#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ro3 n LYS 2 N 0.00 0.00 0.00 0.03 5.02 -1.26 -0.22 118.16 121.73 2ro3 n LYS 2 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2ro3 n LYS 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2ro3 n LYS 2 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2ro3 n SER 3 N 4.64 0.42 0.02 4.39 2.88 -1.26 -4.83 113.62 119.89 2ro3 n SER 3 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 2ro3 n SER 3 Cb 0.00 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.32 2ro3 n SER 3 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2ro3 h ILE 4 N 0.00 1.07 -2.11 2.46 2.04 -2.04 -3.48 117.51 115.45 2ro3 h ILE 4 Ca 0.00 -2.82 -0.21 0.00 1.00 0.00 0.00 64.86 62.83 2ro3 h ILE 4 Cb 0.31 2.61 0.02 0.00 -0.74 0.00 0.00 36.82 39.02 2ro3 h ILE 4 CO 0.00 0.72 -0.29 0.61 0.00 0.00 0.00 178.15 179.19 2ro3 n GLY 5 N 1.60 0.03 3.26 5.37 0.00 0.69 -4.96 105.19 111.19 2ro3 n GLY 5 Ca -0.15 -0.37 -0.30 0.00 0.00 0.00 0.00 46.02 45.19 2ro3 n GLY 5 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ro3 s VAL 6 N -2.73 1.96 -0.02 1.61 -7.23 -1.26 -4.48 120.40 108.24 2ro3 s VAL 6 Ca 0.10 -1.03 0.06 0.00 -1.81 0.00 0.00 61.98 59.30 2ro3 s VAL 6 Cb -0.04 -1.64 -0.01 0.00 0.56 0.00 0.00 36.38 35.24 2ro3 s VAL 6 CO 0.12 0.55 -0.21 0.54 -0.31 0.00 0.00 175.10 175.79 2ro3 s VAL 7 N -0.32 1.68 0.11 1.32 0.11 -1.26 -5.02 120.40 117.01 2ro3 s VAL 7 Ca 0.02 -0.90 0.10 0.00 -2.93 0.00 0.00 61.98 58.27 2ro3 s VAL 7 Cb -0.12 -1.40 -0.04 0.00 -1.53 0.00 0.00 36.38 33.30 2ro3 s VAL 7 CO 0.02 0.47 -0.27 -0.13 -3.33 0.00 0.00 175.10 171.87 2ro3 s ARG 8 N -0.42 1.48 -0.24 1.54 3.00 -1.26 -5.10 118.95 117.95 2ro3 s ARG 8 Ca 0.06 -1.28 -0.07 0.00 0.00 0.00 0.00 55.73 54.44 2ro3 s ARG 8 Cb -0.09 -1.90 -0.03 0.00 0.00 0.00 0.00 34.95 32.94 2ro3 s ARG 8 CO -0.00 0.46 0.05 0.15 0.00 0.00 0.00 175.30 175.95 2ro3 s LYS 9 N -1.85 3.63 0.42 3.54 -0.14 -1.26 -5.07 119.74 119.01 2ro3 s LYS 9 Ca 0.13 -0.50 -0.24 0.00 -1.36 0.00 0.00 55.97 54.00 2ro3 s LYS 9 Cb -0.10 -3.25 -0.10 0.00 -1.68 0.00 0.00 37.83 32.70 2ro3 s LYS 9 CO 0.05 -0.14 1.00 0.28 -0.76 0.00 0.00 175.35 175.78 2ro3 n VAL 10 N 4.76 2.47 0.00 3.17 0.31 -1.26 -4.86 118.33 122.92 2ro3 n VAL 10 Ca -0.17 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.66 2ro3 n VAL 10 Cb 0.51 -1.15 0.00 0.00 -0.91 0.00 0.00 33.84 32.29 2ro3 n VAL 10 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2ro3 n ASP 11 N 0.48 0.00 0.06 4.52 2.03 0.70 -4.95 116.55 119.39 2ro3 n ASP 11 Ca 0.09 0.76 0.00 0.00 0.52 0.00 0.00 54.79 56.17 2ro3 n ASP 11 Cb 0.39 -0.26 0.00 0.00 -0.72 0.00 0.00 41.12 40.53 2ro3 n ASP 11 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2ro3 n GLU 12 N -1.36 0.00 -0.44 -0.67 1.02 -1.26 -4.93 120.64 112.99 2ro3 n GLU 12 Ca 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.20 2ro3 n GLU 12 Cb 0.00 0.00 0.25 0.00 -0.02 0.00 0.00 31.44 31.67 2ro3 n GLU 12 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 2ro3 n LEU 13 N -2.73 3.52 0.00 -4.62 -0.00 -1.26 -4.85 117.00 107.05 2ro3 n LEU 13 Ca 0.00 -1.77 0.00 0.00 -0.00 0.00 0.00 56.01 54.24 2ro3 n LEU 13 Cb 0.00 -0.49 0.00 0.00 -0.00 0.00 0.00 43.42 42.93 2ro3 n LEU 13 CO 0.00 0.59 0.00 0.61 -0.00 0.00 0.00 177.39 178.59 2ro3 n GLY 14 N 0.86 0.85 3.70 1.47 0.00 -1.26 -5.08 105.19 105.73 2ro3 n GLY 14 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2ro3 n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ro3 s ARG 15 N -0.38 4.43 0.33 1.61 0.52 -1.26 -4.79 118.95 119.41 2ro3 s ARG 15 Ca 0.00 1.65 0.05 0.00 -0.52 0.00 0.00 55.73 56.91 2ro3 s ARG 15 Cb 0.00 -3.44 -0.02 0.00 0.52 0.00 0.00 34.95 32.01 2ro3 s ARG 15 CO 0.00 -0.28 0.19 0.44 0.02 0.00 0.00 175.30 175.67 2ro3 n ILE 16 N 4.16 0.00 -3.92 1.52 -5.35 -1.26 -0.21 119.36 114.30 2ro3 n ILE 16 Ca 0.09 -2.12 -0.35 0.00 -0.27 0.00 0.00 62.75 60.10 2ro3 n ILE 16 Cb 0.47 0.91 -0.14 0.00 -1.74 0.00 0.00 39.64 39.14 2ro3 n ILE 16 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2ro3 s VAL 17 N -3.04 2.97 0.31 7.28 0.11 -1.26 -5.05 120.40 121.71 2ro3 s VAL 17 Ca 0.26 -1.29 -0.15 0.00 -2.93 0.00 0.00 61.98 57.87 2ro3 s VAL 17 Cb 0.01 -2.66 -0.09 0.00 -1.53 0.00 0.00 36.38 32.11 2ro3 s VAL 17 CO 0.19 -0.03 0.72 -0.04 -3.33 0.00 0.00 175.10 172.60 2ro3 s MET 18 N 1.27 4.01 0.59 1.54 1.00 -1.26 -4.94 119.30 121.51 2ro3 s MET 18 Ca -0.04 0.66 -0.03 0.00 0.00 0.00 0.00 55.69 56.28 2ro3 s MET 18 Cb -0.19 -2.48 0.03 0.00 0.00 0.00 0.00 34.83 32.19 2ro3 s MET 18 CO -0.02 0.19 0.86 -1.25 0.00 0.00 0.00 175.02 174.80 2ro3 s PRO 19 N -2.89 2.61 0.45 2.03 0.04 -1.26 -4.93 135.00 131.05 2ro3 s PRO 19 Ca 0.53 -0.40 0.23 0.00 0.04 0.00 0.00 61.00 61.40 2ro3 s PRO 19 Cb -0.11 -2.35 1.22 0.00 0.04 0.00 0.00 34.50 33.30 2ro3 s PRO 19 CO 0.18 -0.79 1.82 0.97 0.04 0.00 0.00 177.00 179.22 2ro3 h ILE 20 N -0.13 0.56 -0.93 0.56 6.09 -1.99 0.16 117.51 121.82 2ro3 h ILE 20 Ca -0.44 -0.10 0.14 0.00 -1.37 0.00 0.00 64.86 63.09 2ro3 h ILE 20 Cb 1.29 0.26 -0.08 0.00 0.47 0.00 0.00 36.82 38.76 2ro3 h ILE 20 CO 0.57 0.05 0.60 -0.33 -3.07 0.00 0.00 178.15 175.97 2ro3 h GLU 21 N 0.28 0.78 -0.24 2.19 4.39 -1.98 0.35 114.58 120.36 2ro3 h GLU 21 Ca 0.52 -0.05 -0.08 0.00 0.34 0.00 0.00 59.36 60.10 2ro3 h GLU 21 Cb 1.53 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 30.00 2ro3 h GLU 21 CO -0.17 0.52 -0.15 1.25 -1.16 0.00 0.00 179.01 179.30 2ro3 h LEU 22 N 0.81 0.55 -0.04 1.33 6.46 -1.04 0.16 115.31 123.53 2ro3 h LEU 22 Ca 0.47 -0.43 -0.00 0.00 -0.12 0.00 0.00 57.88 57.80 2ro3 h LEU 22 Cb 0.63 -0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 40.41 2ro3 h LEU 22 CO -0.23 0.86 0.02 0.03 -0.62 0.00 0.00 178.44 178.50 2ro3 h ARG 23 N 0.24 0.05 0.24 1.25 3.08 -0.92 -0.95 114.38 117.37 2ro3 h ARG 23 Ca 0.05 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 2ro3 h ARG 23 Cb 0.67 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.71 2ro3 h ARG 23 CO 0.04 0.09 -0.14 0.00 -1.07 0.00 0.00 179.97 178.90 2ro3 h ARG 24 N -0.00 -0.35 -0.71 0.04 3.08 -0.34 0.11 114.38 116.22 2ro3 h ARG 24 Ca 0.01 0.02 0.14 0.00 0.07 0.00 0.00 59.98 60.23 2ro3 h ARG 24 Cb 0.05 0.08 -0.10 0.00 0.08 0.00 0.00 29.97 30.09 2ro3 h ARG 24 CO -0.00 -0.23 0.23 0.00 -1.07 0.00 0.00 179.97 178.89 2ro3 h ALA 25 N 0.39 0.95 -3.00 0.04 0.00 -0.62 -3.39 119.26 113.63 2ro3 h ALA 25 Ca -0.03 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2ro3 h ALA 25 Cb 0.29 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2ro3 h ALA 25 CO 0.04 -0.27 0.00 1.28 0.00 0.00 0.00 179.25 180.30 2ro3 n LEU 26 N -5.07 0.00 -0.06 0.00 4.77 -0.37 -5.04 117.00 111.23 2ro3 n LEU 26 Ca 0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2ro3 n LEU 26 Cb 0.40 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 2ro3 n LEU 26 CO 0.16 0.00 0.03 -0.67 -1.33 0.00 0.00 177.39 175.59 2ro3 n ASP 27 N 0.00 0.00 -4.72 -1.43 2.03 -0.06 -5.04 116.55 107.34 2ro3 n ASP 27 Ca 0.00 -0.21 -0.42 0.00 0.52 0.00 0.00 54.79 54.69 2ro3 n ASP 27 Cb 0.00 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.37 2ro3 n ASP 27 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2ro3 s ILE 28 N 0.00 4.24 -0.24 5.18 1.09 -0.70 -4.93 121.20 125.84 2ro3 s ILE 28 Ca 0.00 1.67 -0.16 0.00 -1.10 0.00 0.00 60.65 61.06 2ro3 s ILE 28 Cb 0.00 -4.07 -0.11 0.00 -1.06 0.00 0.00 42.46 37.22 2ro3 s ILE 28 CO 0.00 0.16 -0.26 0.00 -0.10 0.00 0.00 174.94 174.74 2ro3 n ALA 29 N 3.60 1.04 0.00 9.38 0.00 -1.26 -4.66 120.51 128.61 2ro3 n ALA 29 Ca 0.07 -0.92 0.00 0.00 0.00 0.00 0.00 53.44 52.58 2ro3 n ALA 29 Cb 0.48 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.93 2ro3 n ALA 29 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 2ro3 n ILE 30 N -4.34 0.00 0.00 0.00 0.00 -1.26 -4.98 119.36 108.78 2ro3 n ILE 30 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 62.75 62.34 2ro3 n ILE 30 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 39.64 40.39 2ro3 n ILE 30 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2ro3 n LYS 31 N -0.97 0.00 0.00 9.51 5.02 -1.26 -5.08 118.16 125.37 2ro3 n LYS 31 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2ro3 n LYS 31 Cb 0.00 -0.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.51 2ro3 n LYS 31 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2ro3 n ASP 32 N -2.28 0.00 0.00 4.39 2.03 -1.26 -4.68 116.55 114.75 2ro3 n ASP 32 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2ro3 n ASP 32 Cb 0.22 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.62 2ro3 n ASP 32 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2ro3 n SER 33 N 7.10 0.00 -3.88 1.67 7.64 -1.26 -5.03 113.62 119.86 2ro3 n SER 33 Ca 0.00 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.63 2ro3 n SER 33 Cb 0.00 0.00 -0.17 0.00 -1.01 0.00 0.00 64.21 63.03 2ro3 n SER 33 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2ro3 s ILE 34 N 0.00 0.84 -0.02 0.44 1.09 -1.26 -3.22 121.20 119.07 2ro3 s ILE 34 Ca 0.00 -0.18 0.05 0.00 -1.10 0.00 0.00 60.65 59.42 2ro3 s ILE 34 Cb 0.00 -0.88 -0.03 0.00 -1.06 0.00 0.00 42.46 40.49 2ro3 s ILE 34 CO 0.00 0.33 -0.18 -0.70 -0.10 0.00 0.00 174.94 174.30 2ro3 s GLU 35 N 1.66 2.30 0.14 2.79 2.12 0.88 -4.90 118.70 123.68 2ro3 s GLU 35 Ca 0.03 -0.83 0.10 0.00 0.36 0.00 0.00 54.97 54.63 2ro3 s GLU 35 Cb -0.13 -2.26 -0.04 0.00 0.26 0.00 0.00 34.13 31.96 2ro3 s GLU 35 CO -0.06 0.59 -0.20 -0.06 -0.54 0.00 0.00 175.26 174.98 2ro3 s PHE 36 N -0.77 2.46 0.25 5.30 0.08 -1.25 -1.26 117.98 122.78 2ro3 s PHE 36 Ca 0.12 -0.30 0.10 0.00 0.12 0.00 0.00 56.93 56.97 2ro3 s PHE 36 Cb -0.10 -1.29 -0.04 0.00 -0.57 0.00 0.00 43.02 41.02 2ro3 s PHE 36 CO 0.02 0.40 -0.05 0.12 -0.10 0.00 0.00 175.22 175.61 2ro3 s PHE 37 N -1.26 2.62 -0.05 0.36 2.19 0.20 -4.90 117.98 117.15 2ro3 s PHE 37 Ca 0.18 -0.24 0.01 0.00 0.33 0.00 0.00 56.93 57.22 2ro3 s PHE 37 Cb -0.10 -1.18 0.02 0.00 -1.31 0.00 0.00 43.02 40.45 2ro3 s PHE 37 CO 0.10 0.61 -0.06 0.54 1.83 0.00 0.00 175.22 178.24 2ro3 s VAL 38 N -2.22 0.67 -0.40 3.12 0.11 -1.26 0.26 120.40 120.68 2ro3 s VAL 38 Ca 0.30 -0.20 0.02 0.00 -2.93 0.00 0.00 61.98 59.17 2ro3 s VAL 38 Cb -0.07 -0.67 0.12 0.00 -1.53 0.00 0.00 36.38 34.23 2ro3 s VAL 38 CO 0.18 0.26 0.18 -0.62 -3.33 0.00 0.00 175.10 171.76 2ro3 s ASP 39 N 0.89 3.97 0.00 3.54 2.15 0.11 -4.96 116.67 122.37 2ro3 s ASP 39 Ca -0.11 -2.33 0.00 0.00 0.43 0.00 0.00 52.55 50.54 2ro3 s ASP 39 Cb -0.15 -1.12 0.00 0.00 -0.30 0.00 0.00 42.92 41.35 2ro3 s ASP 39 CO 0.01 -0.32 0.00 0.61 -0.17 0.00 0.00 175.17 175.30 2ro3 n GLY 40 N 3.96 0.66 0.22 2.66 0.00 -1.26 -0.67 105.19 110.77 2ro3 n GLY 40 Ca 0.05 0.58 0.08 0.00 0.00 0.00 0.00 46.02 46.73 2ro3 n GLY 40 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ro3 n ASP 41 N 3.07 1.96 -4.26 1.61 9.92 -1.26 -5.04 116.55 122.55 2ro3 n ASP 41 Ca 0.00 -3.05 -0.20 0.00 -0.53 0.00 0.00 54.79 51.02 2ro3 n ASP 41 Cb 0.00 -0.41 -0.11 0.00 -0.64 0.00 0.00 41.12 39.95 2ro3 n ASP 41 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 2ro3 s LYS 42 N -2.52 1.08 0.04 -1.24 2.20 0.16 -5.15 119.74 114.30 2ro3 s LYS 42 Ca 0.29 -1.24 0.07 0.00 -0.36 0.00 0.00 55.97 54.73 2ro3 s LYS 42 Cb 0.26 -1.06 -0.02 0.00 -1.51 0.00 0.00 37.83 35.50 2ro3 s LYS 42 CO 0.01 0.21 -0.20 0.42 -0.36 0.00 0.00 175.35 175.43 2ro3 s ILE 43 N -1.92 1.64 -0.04 5.43 -1.09 -1.26 0.08 121.20 124.04 2ro3 s ILE 43 Ca 0.09 -1.16 0.05 0.00 -2.23 0.00 0.00 60.65 57.41 2ro3 s ILE 43 Cb -0.06 -1.42 -0.01 0.00 -1.58 0.00 0.00 42.46 39.39 2ro3 s ILE 43 CO 0.04 0.22 -0.20 -0.63 -1.23 0.00 0.00 174.94 173.14 2ro3 s ILE 44 N -0.77 1.67 0.05 2.92 1.01 0.14 -4.91 121.20 121.30 2ro3 s ILE 44 Ca 0.07 -0.87 0.06 0.00 0.00 0.00 0.00 60.65 59.92 2ro3 s ILE 44 Cb -0.09 -1.41 -0.02 0.00 0.01 0.00 0.00 42.46 40.95 2ro3 s ILE 44 CO 0.01 0.47 -0.18 -0.76 0.00 0.00 0.00 174.94 174.49 2ro3 s LEU 45 N -0.17 2.18 0.09 2.97 1.02 -1.26 0.60 118.68 124.12 2ro3 s LEU 45 Ca -0.00 -0.51 -0.26 0.00 0.02 0.00 0.00 54.13 53.38 2ro3 s LEU 45 Cb -0.11 -0.81 0.07 0.00 0.02 0.00 0.00 46.19 45.36 2ro3 s LEU 45 CO 0.02 0.10 0.63 -1.59 0.02 0.00 0.00 176.35 175.52 2ro3 s LYS 46 N -1.24 1.20 0.56 1.70 0.00 -0.39 -4.96 119.74 116.61 2ro3 s LYS 46 Ca 0.05 -0.24 -0.20 0.00 0.00 0.00 0.00 55.97 55.58 2ro3 s LYS 46 Cb -0.09 0.56 -0.05 0.00 0.00 0.00 0.00 37.83 38.26 2ro3 s LYS 46 CO 0.02 -0.48 1.22 0.21 0.00 0.00 0.00 175.35 176.31 2ro3 s LYS 47 N -2.94 3.17 -0.02 1.78 2.36 -1.25 -0.08 119.74 122.75 2ro3 s LYS 47 Ca -0.03 1.87 -0.24 0.00 -2.55 0.00 0.00 55.97 55.02 2ro3 s LYS 47 Cb -0.01 -2.07 -0.17 0.00 -1.05 0.00 0.00 37.83 34.54 2ro3 s LYS 47 CO -0.06 -1.06 1.11 -0.92 1.55 0.00 0.00 175.35 175.97 2ro3 h TYR 48 N 1.21 -0.26 0.21 4.03 3.20 -1.92 -3.34 116.97 120.09 2ro3 h TYR 48 Ca -0.50 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.37 2ro3 h TYR 48 Cb 1.29 0.09 -0.04 0.00 1.54 0.00 0.00 36.73 39.60 2ro3 h TYR 48 CO 0.48 0.13 -0.50 -0.22 -1.64 0.00 0.00 178.16 176.41 2ro3 h LYS 49 N -0.75 -0.77 -6.81 1.82 1.63 -1.91 -3.38 116.57 106.40 2ro3 h LYS 49 Ca -0.03 0.05 -0.55 0.00 -0.85 0.00 0.00 60.65 59.27 2ro3 h LYS 49 Cb 0.50 0.17 0.10 0.00 -0.60 0.00 0.00 32.23 32.41 2ro3 h LYS 49 CO 0.05 -0.51 0.73 -2.30 -3.45 0.00 0.00 179.45 173.96 2ro3 n PRO 50 N -5.50 2.49 0.00 1.90 -0.02 -1.26 -1.88 135.00 130.72 2ro3 n PRO 50 Ca -0.09 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 2ro3 n PRO 50 Cb 0.42 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 2ro3 n PRO 50 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2ro3 n HIS 51 N 1.08 0.00 0.00 6.00 8.25 -1.26 -4.74 115.22 124.55 2ro3 n HIS 51 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 2ro3 n HIS 51 Cb 0.37 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.48 2ro3 n HIS 51 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2ro3 n GLY 52 N -1.75 1.78 3.77 -1.41 0.00 -0.79 -4.88 105.19 101.91 2ro3 n GLY 52 Ca 0.00 -0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 2ro3 n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ro3 s VAL 53 N 0.00 2.40 0.00 1.61 0.11 -1.26 -4.92 120.40 118.34 2ro3 s VAL 53 Ca 0.00 0.38 0.00 0.00 -2.93 0.00 0.00 61.98 59.43 2ro3 s VAL 53 Cb 0.00 -3.23 0.00 0.00 -1.53 0.00 0.00 36.38 31.62 2ro3 s VAL 53 CO 0.00 0.07 0.32 0.00 -3.33 0.00 0.00 175.10 172.16