#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j28 n LYS 2 N 0.00 1.03 -4.25 0.00 5.02 -1.25 -4.42 118.16 114.29 2j28 n LYS 2 Ca 0.00 -1.71 -0.17 0.00 -2.02 0.00 0.00 58.31 54.41 2j28 n LYS 2 Cb 0.00 0.73 -0.09 0.00 -0.02 0.00 0.00 35.03 35.66 2j28 n LYS 2 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2j28 s THR 3 N -2.12 0.00 0.32 -0.18 -1.32 -1.21 -0.78 115.64 110.35 2j28 s THR 3 Ca 0.06 -1.98 -0.29 0.00 -1.21 0.00 0.00 61.69 58.26 2j28 s THR 3 Cb 0.00 -2.50 -0.11 0.00 -1.51 0.00 0.00 72.50 68.38 2j28 s THR 3 CO 0.04 0.00 1.52 -0.51 -2.21 0.00 0.00 174.62 173.46 2j28 s ILE 4 N -3.66 2.17 -0.15 5.08 2.07 -1.21 -3.07 121.20 122.42 2j28 s ILE 4 Ca 0.40 0.15 -0.11 0.00 -1.41 0.00 0.00 60.65 59.69 2j28 s ILE 4 Cb 0.04 -3.10 0.04 0.00 0.13 0.00 0.00 42.46 39.57 2j28 s ILE 4 CO 0.22 0.03 0.21 0.29 -1.91 0.00 0.00 174.94 173.78 2j28 n LYS 5 N 1.51 -4.38 -3.20 3.50 5.02 -0.95 -4.95 118.16 114.71 2j28 n LYS 5 Ca 0.05 3.30 -0.23 0.00 -2.02 0.00 0.00 58.31 59.41 2j28 n LYS 5 Cb 0.39 -4.66 -0.07 0.00 -0.02 0.00 0.00 35.03 30.67 2j28 n LYS 5 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 2j28 n ILE 6 N 1.82 -0.80 -2.54 -0.18 -5.35 -1.00 -4.69 119.36 106.62 2j28 n ILE 6 Ca -0.36 -3.45 -0.41 0.00 -0.27 0.00 0.00 62.75 58.27 2j28 n ILE 6 Cb 0.55 -1.43 -0.04 0.00 -1.74 0.00 0.00 39.64 36.98 2j28 n ILE 6 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2j28 s THR 7 N -0.48 3.89 -0.18 7.28 -4.23 -1.18 -3.36 115.64 117.37 2j28 s THR 7 Ca 0.34 1.67 -0.20 0.00 -1.18 0.00 0.00 61.69 62.32 2j28 s THR 7 Cb 0.12 -4.07 -0.03 0.00 1.34 0.00 0.00 72.50 69.86 2j28 s THR 7 CO -0.15 0.31 0.59 -1.58 -0.54 0.00 0.00 174.62 173.25 2j28 s GLN 8 N -0.51 4.24 1.00 3.99 0.74 -0.93 -2.87 119.66 125.32 2j28 s GLN 8 Ca 0.48 0.57 -0.14 0.00 0.05 0.00 0.00 55.36 56.32 2j28 s GLN 8 Cb -0.29 -3.54 0.19 0.00 1.10 0.00 0.00 33.01 30.47 2j28 s GLN 8 CO 0.35 -0.14 1.14 0.95 -0.55 0.00 0.00 175.29 177.04 2j28 s THR 9 N 1.58 1.92 1.20 -0.34 -4.23 0.15 -4.33 115.64 111.60 2j28 s THR 9 Ca 0.28 0.00 -0.17 0.00 -1.18 0.00 0.00 61.69 60.62 2j28 s THR 9 Cb -0.16 -2.65 0.23 0.00 1.34 0.00 0.00 72.50 71.26 2j28 s THR 9 CO 0.11 0.00 0.56 0.54 -0.54 0.00 0.00 174.62 175.29 2j28 n ARG 10 N -4.09 -2.57 0.00 3.99 1.74 -1.26 -4.78 116.66 109.69 2j28 n ARG 10 Ca 0.08 -0.74 0.00 0.00 -0.77 0.00 0.00 57.85 56.42 2j28 n ARG 10 Cb 0.59 -1.90 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 2j28 n ARG 10 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2j28 n SER 11 N -3.62 0.00 0.00 0.55 2.88 -1.26 -4.81 113.62 107.36 2j28 n SER 11 Ca 0.03 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 2j28 n SER 11 Cb 0.56 0.59 0.00 0.00 -0.75 0.00 0.00 64.21 64.61 2j28 n SER 11 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2j28 n ALA 12 N -0.53 0.00 -2.45 -1.46 0.00 -1.26 -5.00 120.51 109.81 2j28 n ALA 12 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 2j28 n ALA 12 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 2j28 n ALA 12 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2j28 s ILE 13 N -1.93 4.96 0.00 0.00 -0.00 -1.26 -4.07 121.20 118.90 2j28 s ILE 13 Ca 0.00 0.66 0.00 0.00 -0.00 0.00 0.00 60.65 61.31 2j28 s ILE 13 Cb 0.00 -3.69 0.00 0.00 -0.00 0.00 0.00 42.46 38.77 2j28 s ILE 13 CO 0.00 0.25 0.00 0.61 -0.00 0.00 0.00 174.94 175.80 2j28 n GLY 14 N 0.81 3.12 3.53 6.27 0.00 -1.26 -5.06 105.19 112.60 2j28 n GLY 14 Ca -0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.68 2j28 n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2j28 s ARG 15 N -0.61 -0.66 0.56 1.61 1.81 -1.26 -4.98 118.95 115.42 2j28 s ARG 15 Ca 0.00 0.75 -0.17 0.00 -1.72 0.00 0.00 55.73 54.59 2j28 s ARG 15 Cb 0.00 -1.59 -0.05 0.00 -0.45 0.00 0.00 34.95 32.86 2j28 s ARG 15 CO 0.00 -3.53 1.05 -0.51 -0.68 0.00 0.00 175.30 171.64 2j28 s LEU 16 N -7.06 3.60 0.49 2.53 1.43 -1.26 -4.86 118.68 113.56 2j28 s LEU 16 Ca 0.68 1.86 0.26 0.00 -1.03 0.00 0.00 54.13 55.89 2j28 s LEU 16 Cb -0.23 -4.54 1.33 0.00 0.03 0.00 0.00 46.19 42.77 2j28 s LEU 16 CO 0.63 -1.05 1.90 -0.65 0.23 0.00 0.00 176.35 177.40 2j28 h PRO 17 N 0.78 0.14 -0.19 1.29 0.11 -2.01 -0.34 132.00 131.78 2j28 h PRO 17 Ca -0.48 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.48 2j28 h PRO 17 Cb 1.22 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2j28 h PRO 17 CO 0.58 0.09 -0.46 0.87 -0.21 0.00 0.00 178.00 178.87 2j28 h LYS 18 N 0.14 0.64 0.53 1.05 6.56 -1.99 -2.94 116.57 120.56 2j28 h LYS 18 Ca 0.41 -0.44 -0.02 0.00 -1.06 0.00 0.00 60.65 59.54 2j28 h LYS 18 Cb 1.40 0.06 -0.00 0.00 -0.57 0.00 0.00 32.23 33.12 2j28 h LYS 18 CO -0.06 1.06 -0.32 0.45 -2.06 0.00 0.00 179.45 178.52 2j28 h HIS 19 N 0.32 -0.84 -0.27 -1.35 3.86 -1.42 -1.13 115.15 114.32 2j28 h HIS 19 Ca -0.00 -0.01 0.08 0.00 -1.16 0.00 0.00 60.37 59.28 2j28 h HIS 19 Cb 1.07 0.30 -0.01 0.00 1.06 0.00 0.00 27.41 29.82 2j28 h HIS 19 CO 0.09 -0.47 0.30 1.57 0.86 0.00 0.00 177.93 180.28 2j28 h LYS 20 N -0.79 0.00 -0.45 2.45 2.10 -1.65 0.61 116.57 118.84 2j28 h LYS 20 Ca -0.07 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.49 2j28 h LYS 20 Cb 0.63 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.94 2j28 h LYS 20 CO 0.08 0.00 -0.05 0.00 -2.00 0.00 0.00 179.45 177.48 2j28 h ALA 21 N 1.66 0.61 -0.04 0.07 0.00 -1.21 -2.78 119.26 117.58 2j28 h ALA 21 Ca 0.13 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 2j28 h ALA 21 Cb 0.72 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2j28 h ALA 21 CO -0.00 0.46 -0.32 1.79 0.00 0.00 0.00 179.25 181.18 2j28 h THR 22 N 0.67 1.25 0.00 0.00 1.35 0.35 -1.98 112.91 114.55 2j28 h THR 22 Ca 0.12 -1.17 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 2j28 h THR 22 Cb 0.57 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.57 2j28 h THR 22 CO 0.03 0.34 0.00 0.18 -0.25 0.00 0.00 175.52 175.82 2j28 n LEU 23 N -4.14 0.05 0.04 3.87 4.77 -0.99 -0.90 117.00 119.71 2j28 n LEU 23 Ca -0.02 0.52 -0.20 0.00 -0.03 0.00 0.00 56.01 56.29 2j28 n LEU 23 Cb 0.38 -0.53 -0.14 0.00 -2.33 0.00 0.00 43.42 40.80 2j28 n LEU 23 CO 0.39 -0.51 0.08 -0.07 -1.33 0.00 0.00 177.39 175.95 2j28 h LEU 24 N 0.00 0.51 -1.76 2.23 -0.00 -1.42 -3.16 115.31 111.72 2j28 h LEU 24 Ca 0.00 -0.90 0.01 0.00 -0.00 0.00 0.00 57.88 56.98 2j28 h LEU 24 Cb 0.02 -0.16 -0.00 0.00 -0.00 0.00 0.00 40.66 40.52 2j28 h LEU 24 CO 0.00 1.37 0.42 1.23 -0.00 0.00 0.00 178.44 181.46 2j28 h GLY 25 N -0.27 0.00 -4.37 0.83 0.00 -1.16 -3.38 103.07 94.73 2j28 h GLY 25 Ca -0.13 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.51 2j28 h GLY 25 CO 0.15 0.00 -0.82 1.08 0.00 0.00 0.00 176.54 176.95 2j28 s LEU 26 N -5.73 2.54 0.00 3.11 1.43 -1.19 -4.68 118.68 114.16 2j28 s LEU 26 Ca -0.03 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.60 2j28 s LEU 26 Cb 0.08 -1.48 0.00 0.00 0.03 0.00 0.00 46.19 44.82 2j28 s LEU 26 CO 0.25 0.25 0.69 0.61 0.23 0.00 0.00 176.35 178.37 2j28 n GLY 27 N 1.48 -0.22 3.26 -3.19 0.00 -1.26 -4.80 105.19 100.47 2j28 n GLY 27 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 2j28 n GLY 27 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2j28 n LEU 28 N -1.19 -2.50 -3.61 0.99 4.32 -1.25 -4.99 117.00 108.77 2j28 n LEU 28 Ca 0.00 0.86 0.04 0.00 -0.02 0.00 0.00 56.01 56.89 2j28 n LEU 28 Cb 0.03 -0.88 0.00 0.00 -1.62 0.00 0.00 43.42 40.95 2j28 n LEU 28 CO 0.00 -3.89 1.21 -0.13 -1.22 0.00 0.00 177.39 173.37 2j28 s ARG 29 N -0.98 0.04 1.36 3.23 1.81 -1.26 -4.83 118.95 118.32 2j28 s ARG 29 Ca 0.59 -0.02 0.00 0.00 -1.72 0.00 0.00 55.73 54.58 2j28 s ARG 29 Cb -0.69 0.01 0.00 0.00 -0.45 0.00 0.00 34.95 33.83 2j28 s ARG 29 CO 0.60 -0.02 0.00 0.54 -0.68 0.00 0.00 175.30 175.74 2j28 n ARG 30 N -0.56 0.00 -0.01 3.54 5.12 -1.26 -4.20 116.66 119.29 2j28 n ARG 30 Ca -0.08 0.00 -0.02 0.00 -1.93 0.00 0.00 57.85 55.82 2j28 n ARG 30 Cb 0.63 0.00 -0.01 0.00 -1.16 0.00 0.00 32.46 31.93 2j28 n ARG 30 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2j28 n ILE 31 N -0.11 0.56 0.18 0.55 2.08 -1.26 -4.70 119.36 116.66 2j28 n ILE 31 Ca 0.00 0.26 0.18 0.00 0.56 0.00 0.00 62.75 63.75 2j28 n ILE 31 Cb 0.00 -1.55 0.81 0.00 -0.75 0.00 0.00 39.64 38.15 2j28 n ILE 31 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2j28 h GLY 32 N -0.21 0.00 -5.05 7.39 0.00 -1.84 -3.16 103.07 100.20 2j28 h GLY 32 Ca 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.68 2j28 h GLY 32 CO 0.00 0.00 0.25 1.57 0.00 0.00 0.00 176.54 178.36 2j28 n HIS 33 N -3.69 1.25 -3.99 5.60 -0.00 -1.26 -4.59 115.22 108.54 2j28 n HIS 33 Ca 0.03 0.69 -0.09 0.00 -0.00 0.00 0.00 57.72 58.36 2j28 n HIS 33 Cb 0.42 -2.27 -0.10 0.00 -0.00 0.00 0.00 29.99 28.05 2j28 n HIS 33 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.34 176.26 2j28 s THR 34 N -0.22 0.15 0.00 3.57 -1.32 -1.26 -2.19 115.64 114.38 2j28 s THR 34 Ca 0.73 -1.27 0.00 0.00 -1.21 0.00 0.00 61.69 59.94 2j28 s THR 34 Cb -0.86 -0.96 0.00 0.00 -1.51 0.00 0.00 72.50 69.18 2j28 s THR 34 CO 0.53 -0.70 0.00 0.52 -2.21 0.00 0.00 174.62 172.75 2j28 n VAL 35 N 0.73 0.00 -4.38 5.08 0.31 -1.21 -4.82 118.33 114.03 2j28 n VAL 35 Ca -0.18 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 63.92 2j28 n VAL 35 Cb 0.59 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 33.44 2j28 n VAL 35 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2j28 s GLU 36 N -1.32 1.85 0.00 5.55 2.02 -1.23 -2.24 118.70 123.33 2j28 s GLU 36 Ca 0.00 -2.10 0.00 0.00 0.02 0.00 0.00 54.97 52.89 2j28 s GLU 36 Cb 0.00 -0.05 0.00 0.00 0.10 0.00 0.00 34.13 34.18 2j28 s GLU 36 CO 0.00 -0.60 0.00 0.54 0.02 0.00 0.00 175.26 175.22 2j28 n ARG 37 N -0.76 -1.67 -2.05 1.61 5.12 -1.18 -4.26 116.66 113.49 2j28 n ARG 37 Ca 0.02 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.52 2j28 n ARG 37 Cb 0.63 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.90 2j28 n ARG 37 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 2j28 s GLU 38 N -1.85 4.22 -0.65 5.56 8.01 0.04 -3.32 118.70 130.71 2j28 s GLU 38 Ca 0.00 2.17 -0.07 0.00 0.01 0.00 0.00 54.97 57.09 2j28 s GLU 38 Cb 0.00 -3.68 -0.17 0.00 -4.31 0.00 0.00 34.13 25.97 2j28 s GLU 38 CO 0.00 -0.71 3.01 -3.47 0.01 0.00 0.00 175.26 174.10 2j28 n ASP 39 N 5.90 6.01 -4.89 -0.19 2.03 -1.24 -3.84 116.55 120.32 2j28 n ASP 39 Ca 0.15 -2.42 -0.29 0.00 0.52 0.00 0.00 54.79 52.75 2j28 n ASP 39 Cb 0.42 -1.33 0.02 0.00 -0.72 0.00 0.00 41.12 39.51 2j28 n ASP 39 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2j28 s THR 40 N 1.82 4.36 0.54 5.18 -1.32 -1.26 -4.84 115.64 120.13 2j28 s THR 40 Ca 0.60 0.41 0.28 0.00 -1.21 0.00 0.00 61.69 61.76 2j28 s THR 40 Cb 0.22 -3.72 0.41 0.00 -1.51 0.00 0.00 72.50 67.91 2j28 s THR 40 CO -0.02 -0.83 1.96 -0.65 -2.21 0.00 0.00 174.62 172.87 2j28 h PRO 41 N -0.16 0.00 0.27 7.08 0.11 -1.97 0.25 132.00 137.57 2j28 h PRO 41 Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 2j28 h PRO 41 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2j28 h PRO 41 CO 0.62 0.00 -0.13 0.00 -0.21 0.00 0.00 178.00 178.28 2j28 h ALA 42 N 1.65 -0.65 -0.70 -0.75 0.00 -1.94 -2.65 119.26 114.22 2j28 h ALA 42 Ca 0.28 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.14 2j28 h ALA 42 Cb 1.17 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.06 2j28 h ALA 42 CO -0.00 -0.62 0.46 0.97 0.00 0.00 0.00 179.25 180.06 2j28 h ILE 43 N -0.57 1.10 -0.45 0.00 -0.00 -1.72 0.61 117.51 116.47 2j28 h ILE 43 Ca -0.04 -0.29 0.13 0.00 -0.00 0.00 0.00 64.86 64.67 2j28 h ILE 43 Cb 0.27 0.18 -0.02 0.00 -0.00 0.00 0.00 36.82 37.26 2j28 h ILE 43 CO 0.06 0.15 0.39 -0.09 -0.00 0.00 0.00 178.15 178.66 2j28 h ARG 44 N 0.84 0.00 0.05 2.19 9.65 -0.54 0.14 114.38 126.71 2j28 h ARG 44 Ca 0.28 0.00 -0.36 0.00 -1.10 0.00 0.00 59.98 58.80 2j28 h ARG 44 Cb 0.07 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 28.60 2j28 h ARG 44 CO -0.08 0.00 -2.14 0.41 2.80 0.00 0.00 179.97 180.96 2j28 n GLY 45 N -1.55 -0.65 0.40 2.80 0.00 0.98 -3.76 105.19 103.40 2j28 n GLY 45 Ca 0.08 -0.21 0.19 0.00 0.00 0.00 0.00 46.02 46.08 2j28 n GLY 45 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2j28 h MET 46 N 0.03 0.44 -0.18 1.61 -1.53 0.25 0.39 114.93 115.94 2j28 h MET 46 Ca -0.46 -0.03 -0.15 0.00 -3.44 0.00 0.00 59.70 55.62 2j28 h MET 46 Cb 2.03 -0.10 0.00 0.00 -0.55 0.00 0.00 31.60 32.98 2j28 h MET 46 CO 0.03 0.29 -0.49 0.82 0.14 0.00 0.00 176.91 177.70 2j28 h ILE 47 N 0.45 1.32 -0.58 1.77 2.04 -1.10 -3.01 117.51 118.41 2j28 h ILE 47 Ca 0.52 -1.73 0.05 0.00 1.00 0.00 0.00 64.86 64.70 2j28 h ILE 47 Cb 1.23 1.93 -0.03 0.00 -0.74 0.00 0.00 36.82 39.20 2j28 h ILE 47 CO -0.23 0.54 0.38 0.78 0.00 0.00 0.00 178.15 179.62 2j28 h ASN 48 N 0.33 0.50 0.23 1.72 2.35 -0.40 1.32 115.58 121.64 2j28 h ASN 48 Ca -0.01 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 2j28 h ASN 48 Cb 1.10 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.37 2j28 h ASN 48 CO 0.11 0.33 -0.11 0.00 -1.65 0.00 0.00 177.43 176.11 2j28 h ALA 49 N 1.68 -0.31 -0.29 -0.83 0.00 -1.03 -2.55 119.26 115.94 2j28 h ALA 49 Ca 0.25 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2j28 h ALA 49 Cb 0.24 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2j28 h ALA 49 CO -0.07 -0.55 0.05 0.28 0.00 0.00 0.00 179.25 178.96 2j28 n VAL 50 N -5.12 1.36 0.13 0.00 0.31 -0.72 -4.58 118.33 109.71 2j28 n VAL 50 Ca -0.09 -0.66 0.15 0.00 -0.01 0.00 0.00 64.34 63.73 2j28 n VAL 50 Cb 0.22 -0.47 0.43 0.00 -0.91 0.00 0.00 33.84 33.11 2j28 n VAL 50 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 2j28 h SER 51 N 1.54 0.00 0.00 4.52 0.87 0.21 -1.99 113.55 118.70 2j28 h SER 51 Ca 0.05 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 2j28 h SER 51 Cb 1.28 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 2j28 h SER 51 CO 0.27 0.00 -0.34 0.15 -0.53 0.00 0.00 176.83 176.37 2j28 h PHE 52 N 0.00 0.00 0.00 2.24 3.57 -1.83 -3.38 116.94 117.54 2j28 h PHE 52 Ca 0.18 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.68 2j28 h PHE 52 Cb 1.83 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.57 2j28 h PHE 52 CO 0.00 0.00 0.00 0.00 -2.23 0.00 0.00 178.31 176.08 2j28 n MET 53 N -4.10 0.33 -3.72 1.11 0.00 -0.97 -4.65 117.12 105.12 2j28 n MET 53 Ca -0.05 0.00 -0.14 0.00 0.00 0.00 0.00 57.70 57.51 2j28 n MET 53 Cb 0.18 -1.38 -0.14 0.00 0.00 0.00 0.00 33.22 31.87 2j28 n MET 53 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 2j28 s VAL 54 N -2.00 -0.12 0.10 3.17 1.01 -0.79 -0.67 120.40 121.11 2j28 s VAL 54 Ca 0.12 0.22 0.08 0.00 0.00 0.00 0.00 61.98 62.40 2j28 s VAL 54 Cb 0.06 -0.29 -0.03 0.00 0.00 0.00 0.00 36.38 36.11 2j28 s VAL 54 CO 0.09 0.09 -0.21 -0.54 0.00 0.00 0.00 175.10 174.53 2j28 s LYS 55 N 1.51 1.13 -0.01 2.72 -0.14 -1.14 -4.64 119.74 119.17 2j28 s LYS 55 Ca -0.06 -1.17 0.20 0.00 -1.36 0.00 0.00 55.97 53.59 2j28 s LYS 55 Cb -0.11 -1.40 0.34 0.00 -1.68 0.00 0.00 37.83 34.97 2j28 s LYS 55 CO -0.07 0.33 1.14 1.33 -0.76 0.00 0.00 175.35 177.32 2j28 n VAL 56 N 1.08 0.08 -3.27 3.17 0.24 -1.26 -3.13 118.33 115.25 2j28 n VAL 56 Ca -0.19 -0.87 -0.13 0.00 -2.04 0.00 0.00 64.34 61.10 2j28 n VAL 56 Cb 0.53 0.85 -0.06 0.00 -1.47 0.00 0.00 33.84 33.70 2j28 n VAL 56 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 2j28 s GLU 57 N -0.12 0.76 0.00 7.34 -1.05 -1.26 -4.98 118.70 119.38 2j28 s GLU 57 Ca 0.27 -0.91 0.31 0.00 -0.15 0.00 0.00 54.97 54.49 2j28 s GLU 57 Cb 0.31 -0.57 1.76 0.00 -0.44 0.00 0.00 34.13 35.19 2j28 s GLU 57 CO -0.13 -1.23 2.14 -0.85 0.95 0.00 0.00 175.26 176.14