k1b h VAL 47 CO 0.08 0.41 0.00 0.00 -1.01 0.00 0.00 177.57 177.06 2k1b h MET 48 N 0.89 0.00 0.00 4.17 -0.00 -1.54 -3.10 114.93 115.35 2k1b h MET 48 Ca 0.15 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.85 2k1b h MET 48 Cb 0.58 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.18 2k1b h MET 48 CO 0.03 0.00 -0.04 0.00 -0.00 0.00 0.00 176.91 176.91 2k1b h ALA 49 N 2.29 1.06 0.17 -3.00 0.00 -0.95 0.25 119.26 119.08 2k1b h ALA 49 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2k1b h ALA 49 Cb 0.75 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2k1b h ALA 49 CO 0.00 0.05 -0.08 -0.92 0.00 0.00 0.00 179.25 178.29 2k1b h TYR 50 N 0.00 -0.21 0.00 0.00 3.20 -1.55 -1.04 116.97 117.36 2k1b h TYR 50 Ca -0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2k1b h TYR 50 Cb 0.33 0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.67 2k1b h TYR 50 CO 0.00 -0.12 -0.31 0.39 -1.64 0.00 0.00 178.16 176.48 2k1b n GLU 51 N -5.18 0.16 -0.11 1.82 1.02 -0.69 -4.00 120.64 113.66 2k1b n GLU 51 Ca -0.09 0.08 -0.23 0.00 -0.02 0.00 0.00 57.16 56.91 2k1b n GLU 51 Cb 0.12 -1.64 -0.11 0.00 -0.02 0.00 0.00 31.44 29.79 2k1b n GLU 51 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2k1b n GLU 52 N -1.90 0.57 -2.97 3.49 4.07 0.80 -4.97 120.64 119.73 2k1b n GLU 52 Ca 0.05 0.51 -0.35 0.00 -0.06 0.00 0.00 57.16 57.31 2k1b n GLU 52 Cb 0.40 -1.69 -0.06 0.00 -0.06 0.00 0.00 31.44 30.02 2k1b n GLU 52 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2k1b s LYS 53 N -2.39 4.25 0.00 5.31 -0.14 -0.40 -4.97 119.74 121.40 2k1b s LYS 53 Ca -0.30 0.97 0.22 0.00 -1.36 0.00 0.00 55.97 55.50 2k1b s LYS 53 Cb 0.08 -2.58 0.52 0.00 -1.68 0.00 0.00 37.83 34.17 2k1b s LYS 53 CO 0.56 0.21 1.44 -0.85 -0.76 0.00 0.00 175.35 175.95 2k1b n GLU 54 N 0.07 2.31 0.00 1.68 0.28 -1.26 -4.81 120.64 118.91 2k1b n GLU 54 Ca 0.02 -1.98 0.14 0.00 -0.16 0.00 0.00 57.16 55.18 2k1b n GLU 54 Cb 0.52 -1.48 0.45 0.00 1.43 0.00 0.00 31.44 32.36 2k1b n GLU 54 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36