#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ej4 s SER 2 N 0.00 4.33 -1.06 1.61 1.04 -1.26 -4.98 113.70 113.38 2ej4 s SER 2 Ca 0.00 0.84 -0.03 0.00 0.48 0.00 0.00 55.95 57.24 2ej4 s SER 2 Cb 0.00 -1.36 0.31 0.00 0.10 0.00 0.00 66.02 65.07 2ej4 s SER 2 CO 0.00 -2.02 1.66 -0.24 0.98 0.00 0.00 173.24 173.62 2ej4 n SER 3 N -3.40 6.87 0.00 7.02 2.88 -1.26 -4.56 113.62 121.17 2ej4 n SER 3 Ca 0.08 -3.54 0.00 0.00 -1.33 0.00 0.00 58.87 54.08 2ej4 n SER 3 Cb 0.60 -1.23 0.00 0.00 -0.75 0.00 0.00 64.21 62.84 2ej4 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ej4 n GLY 4 N 0.70 -1.80 2.76 0.46 0.00 -1.26 -5.13 105.19 100.93 2ej4 n GLY 4 Ca 0.36 0.70 -0.30 0.00 0.00 0.00 0.00 46.02 46.78 2ej4 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ej4 s SER 5 N 0.00 3.93 0.40 1.61 0.15 -1.26 -5.11 113.70 113.42 2ej4 s SER 5 Ca 0.00 -2.28 0.04 0.00 0.70 0.00 0.00 55.95 54.41 2ej4 s SER 5 Cb 0.00 -1.08 -0.04 0.00 -1.71 0.00 0.00 66.02 63.19 2ej4 s SER 5 CO 0.00 -0.33 0.08 -0.94 1.20 0.00 0.00 173.24 173.25 2ej4 s SER 6 N 0.79 2.94 0.00 5.45 1.04 -1.26 -5.14 113.70 117.51 2ej4 s SER 6 Ca 0.14 -1.55 0.00 0.00 0.48 0.00 0.00 55.95 55.03 2ej4 s SER 6 Cb -0.22 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.15 2ej4 s SER 6 CO -0.09 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 173.97 2ej4 n GLY 7 N -0.89 0.58 3.76 7.32 0.00 -1.26 -5.07 105.19 109.62 2ej4 n GLY 7 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 2ej4 n GLY 7 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2ej4 s GLN 8 N 1.13 2.96 0.57 1.61 0.00 -1.26 -4.99 119.66 119.68 2ej4 s GLN 8 Ca 0.00 1.71 -0.18 0.00 -0.00 0.00 0.00 55.36 56.89 2ej4 s GLN 8 Cb 0.00 -1.94 -0.04 0.00 0.00 0.00 0.00 33.01 31.03 2ej4 s GLN 8 CO 0.00 -1.19 1.12 -1.25 0.00 0.00 0.00 175.29 173.98 2ej4 s PRO 9 N -3.47 3.21 0.83 9.60 0.04 -1.26 -4.97 135.00 138.98 2ej4 s PRO 9 Ca 0.75 1.55 -0.16 0.00 0.04 0.00 0.00 61.00 63.18 2ej4 s PRO 9 Cb -0.27 -1.99 -0.09 0.00 0.04 0.00 0.00 34.50 32.18 2ej4 s PRO 9 CO 0.34 -0.95 -0.17 1.51 0.04 0.00 0.00 177.00 177.77 2ej4 n ILE 10 N -1.59 0.38 -4.01 0.56 3.06 -1.26 -5.00 119.36 111.50 2ej4 n ILE 10 Ca 0.11 -0.42 -0.27 0.00 -2.50 0.00 0.00 62.75 59.67 2ej4 n ILE 10 Cb 0.51 -0.27 -0.02 0.00 0.54 0.00 0.00 39.64 40.40 2ej4 n ILE 10 CO 0.00 0.00 0.00 -1.59 -2.50 0.00 0.00 176.55 172.46 2ej4 s LYS 11 N -2.26 2.26 0.46 9.51 -2.85 -1.26 -5.15 119.74 120.45 2ej4 s LYS 11 Ca 0.52 -2.03 0.08 0.00 -1.00 0.00 0.00 55.97 53.54 2ej4 s LYS 11 Cb -0.28 -2.03 0.02 0.00 -2.06 0.00 0.00 37.83 33.48 2ej4 s LYS 11 CO 0.72 -0.51 0.56 1.14 0.10 0.00 0.00 175.35 177.35 2ej4 s GLN 12 N -4.18 2.58 -0.45 1.78 0.00 -1.26 -5.09 119.66 113.03 2ej4 s GLN 12 Ca 0.32 -1.48 0.04 0.00 -0.00 0.00 0.00 55.36 54.23 2ej4 s GLN 12 Cb -0.01 -2.58 0.12 0.00 0.00 0.00 0.00 33.01 30.54 2ej4 s GLN 12 CO 0.19 -0.41 0.18 -1.83 0.00 0.00 0.00 175.29 173.42 2ej4 s GLU 13 N -4.36 1.80 0.15 9.60 -1.05 -1.26 -4.67 118.70 118.91 2ej4 s GLU 13 Ca 0.53 -2.31 -0.31 0.00 -0.15 0.00 0.00 54.97 52.72 2ej4 s GLU 13 Cb -0.07 -3.30 -0.11 0.00 -0.44 0.00 0.00 34.13 30.22 2ej4 s GLU 13 CO 0.32 -1.04 1.74 -0.51 0.95 0.00 0.00 175.26 176.72 2ej4 s LEU 14 N 0.22 4.38 -0.21 1.83 1.43 -0.81 -4.70 118.68 120.82 2ej4 s LEU 14 Ca 0.14 2.75 -0.05 0.00 -1.03 0.00 0.00 54.13 55.94 2ej4 s LEU 14 Cb -0.23 -3.58 -0.02 0.00 0.03 0.00 0.00 46.19 42.39 2ej4 s LEU 14 CO -0.03 -0.96 -0.01 -0.44 0.23 0.00 0.00 176.35 175.14 2ej4 s SER 15 N 1.97 4.62 -0.74 2.29 0.01 -1.26 -1.08 113.70 119.51 2ej4 s SER 15 Ca 0.77 -0.29 -0.26 0.00 1.31 0.00 0.00 55.95 57.48 2ej4 s SER 15 Cb -0.46 -1.80 0.00 0.00 0.21 0.00 0.00 66.02 63.98 2ej4 s SER 15 CO 0.34 0.02 1.59 0.00 0.41 0.00 0.00 173.24 175.59 2ej4 n LYS 17 N 9.20 2.45 -3.09 0.00 4.76 -1.26 -3.53 118.16 126.69 2ej4 n LYS 17 Ca 0.17 -1.37 -0.45 0.00 -2.87 0.00 0.00 58.31 53.79 2ej4 n LYS 17 Cb 0.50 -2.27 -0.03 0.00 -1.84 0.00 0.00 35.03 31.39 2ej4 n LYS 17 CO 0.00 0.00 0.00 -0.46 -1.37 0.00 0.00 177.40 175.57 2ej4 s TRP 18 N 1.70 3.20 -0.88 2.13 -0.11 -1.26 -2.69 118.94 121.03 2ej4 s TRP 18 Ca 0.62 -1.32 -0.21 0.00 1.22 0.00 0.00 56.10 56.41 2ej4 s TRP 18 Cb 0.24 -4.08 0.09 0.00 -1.50 0.00 0.00 33.47 28.23 2ej4 s TRP 18 CO -0.02 -1.31 1.17 0.42 -4.62 0.00 0.00 176.95 172.59 2ej4 s ILE 19 N 2.18 4.40 0.00 5.86 1.01 -1.22 -1.42 121.20 132.01 2ej4 s ILE 19 Ca 0.21 -1.02 0.00 0.00 0.00 0.00 0.00 60.65 59.84 2ej4 s ILE 19 Cb -0.14 -4.83 0.00 0.00 0.01 0.00 0.00 42.46 37.50 2ej4 s ILE 19 CO -0.02 -1.61 0.00 -0.67 0.00 0.00 0.00 174.94 172.63 2ej4 n ASP 20 N 7.48 -0.39 -4.05 3.58 -0.08 -1.26 -4.43 116.55 117.41 2ej4 n ASP 20 Ca 0.19 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.34 2ej4 n ASP 20 Cb 0.49 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.83 2ej4 n ASP 20 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 2ej4 s GLU 21 N -0.58 0.49 -0.52 -0.67 2.12 -1.26 -4.81 118.70 113.47 2ej4 s GLU 21 Ca 0.00 -0.73 -0.01 0.00 0.36 0.00 0.00 54.97 54.59 2ej4 s GLU 21 Cb 0.00 -0.23 0.01 0.00 0.26 0.00 0.00 34.13 34.17 2ej4 s GLU 21 CO 0.00 0.03 0.03 0.00 -0.54 0.00 0.00 175.26 174.78 2ej4 n ALA 22 N 1.49 -0.91 -1.76 6.30 0.00 -1.26 -4.85 120.51 119.52 2ej4 n ALA 22 Ca -0.23 0.04 -0.39 0.00 0.00 0.00 0.00 53.44 52.86 2ej4 n ALA 22 Cb 0.55 -1.04 0.02 0.00 0.00 0.00 0.00 19.45 18.98 2ej4 n ALA 22 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2ej4 s GLN 23 N -5.10 3.51 0.28 0.00 0.00 -1.26 -4.85 119.66 112.24 2ej4 s GLN 23 Ca 0.03 2.26 0.08 0.00 -0.00 0.00 0.00 55.36 57.73 2ej4 s GLN 23 Cb -0.02 -2.49 0.84 0.00 0.00 0.00 0.00 33.01 31.34 2ej4 s GLN 23 CO 0.04 -0.90 1.29 1.28 0.00 0.00 0.00 175.29 177.00 2ej4 n LEU 24 N -0.51 0.07 -4.88 2.60 4.77 -1.26 -4.16 117.00 113.64 2ej4 n LEU 24 Ca 0.07 1.38 -0.36 0.00 -0.03 0.00 0.00 56.01 57.07 2ej4 n LEU 24 Cb 0.44 -0.58 -0.06 0.00 -2.33 0.00 0.00 43.42 40.89 2ej4 n LEU 24 CO 0.55 -1.46 -0.07 -0.44 -1.33 0.00 0.00 177.39 174.63 2ej4 s SER 25 N -4.83 6.51 0.13 -1.43 0.01 -1.26 -5.10 113.70 107.72 2ej4 s SER 25 Ca -0.09 0.59 0.02 0.00 1.31 0.00 0.00 55.95 57.77 2ej4 s SER 25 Cb 0.26 -2.11 -0.04 0.00 0.21 0.00 0.00 66.02 64.34 2ej4 s SER 25 CO 0.64 0.32 -0.04 -0.13 0.41 0.00 0.00 173.24 174.44 2ej4 s ARG 26 N -1.42 0.94 0.92 12.44 1.81 -1.26 -4.35 118.95 128.03 2ej4 s ARG 26 Ca 0.23 -1.41 -0.12 0.00 -1.72 0.00 0.00 55.73 52.71 2ej4 s ARG 26 Cb -0.13 -0.21 0.14 0.00 -0.45 0.00 0.00 34.95 34.30 2ej4 s ARG 26 CO 0.12 -0.07 1.09 -1.25 -0.68 0.00 0.00 175.30 174.51 2ej4 s PRO 27 N -3.87 1.03 -0.94 3.54 0.04 -1.26 -4.94 135.00 128.59 2ej4 s PRO 27 Ca 0.17 0.74 -0.14 0.00 0.04 0.00 0.00 61.00 61.81 2ej4 s PRO 27 Cb 0.06 -1.79 -0.29 0.00 0.04 0.00 0.00 34.50 32.52 2ej4 s PRO 27 CO -0.01 -2.38 2.16 1.63 0.04 0.00 0.00 177.00 178.44 2ej4 n LYS 28 N -3.96 0.00 -0.64 4.56 5.02 -1.26 -4.85 118.16 117.03 2ej4 n LYS 28 Ca 0.06 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.25 2ej4 n LYS 28 Cb 0.56 -1.07 0.08 0.00 -0.02 0.00 0.00 35.03 34.58 2ej4 n LYS 28 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 2ej4 n LYS 29 N 5.92 -0.70 -4.13 1.97 2.85 -1.26 -4.95 118.16 117.86 2ej4 n LYS 29 Ca 0.64 -0.73 -0.35 0.00 -1.05 0.00 0.00 58.31 56.82 2ej4 n LYS 29 Cb 0.11 -0.52 -0.09 0.00 -0.65 0.00 0.00 35.03 33.88 2ej4 n LYS 29 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2ej4 s SER 30 N -2.74 5.61 0.40 -5.58 1.04 -1.26 -4.24 113.70 106.93 2ej4 s SER 30 Ca 0.27 0.17 0.35 0.00 0.48 0.00 0.00 55.95 57.23 2ej4 s SER 30 Cb -0.01 -1.81 1.29 0.00 0.10 0.00 0.00 66.02 65.59 2ej4 s SER 30 CO 0.19 0.29 1.21 0.00 0.98 0.00 0.00 173.24 175.92 2ej4 n ASP 32 N -3.71 -6.21 -3.98 0.00 9.92 -1.23 -4.99 116.55 106.34 2ej4 n ASP 32 Ca 0.34 0.90 -0.12 0.00 -0.53 0.00 0.00 54.79 55.37 2ej4 n ASP 32 Cb 1.46 -2.65 -0.08 0.00 -0.64 0.00 0.00 41.12 39.21 2ej4 n ASP 32 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 2ej4 s ARG 33 N -0.67 1.41 -0.10 -1.24 1.81 -1.26 -4.96 118.95 113.94 2ej4 s ARG 33 Ca -0.05 -1.57 -0.04 0.00 -1.72 0.00 0.00 55.73 52.35 2ej4 s ARG 33 Cb 0.00 0.35 0.05 0.00 -0.45 0.00 0.00 34.95 34.90 2ej4 s ARG 33 CO 0.23 -0.52 0.22 0.95 -0.68 0.00 0.00 175.30 175.50 2ej4 s THR 34 N -3.96 -0.24 0.05 0.02 -4.23 -1.25 -3.86 115.64 102.18 2ej4 s THR 34 Ca 0.34 0.25 0.06 0.00 -1.18 0.00 0.00 61.69 61.16 2ej4 s THR 34 Cb 0.04 -0.37 -0.03 0.00 1.34 0.00 0.00 72.50 73.48 2ej4 s THR 34 CO 0.13 0.10 -0.17 -0.36 -0.54 0.00 0.00 174.62 173.78 2ej4 s PHE 35 N 1.93 1.52 -0.09 3.99 0.08 -0.24 -4.94 117.98 120.22 2ej4 s PHE 35 Ca -0.02 -0.38 0.15 0.00 0.12 0.00 0.00 56.93 56.79 2ej4 s PHE 35 Cb -0.12 -0.89 -0.23 0.00 -0.57 0.00 0.00 43.02 41.22 2ej4 s PHE 35 CO -0.08 0.08 0.54 0.43 -0.10 0.00 0.00 175.22 176.09 2ej4 n SER 36 N 1.71 0.64 -4.36 1.36 7.64 -1.26 -1.92 113.62 117.44 2ej4 n SER 36 Ca -0.18 0.30 -0.32 0.00 1.01 0.00 0.00 58.87 59.68 2ej4 n SER 36 Cb 0.54 0.26 -0.15 0.00 -1.01 0.00 0.00 64.21 63.85 2ej4 n SER 36 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2ej4 s THR 37 N -2.63 2.54 0.37 0.44 -4.23 -1.26 -4.88 115.64 105.99 2ej4 s THR 37 Ca -0.06 -0.90 0.10 0.00 -1.18 0.00 0.00 61.69 59.65 2ej4 s THR 37 Cb 0.08 -1.97 0.32 0.00 1.34 0.00 0.00 72.50 72.27 2ej4 s THR 37 CO 0.83 0.57 1.89 -0.03 -0.54 0.00 0.00 174.62 177.34 2ej4 h MET 38 N 5.85 0.64 -0.56 3.99 4.05 -2.00 -1.47 114.93 125.44 2ej4 h MET 38 Ca -0.37 -0.04 0.09 0.00 -0.28 0.00 0.00 59.70 59.10 2ej4 h MET 38 Cb 1.17 -0.14 -0.07 0.00 -0.80 0.00 0.00 31.60 31.75 2ej4 h MET 38 CO 0.49 0.42 0.16 1.25 0.23 0.00 0.00 176.91 179.47 2ej4 h HIS 39 N 0.66 0.27 -0.03 1.39 -0.00 -1.99 -2.23 115.15 113.21 2ej4 h HIS 39 Ca 0.42 0.03 0.03 0.00 -0.00 0.00 0.00 60.37 60.85 2ej4 h HIS 39 Cb 0.67 -0.04 -0.05 0.00 -0.00 0.00 0.00 27.41 28.00 2ej4 h HIS 39 CO -0.00 0.04 -0.25 0.93 -0.00 0.00 0.00 177.93 178.65 2ej4 h GLU 40 N 0.31 -0.36 -0.18 5.26 4.39 -1.67 0.17 114.58 122.51 2ej4 h GLU 40 Ca 0.28 0.02 0.05 0.00 0.34 0.00 0.00 59.36 60.06 2ej4 h GLU 40 Cb 0.37 0.08 -0.07 0.00 -0.10 0.00 0.00 28.75 29.03 2ej4 h GLU 40 CO -0.33 -0.24 -0.39 1.25 -1.16 0.00 0.00 179.01 178.14 2ej4 h LEU 41 N -0.37 -1.24 -0.99 1.33 5.85 -1.41 1.25 115.31 119.73 2ej4 h LEU 41 Ca 0.07 0.17 0.05 0.00 0.84 0.00 0.00 57.88 59.02 2ej4 h LEU 41 Cb 0.47 0.52 -0.06 0.00 0.37 0.00 0.00 40.66 41.95 2ej4 h LEU 41 CO -0.24 -0.40 0.64 0.58 -0.34 0.00 0.00 178.44 178.68 2ej4 h VAL 42 N -0.44 1.11 0.00 1.05 2.07 -1.13 0.20 116.25 119.12 2ej4 h VAL 42 Ca 0.09 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2ej4 h VAL 42 Cb 0.60 -0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 2ej4 h VAL 42 CO -0.42 0.22 0.00 0.41 0.02 0.00 0.00 177.57 177.80 2ej4 n THR 43 N -4.49 0.39 -0.02 2.57 -1.04 0.56 -3.23 114.28 109.01 2ej4 n THR 43 Ca 0.14 -0.08 -0.00 0.00 -2.04 0.00 0.00 64.05 62.07 2ej4 n THR 43 Cb 0.15 -0.62 -0.00 0.00 -1.82 0.00 0.00 70.33 68.04 2ej4 n THR 43 CO 0.00 0.00 0.00 -0.74 -0.64 0.00 0.00 175.07 173.69 2ej4 h HIS 44 N 0.00 0.00 0.00 -1.42 6.17 0.36 -3.28 115.15 116.98 2ej4 h HIS 44 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 2ej4 h HIS 44 Cb 0.57 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.50 2ej4 h HIS 44 CO 0.00 0.00 0.09 0.28 0.71 0.00 0.00 177.93 179.01 2ej4 n VAL 45 N -3.35 1.23 0.13 5.26 0.31 -0.84 0.15 118.33 121.22 2ej4 n VAL 45 Ca -0.00 0.64 -0.06 0.00 -0.01 0.00 0.00 64.34 64.91 2ej4 n VAL 45 Cb 0.01 -1.64 -0.03 0.00 -0.91 0.00 0.00 33.84 31.26 2ej4 n VAL 45 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 2ej4 h THR 46 N 0.00 0.00 0.01 2.52 2.02 -1.65 0.29 112.91 116.10 2ej4 h THR 46 Ca 0.00 -0.45 -0.32 0.00 0.77 0.00 0.00 66.41 66.41 2ej4 h THR 46 Cb 0.18 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.54 2ej4 h THR 46 CO 0.00 0.00 -1.76 1.15 0.37 0.00 0.00 175.52 175.28 2ej4 n MET 47 N -4.28 0.59 -0.28 6.66 0.00 -1.01 0.22 117.12 119.02 2ej4 n MET 47 Ca -0.05 0.44 0.09 0.00 0.00 0.00 0.00 57.70 58.18 2ej4 n MET 47 Cb 0.15 -1.66 0.24 0.00 0.00 0.00 0.00 33.22 31.95 2ej4 n MET 47 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 2ej4 h GLU 48 N -0.89 0.36 0.00 3.17 4.39 -0.52 -1.96 114.58 119.12 2ej4 h GLU 48 Ca -0.48 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.20 2ej4 h GLU 48 Cb 1.47 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 30.04 2ej4 h GLU 48 CO -0.26 0.24 0.00 0.72 -1.16 0.00 0.00 179.01 178.55 2ej4 n HIS 49 N -5.07 0.00 -0.40 4.33 8.25 -1.18 -4.69 115.22 116.45 2ej4 n HIS 49 Ca 0.18 0.00 0.32 0.00 -0.26 0.00 0.00 57.72 57.96 2ej4 n HIS 49 Cb 0.54 0.00 0.60 0.00 1.12 0.00 0.00 29.99 32.24 2ej4 n HIS 49 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2ej4 h VAL 50 N 0.00 0.21 -2.96 1.59 2.07 -0.23 -3.47 116.25 113.46 2ej4 h VAL 50 Ca 0.00 -0.06 0.23 0.00 0.82 0.00 0.00 66.70 67.69 2ej4 h VAL 50 Cb 0.00 0.03 -0.13 0.00 -1.52 0.00 0.00 31.29 29.67 2ej4 h VAL 50 CO 0.00 0.03 -1.02 0.61 0.02 0.00 0.00 177.57 177.21 2ej4 n GLY 51 N -1.47 -3.40 0.00 2.17 0.00 0.59 -4.80 105.19 98.29 2ej4 n GLY 51 Ca 0.34 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 45.29 2ej4 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ej4 n GLY 52 N -3.63 -2.56 0.04 -0.02 0.00 -1.26 -4.73 105.19 93.04 2ej4 n GLY 52 Ca -0.06 -1.29 0.09 0.00 0.00 0.00 0.00 46.02 44.76 2ej4 n GLY 52 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ej4 n PRO 53 N 0.00 0.07 -0.25 1.61 -0.04 -1.26 -2.32 135.00 132.80 2ej4 n PRO 53 Ca 0.00 0.31 0.04 0.00 -0.04 0.00 0.00 63.50 63.82 2ej4 n PRO 53 Cb 0.00 -1.63 0.15 0.00 -0.04 0.00 0.00 33.50 31.99 2ej4 n PRO 53 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2ej4 n GLU 54 N -1.75 2.11 -3.57 0.54 1.02 -1.26 -4.87 120.64 112.85 2ej4 n GLU 54 Ca 0.03 -1.23 -0.37 0.00 -0.02 0.00 0.00 57.16 55.58 2ej4 n GLU 54 Cb 0.19 -1.48 -0.06 0.00 -0.02 0.00 0.00 31.44 30.07 2ej4 n GLU 54 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2ej4 s GLN 55 N -1.65 3.80 -0.42 3.49 -0.44 -0.98 -5.06 119.66 118.40 2ej4 s GLN 55 Ca 0.22 0.26 -0.14 0.00 -2.50 0.00 0.00 55.36 53.21 2ej4 s GLN 55 Cb 0.14 -3.15 0.04 0.00 -1.64 0.00 0.00 33.01 28.40 2ej4 s GLN 55 CO 0.11 0.66 0.31 1.21 0.50 0.00 0.00 175.29 178.08 2ej4 s ASN 56 N -1.30 6.00 0.00 6.67 2.47 -1.26 -4.88 114.94 122.65 2ej4 s ASN 56 Ca 0.26 -1.11 0.00 0.00 0.42 0.00 0.00 52.86 52.42 2ej4 s ASN 56 Cb -0.15 -2.12 0.00 0.00 -1.45 0.00 0.00 41.25 37.53 2ej4 s ASN 56 CO 0.14 -0.51 0.00 -3.20 -3.72 0.00 0.00 177.10 169.81 2ej4 n ASN 57 N 5.12 -1.96 -4.10 -4.21 2.85 -1.26 -5.03 115.26 106.67 2ej4 n ASN 57 Ca -0.11 0.00 -0.33 0.00 -0.11 0.00 0.00 54.58 54.03 2ej4 n ASN 57 Cb 0.45 -0.18 -0.15 0.00 1.24 0.00 0.00 39.78 41.14 2ej4 n ASN 57 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 2ej4 s HIS 58 N -0.40 3.02 0.06 1.20 3.76 -1.26 -5.06 115.29 116.61 2ej4 s HIS 58 Ca 0.00 -1.95 0.03 0.00 -0.15 0.00 0.00 55.06 52.99 2ej4 s HIS 58 Cb 0.00 -1.93 -0.03 0.00 1.11 0.00 0.00 32.58 31.73 2ej4 s HIS 58 CO 0.00 -0.84 -0.10 0.08 -0.85 0.00 0.00 174.74 173.03 2ej4 s VAL 59 N 1.21 0.76 -0.41 -0.90 1.01 -1.26 -4.19 120.40 116.62 2ej4 s VAL 59 Ca -0.02 -1.24 -0.23 0.00 0.00 0.00 0.00 61.98 60.50 2ej4 s VAL 59 Cb -0.16 -0.86 0.02 0.00 0.00 0.00 0.00 36.38 35.37 2ej4 s VAL 59 CO -0.09 -0.37 0.76 0.00 0.00 0.00 0.00 175.10 175.41 2ej4 s TYR 61 N 3.14 3.07 0.22 0.00 2.02 -1.26 -3.63 117.35 120.91 2ej4 s TYR 61 Ca 0.30 -1.07 -0.09 0.00 -0.37 0.00 0.00 57.07 55.83 2ej4 s TYR 61 Cb -0.13 -2.16 -0.01 0.00 -0.40 0.00 0.00 41.96 39.25 2ej4 s TYR 61 CO 0.20 -0.59 0.36 -0.46 -1.57 0.00 0.00 175.55 173.48 2ej4 s TRP 62 N 1.46 0.58 0.05 2.71 -0.11 -1.26 -3.44 118.94 118.93 2ej4 s TRP 62 Ca 0.03 -0.91 -0.15 0.00 1.22 0.00 0.00 56.10 56.29 2ej4 s TRP 62 Cb -0.16 -0.04 -0.31 0.00 -1.50 0.00 0.00 33.47 31.46 2ej4 s TRP 62 CO -0.01 -0.86 1.07 1.49 -4.62 0.00 0.00 176.95 174.02 2ej4 h GLU 63 N 2.39 0.61 -2.16 5.86 4.81 -1.88 -3.40 114.58 120.81 2ej4 h GLU 63 Ca -0.29 -0.86 -0.58 0.00 -0.13 0.00 0.00 59.36 57.49 2ej4 h GLU 63 Cb 1.25 0.29 -0.41 0.00 0.63 0.00 0.00 28.75 30.52 2ej4 h GLU 63 CO 0.42 1.40 -0.82 0.39 -0.73 0.00 0.00 179.01 179.66 2ej4 n GLU 64 N -3.78 1.65 -4.77 1.92 1.02 -1.26 -5.09 120.64 110.33 2ej4 n GLU 64 Ca -0.15 -4.00 -0.32 0.00 -0.02 0.00 0.00 57.16 52.67 2ej4 n GLU 64 Cb 1.02 -1.80 -0.13 0.00 -0.02 0.00 0.00 31.44 30.51 2ej4 n GLU 64 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ej4 h PRO 66 N 5.01 0.90 0.00 0.00 0.13 -1.98 -2.98 132.00 133.08 2ej4 h PRO 66 Ca -0.47 -0.48 -0.01 0.00 -0.87 0.00 0.00 66.00 64.17 2ej4 h PRO 66 Cb 1.15 0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2ej4 h PRO 66 CO 0.50 1.13 -0.05 0.00 -0.23 0.00 0.00 178.00 179.35 2ej4 h ARG 67 N 0.71 0.00 0.00 0.86 3.08 -1.96 -3.47 114.38 113.61 2ej4 h ARG 67 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2ej4 h ARG 67 Cb 0.96 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.01 2ej4 h ARG 67 CO 0.09 0.05 0.00 0.39 -1.07 0.00 0.00 179.97 179.43 2ej4 n GLU 68 N -3.15 0.00 -1.51 0.04 1.02 -1.13 -3.01 120.64 112.91 2ej4 n GLU 68 Ca 0.01 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.13 2ej4 n GLU 68 Cb 0.36 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 31.80 2ej4 n GLU 68 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ej4 n GLY 69 N 0.00 0.39 3.66 0.62 0.00 -1.24 -4.46 105.19 104.16 2ej4 n GLY 69 Ca 0.00 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 2ej4 n GLY 69 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2ej4 n LYS 70 N -0.46 1.18 -0.11 1.61 2.85 -1.16 -4.48 118.16 117.59 2ej4 n LYS 70 Ca -0.13 0.45 0.12 0.00 -1.05 0.00 0.00 58.31 57.70 2ej4 n LYS 70 Cb 0.61 -2.30 0.24 0.00 -0.65 0.00 0.00 35.03 32.93 2ej4 n LYS 70 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2ej4 n SER 71 N -0.81 2.87 -0.88 -5.58 2.88 -1.26 -2.15 113.62 108.69 2ej4 n SER 71 Ca 0.13 -1.91 0.11 0.00 -1.33 0.00 0.00 58.87 55.87 2ej4 n SER 71 Cb 0.46 -0.15 -0.03 0.00 -0.75 0.00 0.00 64.21 63.74 2ej4 n SER 71 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2ej4 n PHE 72 N 1.14 -2.91 -0.03 0.66 3.01 -1.26 -4.61 117.46 113.47 2ej4 n PHE 72 Ca 0.17 1.03 0.02 0.00 1.01 0.00 0.00 57.45 59.68 2ej4 n PHE 72 Cb 0.53 -1.88 -0.10 0.00 -0.01 0.00 0.00 39.48 38.02 2ej4 n PHE 72 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 2ej4 n LYS 73 N -2.70 0.97 -4.40 -1.08 4.81 -1.26 -5.03 118.16 109.47 2ej4 n LYS 73 Ca 0.01 -0.08 -0.20 0.00 -0.87 0.00 0.00 58.31 57.17 2ej4 n LYS 73 Cb 0.38 -1.32 -0.10 0.00 0.02 0.00 0.00 35.03 34.00 2ej4 n LYS 73 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2ej4 s ALA 74 N -2.71 2.14 0.00 3.14 0.00 -1.26 -5.09 121.76 117.97 2ej4 s ALA 74 Ca -0.05 -1.95 0.00 0.00 0.00 0.00 0.00 51.96 49.95 2ej4 s ALA 74 Cb 0.07 0.64 0.00 0.00 0.00 0.00 0.00 23.12 23.83 2ej4 s ALA 74 CO 0.55 -0.30 0.23 1.17 0.00 0.00 0.00 175.76 177.41 2ej4 n LYS 75 N -0.58 0.00 -0.30 0.00 4.81 -1.26 -3.67 118.16 117.15 2ej4 n LYS 75 Ca -0.03 0.30 0.34 0.00 -0.87 0.00 0.00 58.31 58.05 2ej4 n LYS 75 Cb 0.66 -0.94 0.61 0.00 0.02 0.00 0.00 35.03 35.37 2ej4 n LYS 75 CO 0.00 0.00 0.00 0.10 1.17 0.00 0.00 177.40 178.67 2ej4 h TYR 76 N 0.00 0.00 -0.69 5.64 -0.00 -2.00 0.60 116.97 120.52 2ej4 h TYR 76 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 58.73 58.80 2ej4 h TYR 76 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 36.73 36.67 2ej4 h TYR 76 CO 0.04 0.00 0.38 0.87 -0.00 0.00 0.00 178.16 179.45 2ej4 h LYS 77 N 0.00 0.66 0.18 0.10 1.57 -1.99 -1.61 116.57 115.49 2ej4 h LYS 77 Ca 0.57 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.30 2ej4 h LYS 77 Cb 2.81 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 34.97 2ej4 h LYS 77 CO -0.01 0.44 -0.16 1.25 -0.57 0.00 0.00 179.45 180.40 2ej4 h LEU 78 N 0.68 -0.44 -1.72 2.94 5.85 0.12 -1.82 115.31 120.92 2ej4 h LEU 78 Ca 0.32 0.03 0.32 0.00 0.84 0.00 0.00 57.88 59.39 2ej4 h LEU 78 Cb 0.23 0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.33 2ej4 h LEU 78 CO -0.20 -0.22 0.78 0.58 -0.34 0.00 0.00 178.44 179.03 2ej4 h VAL 79 N -0.34 0.44 -0.19 1.05 2.07 -1.65 0.18 116.25 117.81 2ej4 h VAL 79 Ca -0.02 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 2ej4 h VAL 79 Cb 0.29 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2ej4 h VAL 79 CO -0.01 0.03 0.09 0.78 0.02 0.00 0.00 177.57 178.48 2ej4 h ASN 80 N 0.16 0.25 -0.09 0.57 2.35 -0.69 -2.84 115.58 115.29 2ej4 h ASN 80 Ca 0.59 -0.12 -0.17 0.00 -0.55 0.00 0.00 56.30 56.05 2ej4 h ASN 80 Cb 1.98 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 40.28 2ej4 h ASN 80 CO -0.14 0.30 -0.54 -0.74 -1.65 0.00 0.00 177.43 174.66 2ej4 h HIS 81 N 0.18 0.84 -0.87 1.19 2.76 0.08 -3.16 115.15 116.17 2ej4 h HIS 81 Ca 0.07 -0.29 0.18 0.00 -2.20 0.00 0.00 60.37 58.12 2ej4 h HIS 81 Cb 0.12 -0.16 -0.11 0.00 1.55 0.00 0.00 27.41 28.81 2ej4 h HIS 81 CO -0.03 1.06 0.42 0.82 -1.30 0.00 0.00 177.93 178.90 2ej4 h ILE 82 N 0.52 0.61 -0.71 6.26 2.04 -0.90 -1.11 117.51 124.23 2ej4 h ILE 82 Ca 0.01 -0.18 0.14 0.00 1.00 0.00 0.00 64.86 65.84 2ej4 h ILE 82 Cb 1.10 0.04 -0.14 0.00 -0.74 0.00 0.00 36.82 37.09 2ej4 h ILE 82 CO 0.11 0.10 -0.18 0.03 0.00 0.00 0.00 178.15 178.20 2ej4 h ARG 83 N 0.53 -0.00 -1.19 2.37 3.08 -1.47 0.49 114.38 118.18 2ej4 h ARG 83 Ca 0.51 0.00 0.35 0.00 0.07 0.00 0.00 59.98 60.90 2ej4 h ARG 83 Cb 0.84 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.80 2ej4 h ARG 83 CO -0.44 -0.00 0.79 -0.24 -1.07 0.00 0.00 179.97 179.01 2ej4 h VAL 84 N -0.00 0.36 0.02 2.04 3.04 -1.36 -1.08 116.25 119.26 2ej4 h VAL 84 Ca 0.34 -0.07 -0.00 0.00 -1.01 0.00 0.00 66.70 65.96 2ej4 h VAL 84 Cb 0.52 0.13 0.00 0.00 -2.01 0.00 0.00 31.29 29.93 2ej4 h VAL 84 CO -0.73 0.04 -0.01 0.45 -1.01 0.00 0.00 177.57 176.31 2ej4 h HIS 85 N 0.21 -0.02 -1.05 3.17 3.86 -0.15 -3.32 115.15 117.85 2ej4 h HIS 85 Ca 0.67 -0.00 0.38 0.00 -1.16 0.00 0.00 60.37 60.27 2ej4 h HIS 85 Cb 2.07 0.01 -0.16 0.00 1.06 0.00 0.00 27.41 30.39 2ej4 h HIS 85 CO -0.00 0.47 0.60 1.79 0.86 0.00 0.00 177.93 181.65 2ej4 h THR 86 N -0.99 0.13 0.00 2.45 1.35 -0.27 -3.44 112.91 112.14 2ej4 h THR 86 Ca -0.00 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.81 2ej4 h THR 86 Cb 0.50 -0.02 0.00 0.00 -1.73 0.00 0.00 68.15 66.91 2ej4 h THR 86 CO 0.00 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 175.91 2ej4 n GLY 87 N -1.31 0.55 0.00 5.82 0.00 -0.66 -5.09 105.19 104.51 2ej4 n GLY 87 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.37 2ej4 n GLY 87 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2ej4 n GLU 88 N -1.59 2.70 -0.83 1.61 0.00 -1.24 -4.98 120.64 116.31 2ej4 n GLU 88 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 57.16 56.82 2ej4 n GLU 88 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 31.44 31.55 2ej4 n GLU 88 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.13 177.49 2ej4 n LYS 89 N 0.00 -0.46 -3.30 5.31 2.85 -1.26 -4.89 118.16 116.42 2ej4 n LYS 89 Ca 0.00 -0.11 0.00 0.00 -1.05 0.00 0.00 58.31 57.15 2ej4 n LYS 89 Cb 0.00 -1.60 0.00 0.00 -0.65 0.00 0.00 35.03 32.78 2ej4 n LYS 89 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 2ej4 n SER 90 N -0.09 0.00 0.00 -5.58 7.64 -1.26 -4.49 113.62 109.84 2ej4 n SER 90 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.91 2ej4 n SER 90 Cb 0.57 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 2ej4 n SER 90 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ej4 n GLY 91 N 0.00 0.55 3.77 0.23 0.00 -1.26 -5.13 105.19 103.36 2ej4 n GLY 91 Ca 0.00 -1.70 -0.36 0.00 0.00 0.00 0.00 46.02 43.96 2ej4 n GLY 91 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ej4 s PRO 92 N -1.44 3.55 -1.36 1.61 0.04 -1.26 -4.94 135.00 131.20 2ej4 s PRO 92 Ca 0.00 1.69 -0.11 0.00 0.04 0.00 0.00 61.00 62.62 2ej4 s PRO 92 Cb 0.00 -2.20 0.11 0.00 0.04 0.00 0.00 34.50 32.45 2ej4 s PRO 92 CO 0.00 -0.71 2.05 -1.13 0.04 0.00 0.00 177.00 177.25 2ej4 n SER 93 N -0.91 4.64 0.00 6.66 3.41 -1.26 -4.93 113.62 121.24 2ej4 n SER 93 Ca 0.10 -2.99 0.00 0.00 -0.26 0.00 0.00 58.87 55.72 2ej4 n SER 93 Cb 0.50 -1.55 0.00 0.00 -0.26 0.00 0.00 64.21 62.89 2ej4 n SER 93 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2ej4 n SER 94 N 4.78 -0.84 0.00 4.04 7.64 -1.26 -5.37 113.62 122.60 2ej4 n SER 94 Ca 0.46 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.34 2ej4 n SER 94 Cb 0.37 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 2ej4 n SER 94 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64