#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 0.89 0.09 1.61 0.01 -1.26 -5.14 113.70 109.89 2ej4 s SER 2 Ca 0.00 0.14 -0.26 0.00 1.31 0.00 0.00 55.95 57.14 2ej4 s SER 2 Cb 0.00 0.52 0.08 0.00 0.21 0.00 0.00 66.02 66.83 2ej4 s SER 2 CO 0.00 -0.29 0.83 -0.55 0.41 0.00 0.00 173.24 173.65 2ej4 s SER 3 N 2.37 -0.35 -0.03 2.44 0.15 -1.26 -5.18 113.70 111.83 2ej4 s SER 3 Ca 0.05 -0.14 -0.06 0.00 0.70 0.00 0.00 55.95 56.50 2ej4 s SER 3 Cb -0.14 0.48 0.01 0.00 -1.71 0.00 0.00 66.02 64.66 2ej4 s SER 3 CO -0.10 -0.82 0.14 -0.83 1.20 0.00 0.00 173.24 172.83 2ej4 s GLY 4 N -2.68 -0.04 0.30 9.45 0.00 -1.26 -5.16 107.32 107.93 2ej4 s GLY 4 Ca 0.06 0.18 -0.19 0.00 0.00 0.00 0.00 44.72 44.77 2ej4 s GLY 4 CO -0.06 0.09 0.83 -1.35 0.00 0.00 0.00 173.10 172.61 2ej4 s SER 5 N -0.51 -0.09 0.00 1.64 1.04 -1.26 -5.19 113.70 109.33 2ej4 s SER 5 Ca -0.06 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.53 2ej4 s SER 5 Cb -0.04 0.72 0.00 0.00 0.10 0.00 0.00 66.02 66.80 2ej4 s SER 5 CO 0.01 -1.39 0.00 -0.24 0.98 0.00 0.00 173.24 172.59 2ej4 n SER 6 N -1.01 0.00 -0.13 7.02 2.88 -1.26 -5.18 113.62 115.94 2ej4 n SER 6 Ca -0.06 -0.27 0.00 0.00 -1.33 0.00 0.00 58.87 57.21 2ej4 n SER 6 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 2ej4 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ej4 n GLY 7 N 0.00 1.00 3.59 0.46 0.00 -1.26 -5.13 105.19 103.85 2ej4 n GLY 7 Ca 0.00 -1.40 -0.11 0.00 0.00 0.00 0.00 46.02 44.52 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 0.59 0.60 0.58 1.61 -2.07 -1.26 -5.17 119.66 114.55 2ej4 s GLN 8 Ca 0.00 0.24 -0.18 0.00 -1.82 0.00 0.00 55.36 53.60 2ej4 s GLN 8 Cb 0.00 0.29 -0.04 0.00 -1.09 0.00 0.00 33.01 32.17 2ej4 s GLN 8 CO 0.00 -0.17 1.12 -1.25 -1.32 0.00 0.00 175.29 173.67 2ej4 s PRO 9 N -0.86 3.19 1.07 9.60 0.04 -1.26 -5.00 135.00 141.79 2ej4 s PRO 9 Ca -0.01 1.54 -0.16 0.00 0.04 0.00 0.00 61.00 62.40 2ej4 s PRO 9 Cb -0.01 -1.99 0.10 0.00 0.04 0.00 0.00 34.50 32.64 2ej4 s PRO 9 CO 0.01 -0.96 0.21 1.51 0.04 0.00 0.00 177.00 177.80 2ej4 n ILE 10 N -1.64 0.00 -4.20 0.56 3.06 -1.26 -5.04 119.36 110.84 2ej4 n ILE 10 Ca 0.11 -0.28 -0.09 0.00 -2.50 0.00 0.00 62.75 60.00 2ej4 n ILE 10 Cb 0.51 -0.65 -0.02 0.00 0.54 0.00 0.00 39.64 40.03 2ej4 n ILE 10 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 2ej4 n LYS 11 N -2.23 1.20 -1.95 9.51 4.76 -1.26 -5.16 118.16 123.03 2ej4 n LYS 11 Ca 0.03 -1.13 -0.29 0.00 -2.87 0.00 0.00 58.31 54.05 2ej4 n LYS 11 Cb 0.59 0.46 0.10 0.00 -1.84 0.00 0.00 35.03 34.34 2ej4 n LYS 11 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 2ej4 s GLN 12 N -2.54 1.87 -0.60 1.97 0.00 -1.26 -5.00 119.66 114.09 2ej4 s GLN 12 Ca 0.03 -0.00 -0.11 0.00 -0.00 0.00 0.00 55.36 55.28 2ej4 s GLN 12 Cb 0.00 -1.97 0.15 0.00 0.00 0.00 0.00 33.01 31.19 2ej4 s GLN 12 CO 0.02 -1.62 0.50 -1.83 0.00 0.00 0.00 175.29 172.36 2ej4 s GLU 13 N -5.56 2.89 0.10 9.60 -1.05 -1.26 -4.14 118.70 119.29 2ej4 s GLU 13 Ca 0.63 -2.06 -0.30 0.00 -0.15 0.00 0.00 54.97 53.09 2ej4 s GLU 13 Cb -0.10 -4.10 -0.06 0.00 -0.44 0.00 0.00 34.13 29.43 2ej4 s GLU 13 CO 0.49 -1.24 0.99 -0.51 0.95 0.00 0.00 175.26 175.94 2ej4 s LEU 14 N 0.86 4.47 -0.04 1.83 1.43 0.06 -4.80 118.68 122.49 2ej4 s LEU 14 Ca 0.10 1.82 0.02 0.00 -1.03 0.00 0.00 54.13 55.04 2ej4 s LEU 14 Cb -0.22 -3.59 -0.03 0.00 0.03 0.00 0.00 46.19 42.39 2ej4 s LEU 14 CO -0.03 -0.14 -0.08 -0.44 0.23 0.00 0.00 176.35 175.90 2ej4 s SER 15 N 0.21 4.55 -0.68 2.29 0.01 -1.26 -1.11 113.70 117.71 2ej4 s SER 15 Ca 0.49 -0.10 -0.15 0.00 1.31 0.00 0.00 55.95 57.50 2ej4 s SER 15 Cb -0.24 -1.09 0.17 0.00 0.21 0.00 0.00 66.02 65.08 2ej4 s SER 15 CO 0.30 0.33 0.63 0.00 0.41 0.00 0.00 173.24 174.91 2ej4 n LYS 17 N 4.64 2.89 -3.37 0.00 4.76 -1.26 -3.11 118.16 122.72 2ej4 n LYS 17 Ca -0.01 -1.81 -0.46 0.00 -2.87 0.00 0.00 58.31 53.17 2ej4 n LYS 17 Cb 0.43 -2.61 -0.04 0.00 -1.84 0.00 0.00 35.03 30.98 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 2.69 3.60 -0.43 2.13 -0.11 -1.26 -2.89 118.94 122.67 2ej4 s TRP 18 Ca 0.56 -1.88 -0.29 0.00 1.22 0.00 0.00 56.10 55.71 2ej4 s TRP 18 Cb 0.15 -3.75 0.02 0.00 -1.50 0.00 0.00 33.47 28.39 2ej4 s TRP 18 CO -0.05 -0.99 1.23 0.42 -4.62 0.00 0.00 176.95 172.95 2ej4 s ILE 19 N 0.54 4.13 0.52 5.86 1.01 -1.26 -0.97 121.20 131.03 2ej4 s ILE 19 Ca 0.14 1.18 -0.09 0.00 0.00 0.00 0.00 60.65 61.88 2ej4 s ILE 19 Cb -0.16 -4.43 0.13 0.00 0.01 0.00 0.00 42.46 38.00 2ej4 s ILE 19 CO -0.05 -0.85 0.51 -0.67 0.00 0.00 0.00 174.94 173.88 2ej4 n ASP 20 N 8.05 -1.15 -3.91 3.58 2.03 -1.25 -4.51 116.55 119.39 2ej4 n ASP 20 Ca 0.14 -0.89 -0.15 0.00 0.52 0.00 0.00 54.79 54.41 2ej4 n ASP 20 Cb 0.48 -0.45 -0.14 0.00 -0.72 0.00 0.00 41.12 40.29 2ej4 n ASP 20 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 2ej4 s GLU 21 N -4.15 0.26 -1.34 -0.67 2.12 -1.26 -4.79 118.70 108.87 2ej4 s GLU 21 Ca 0.32 -0.09 0.00 0.00 0.36 0.00 0.00 54.97 55.56 2ej4 s GLU 21 Cb -0.03 -0.27 0.00 0.00 0.26 0.00 0.00 34.13 34.09 2ej4 s GLU 21 CO 0.24 0.04 0.00 0.00 -0.54 0.00 0.00 175.26 175.00 2ej4 n ALA 22 N 3.15 -0.19 -1.01 6.30 0.00 -1.26 -4.95 120.51 122.54 2ej4 n ALA 22 Ca -0.14 0.20 -0.33 0.00 0.00 0.00 0.00 53.44 53.17 2ej4 n ALA 22 Cb 0.58 -1.60 0.13 0.00 0.00 0.00 0.00 19.45 18.56 2ej4 n ALA 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ej4 n GLN 23 N -1.92 0.03 -0.33 0.00 0.00 -1.26 -4.90 117.38 109.01 2ej4 n GLN 23 Ca -0.13 0.09 0.01 0.00 0.00 0.00 0.00 57.00 56.96 2ej4 n GLN 23 Cb 0.50 -2.34 0.18 0.00 0.00 0.00 0.00 30.24 28.58 2ej4 n GLN 23 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 2ej4 h LEU 24 N -1.11 1.02 -9.43 2.61 4.07 -2.01 -3.41 115.31 107.06 2ej4 h LEU 24 Ca -0.45 -0.01 -0.60 0.00 0.08 0.00 0.00 57.88 56.90 2ej4 h LEU 24 Cb 1.30 -0.24 -0.08 0.00 1.08 0.00 0.00 40.66 42.71 2ej4 h LEU 24 CO 0.44 0.71 -0.25 -0.44 -1.08 0.00 0.00 178.44 177.82 2ej4 s SER 25 N -6.12 6.60 0.18 -0.43 0.01 -1.26 -5.09 113.70 107.60 2ej4 s SER 25 Ca -0.12 0.71 0.05 0.00 1.31 0.00 0.00 55.95 57.89 2ej4 s SER 25 Cb 0.19 -2.22 -0.05 0.00 0.21 0.00 0.00 66.02 64.15 2ej4 s SER 25 CO 0.81 0.16 -0.08 -0.13 0.41 0.00 0.00 173.24 174.40 2ej4 s ARG 26 N -0.01 1.20 0.89 12.44 1.81 -1.26 -4.31 118.95 129.70 2ej4 s ARG 26 Ca 0.21 -1.55 -0.11 0.00 -1.72 0.00 0.00 55.73 52.56 2ej4 s ARG 26 Cb -0.14 -0.71 0.12 0.00 -0.45 0.00 0.00 34.95 33.77 2ej4 s ARG 26 CO 0.08 0.04 1.09 -1.25 -0.68 0.00 0.00 175.30 174.58 2ej4 s PRO 27 N -3.77 1.34 -0.92 3.54 0.04 -1.26 -4.95 135.00 129.03 2ej4 s PRO 27 Ca 0.21 0.85 -0.15 0.00 0.04 0.00 0.00 61.00 61.95 2ej4 s PRO 27 Cb 0.03 -1.82 -0.28 0.00 0.04 0.00 0.00 34.50 32.48 2ej4 s PRO 27 CO 0.04 -2.19 2.15 1.63 0.04 0.00 0.00 177.00 178.67 2ej4 n LYS 28 N -3.85 0.00 -2.15 4.56 5.02 -1.26 -4.85 118.16 115.63 2ej4 n LYS 28 Ca 0.07 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.10 2ej4 n LYS 28 Cb 0.55 -1.07 0.07 0.00 -0.02 0.00 0.00 35.03 34.56 2ej4 n LYS 28 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2ej4 s LYS 29 N 7.07 2.16 0.08 1.97 1.02 -1.26 -4.90 119.74 125.88 2ej4 s LYS 29 Ca 1.23 -0.19 -0.25 0.00 0.02 0.00 0.00 55.97 56.79 2ej4 s LYS 29 Cb -0.91 -2.13 -0.06 0.00 -0.52 0.00 0.00 37.83 34.21 2ej4 s LYS 29 CO 0.50 -1.30 0.76 -1.54 -0.92 0.00 0.00 175.35 172.85 2ej4 s SER 30 N -4.53 7.25 0.18 2.83 1.04 -1.26 -3.80 113.70 115.42 2ej4 s SER 30 Ca 0.60 1.49 -0.10 0.00 0.48 0.00 0.00 55.95 58.43 2ej4 s SER 30 Cb -0.11 -2.47 0.25 0.00 0.10 0.00 0.00 66.02 63.79 2ej4 s SER 30 CO 0.45 0.08 1.13 0.00 0.98 0.00 0.00 173.24 175.88 2ej4 n ASP 32 N -5.12 -5.06 -3.67 0.00 -0.08 -1.18 -5.02 116.55 96.42 2ej4 n ASP 32 Ca 0.09 0.58 -0.02 0.00 -1.51 0.00 0.00 54.79 53.93 2ej4 n ASP 32 Cb 0.32 -2.21 -0.01 0.00 2.34 0.00 0.00 41.12 41.56 2ej4 n ASP 32 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 2ej4 s ARG 33 N -2.54 0.85 -0.15 -0.67 6.06 -1.26 -4.88 118.95 116.37 2ej4 s ARG 33 Ca 0.00 -0.45 -0.04 0.00 -2.50 0.00 0.00 55.73 52.74 2ej4 s ARG 33 Cb 0.00 0.30 0.05 0.00 0.06 0.00 0.00 34.95 35.37 2ej4 s ARG 33 CO 0.00 -0.39 0.07 0.95 -2.50 0.00 0.00 175.30 173.43 2ej4 s THR 34 N -2.95 0.05 0.25 4.11 -4.23 -1.25 -4.13 115.64 107.49 2ej4 s THR 34 Ca 0.12 -0.12 0.11 0.00 -1.18 0.00 0.00 61.69 60.62 2ej4 s THR 34 Cb 0.01 -0.59 -0.05 0.00 1.34 0.00 0.00 72.50 73.21 2ej4 s THR 34 CO -0.01 -0.16 -0.16 -0.36 -0.54 0.00 0.00 174.62 173.39 2ej4 s PHE 35 N 2.08 2.41 -0.22 3.99 0.08 -0.27 -4.90 117.98 121.16 2ej4 s PHE 35 Ca 0.02 -0.30 0.08 0.00 0.12 0.00 0.00 56.93 56.85 2ej4 s PHE 35 Cb -0.15 -1.10 -0.19 0.00 -0.57 0.00 0.00 43.02 41.01 2ej4 s PHE 35 CO -0.08 0.63 -0.11 0.43 -0.10 0.00 0.00 175.22 176.00 2ej4 n SER 36 N -0.41 1.46 -4.60 1.36 7.64 -1.26 -0.76 113.62 117.05 2ej4 n SER 36 Ca -0.08 -0.08 -0.31 0.00 1.01 0.00 0.00 58.87 59.41 2ej4 n SER 36 Cb 0.58 0.14 -0.10 0.00 -1.01 0.00 0.00 64.21 63.82 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 -2.47 3.59 0.48 0.44 -4.23 -1.26 -4.21 115.64 107.98 2ej4 s THR 37 Ca -0.23 -0.94 0.17 0.00 -1.18 0.00 0.00 61.69 59.50 2ej4 s THR 37 Cb 0.07 -2.61 0.23 0.00 1.34 0.00 0.00 72.50 71.53 2ej4 s THR 37 CO 0.64 0.29 2.06 -0.03 -0.54 0.00 0.00 174.62 177.03 2ej4 h MET 38 N 4.16 0.00 -0.18 3.99 4.05 -1.97 -2.72 114.93 122.24 2ej4 h MET 38 Ca -0.48 0.00 0.02 0.00 -0.28 0.00 0.00 59.70 58.96 2ej4 h MET 38 Cb 1.17 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.95 2ej4 h MET 38 CO 0.54 0.11 0.05 1.25 0.23 0.00 0.00 176.91 179.10 2ej4 h HIS 39 N 0.00 0.10 0.02 1.39 -0.00 -1.99 -2.68 115.15 111.97 2ej4 h HIS 39 Ca -0.00 0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.40 2ej4 h HIS 39 Cb 0.21 -0.02 -0.05 0.00 -0.00 0.00 0.00 27.41 27.55 2ej4 h HIS 39 CO 0.00 0.04 -0.52 0.93 -0.00 0.00 0.00 177.93 178.39 2ej4 h GLU 40 N 0.14 -0.64 -0.80 5.26 4.39 -1.89 0.18 114.58 121.22 2ej4 h GLU 40 Ca 0.08 0.04 0.18 0.00 0.34 0.00 0.00 59.36 60.01 2ej4 h GLU 40 Cb 0.06 0.15 -0.14 0.00 -0.10 0.00 0.00 28.75 28.71 2ej4 h GLU 40 CO -0.09 -0.43 -0.05 1.25 -1.16 0.00 0.00 179.01 178.54 2ej4 h LEU 41 N -0.66 -0.47 -0.72 1.33 5.85 -1.59 1.39 115.31 120.44 2ej4 h LEU 41 Ca 0.01 0.22 -0.05 0.00 0.84 0.00 0.00 57.88 58.90 2ej4 h LEU 41 Cb 0.70 0.40 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 2ej4 h LEU 41 CO -0.34 -0.22 0.27 0.58 -0.34 0.00 0.00 178.44 178.39 2ej4 h VAL 42 N 0.06 1.25 0.00 1.05 2.07 -0.99 -2.03 116.25 117.67 2ej4 h VAL 42 Ca 0.43 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 67.13 2ej4 h VAL 42 Cb 0.75 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2ej4 h VAL 42 CO -0.74 0.33 0.00 0.41 0.02 0.00 0.00 177.57 177.59 2ej4 n THR 43 N -4.33 0.59 -0.01 2.57 -1.04 0.10 -3.26 114.28 108.91 2ej4 n THR 43 Ca 0.06 -0.21 -0.00 0.00 -2.04 0.00 0.00 64.05 61.85 2ej4 n THR 43 Cb 0.19 -0.65 -0.00 0.00 -1.82 0.00 0.00 70.33 68.05 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 -0.03 0.00 -1.42 6.17 0.23 -3.28 115.15 116.83 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 0.68 0.01 0.00 0.00 2.52 0.00 0.00 27.41 30.62 2ej4 h HIS 44 CO 0.00 -0.02 0.12 0.28 0.71 0.00 0.00 177.93 179.02 2ej4 n VAL 45 N -3.29 1.15 0.11 5.26 0.31 -0.85 0.20 118.33 121.22 2ej4 n VAL 45 Ca -0.00 0.65 -0.05 0.00 -0.01 0.00 0.00 64.34 64.93 2ej4 n VAL 45 Cb 0.01 -1.65 -0.02 0.00 -0.91 0.00 0.00 33.84 31.27 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 0.03 2.52 2.02 -1.63 0.27 112.91 116.12 2ej4 h THR 46 Ca 0.00 -0.32 -0.31 0.00 0.77 0.00 0.00 66.41 66.54 2ej4 h THR 46 Cb 0.24 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.61 2ej4 h THR 46 CO 0.00 0.00 -1.72 1.15 0.37 0.00 0.00 175.52 175.32 2ej4 n MET 47 N -3.76 0.63 -0.35 6.66 0.00 -1.02 0.68 117.12 119.96 2ej4 n MET 47 Ca -0.04 0.42 0.13 0.00 0.00 0.00 0.00 57.70 58.21 2ej4 n MET 47 Cb 0.13 -1.69 0.33 0.00 0.00 0.00 0.00 33.22 31.99 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 -0.65 0.73 0.00 3.17 4.39 -0.48 -2.14 114.58 119.60 2ej4 h GLU 48 Ca -0.44 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.22 2ej4 h GLU 48 Cb 1.59 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 30.07 2ej4 h GLU 48 CO -0.15 0.48 0.00 0.72 -1.16 0.00 0.00 179.01 178.90 2ej4 n HIS 49 N -4.76 0.00 -0.02 4.33 8.25 -1.19 -4.68 115.22 117.14 2ej4 n HIS 49 Ca 0.23 0.00 0.21 0.00 -0.26 0.00 0.00 57.72 57.90 2ej4 n HIS 49 Cb 0.58 0.00 0.42 0.00 1.12 0.00 0.00 29.99 32.12 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 0.06 0.00 1.59 2.07 -0.13 -3.44 116.25 116.39 2ej4 h VAL 50 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2ej4 h VAL 50 Cb 0.00 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 29.92 2ej4 h VAL 50 CO 0.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.20 2ej4 n GLY 51 N -1.61 1.79 0.00 2.17 0.00 0.21 -4.70 105.19 103.06 2ej4 n GLY 51 Ca 0.15 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 0.84 0.00 -0.02 0.00 -1.11 -4.25 105.19 100.64 2ej4 n GLY 52 Ca 0.00 -1.97 0.08 0.00 0.00 0.00 0.00 46.02 44.13 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 0.49 -3.29 1.61 -0.04 -1.26 -3.68 135.00 128.83 2ej4 n PRO 53 Ca 0.00 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.21 2ej4 n PRO 53 Cb 0.00 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 31.89 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 -1.00 1.41 -4.31 0.54 1.02 -1.26 -5.07 120.64 111.97 2ej4 n GLU 54 Ca 0.12 -3.79 -0.16 0.00 -0.02 0.00 0.00 57.16 53.30 2ej4 n GLU 54 Cb 0.05 -1.63 -0.10 0.00 -0.02 0.00 0.00 31.44 29.74 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 -1.66 1.26 -0.38 3.49 0.74 -1.24 -5.00 119.66 116.86 2ej4 s GLN 55 Ca 0.37 -1.60 -0.07 0.00 0.05 0.00 0.00 55.36 54.11 2ej4 s GLN 55 Cb 0.16 -0.70 0.06 0.00 1.10 0.00 0.00 33.01 33.63 2ej4 s GLN 55 CO -0.07 -0.00 0.18 -0.80 -0.55 0.00 0.00 175.29 174.04 2ej4 s ASN 56 N -3.27 5.44 0.00 6.67 -0.87 -1.26 -4.83 114.94 116.82 2ej4 s ASN 56 Ca 0.24 -1.39 0.00 0.00 -1.57 0.00 0.00 52.86 50.14 2ej4 s ASN 56 Cb 0.04 -1.91 0.00 0.00 -0.02 0.00 0.00 41.25 39.36 2ej4 s ASN 56 CO 0.06 -0.44 0.00 -3.20 -2.57 0.00 0.00 177.10 170.95 2ej4 n ASN 57 N 4.83 -1.86 -4.58 -1.22 4.05 -1.26 -4.97 115.26 110.25 2ej4 n ASN 57 Ca -0.10 0.00 -0.43 0.00 0.45 0.00 0.00 54.58 54.50 2ej4 n ASN 57 Cb 0.44 -0.93 -0.03 0.00 1.23 0.00 0.00 39.78 40.48 2ej4 n ASN 57 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 177.26 173.21 2ej4 s HIS 58 N 0.00 2.91 0.05 1.20 3.76 -1.26 -5.02 115.29 116.94 2ej4 s HIS 58 Ca 0.00 0.58 0.04 0.00 -0.15 0.00 0.00 55.06 55.53 2ej4 s HIS 58 Cb 0.00 -4.08 -0.02 0.00 1.11 0.00 0.00 32.58 29.58 2ej4 s HIS 58 CO 0.00 -1.11 -0.12 0.08 -0.85 0.00 0.00 174.74 172.73 2ej4 s VAL 59 N 3.96 0.96 -0.58 -0.90 1.01 -1.26 -1.09 120.40 122.51 2ej4 s VAL 59 Ca 0.41 -1.11 -0.12 0.00 0.00 0.00 0.00 61.98 61.16 2ej4 s VAL 59 Cb -0.09 -0.92 0.15 0.00 0.00 0.00 0.00 36.38 35.51 2ej4 s VAL 59 CO 0.27 -0.16 0.49 0.00 0.00 0.00 0.00 175.10 175.70 2ej4 s TYR 61 N 1.14 3.50 0.23 0.00 2.02 -1.26 -2.48 117.35 120.50 2ej4 s TYR 61 Ca 0.08 1.03 -0.22 0.00 -0.37 0.00 0.00 57.07 57.58 2ej4 s TYR 61 Cb -0.24 -2.70 0.04 0.00 -0.40 0.00 0.00 41.96 38.66 2ej4 s TYR 61 CO -0.01 0.06 0.72 -0.46 -1.57 0.00 0.00 175.55 174.29 2ej4 s TRP 62 N 0.99 -0.28 0.02 2.71 -0.11 -1.26 -4.22 118.94 116.78 2ej4 s TRP 62 Ca 0.31 -0.09 -0.15 0.00 1.22 0.00 0.00 56.10 57.38 2ej4 s TRP 62 Cb -0.16 0.66 -0.35 0.00 -1.50 0.00 0.00 33.47 32.12 2ej4 s TRP 62 CO 0.13 -1.08 0.94 1.49 -4.62 0.00 0.00 176.95 173.82 2ej4 h GLU 63 N 2.00 0.52 -2.22 5.86 4.81 -1.92 -3.39 114.58 120.25 2ej4 h GLU 63 Ca -0.23 -0.89 -0.57 0.00 -0.13 0.00 0.00 59.36 57.53 2ej4 h GLU 63 Cb 1.26 0.33 -0.42 0.00 0.63 0.00 0.00 28.75 30.56 2ej4 h GLU 63 CO 0.27 1.43 -0.74 0.39 -0.73 0.00 0.00 179.01 179.63 2ej4 n GLU 64 N -3.70 2.71 -4.40 1.92 1.02 -1.26 -5.07 120.64 111.86 2ej4 n GLU 64 Ca -0.18 -4.55 -0.33 0.00 -0.02 0.00 0.00 57.16 52.08 2ej4 n GLU 64 Cb 1.10 -2.12 -0.10 0.00 -0.02 0.00 0.00 31.44 30.30 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 4.55 0.71 0.00 0.00 0.13 -1.97 -2.94 132.00 132.48 2ej4 h PRO 66 Ca -0.49 -0.37 0.00 0.00 -0.87 0.00 0.00 66.00 64.27 2ej4 h PRO 66 Cb 1.17 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2ej4 h PRO 66 CO 0.55 0.99 0.00 0.54 -0.23 0.00 0.00 178.00 179.85 2ej4 n ARG 67 N -4.26 0.22 -1.07 0.86 1.74 -1.26 -4.85 116.66 108.04 2ej4 n ARG 67 Ca -0.04 0.39 -0.07 0.00 -0.77 0.00 0.00 57.85 57.36 2ej4 n ARG 67 Cb 0.47 -1.88 -0.03 0.00 -1.02 0.00 0.00 32.46 30.00 2ej4 n ARG 67 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2ej4 n GLU 68 N -2.28 -1.69 -0.21 5.56 1.02 -1.11 0.17 120.64 122.11 2ej4 n GLU 68 Ca 0.03 0.62 0.00 0.00 -0.02 0.00 0.00 57.16 57.79 2ej4 n GLU 68 Cb 0.27 -4.74 0.00 0.00 -0.02 0.00 0.00 31.44 26.95 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 0.25 1.02 0.00 0.62 0.00 -1.03 -4.89 105.19 101.15 2ej4 n GLY 69 Ca -0.07 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2ej4 n GLY 69 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ej4 n LYS 70 N -1.99 0.00 0.00 1.61 5.02 0.13 -4.47 118.16 118.46 2ej4 n LYS 70 Ca 0.00 0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2ej4 n LYS 70 Cb 0.01 -0.81 0.00 0.00 -0.02 0.00 0.00 35.03 34.21 2ej4 n LYS 70 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2ej4 n SER 71 N -0.52 0.00 -2.62 4.39 3.41 -1.26 -4.87 113.62 112.15 2ej4 n SER 71 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.50 2ej4 n SER 71 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2ej4 n SER 71 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2ej4 n PHE 72 N -0.91 0.14 -0.00 7.33 3.72 -0.25 -4.97 117.46 122.52 2ej4 n PHE 72 Ca 0.00 -1.11 -0.01 0.00 -0.05 0.00 0.00 57.45 56.28 2ej4 n PHE 72 Cb 0.00 -0.03 -0.01 0.00 -0.94 0.00 0.00 39.48 38.51 2ej4 n PHE 72 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 2ej4 n LYS 73 N -0.42 1.58 -4.32 -1.08 3.00 -1.26 -4.74 118.16 110.91 2ej4 n LYS 73 Ca -0.04 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 57.95 2ej4 n LYS 73 Cb 0.26 -1.02 -0.09 0.00 0.00 0.00 0.00 35.03 34.18 2ej4 n LYS 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2ej4 s ALA 74 N -2.02 3.23 0.08 3.14 0.00 -1.26 -5.04 121.76 119.89 2ej4 s ALA 74 Ca -0.01 -0.96 -0.34 0.00 0.00 0.00 0.00 51.96 50.66 2ej4 s ALA 74 Cb 0.00 -1.31 -0.17 0.00 0.00 0.00 0.00 23.12 21.65 2ej4 s ALA 74 CO 0.03 0.64 1.60 -0.22 0.00 0.00 0.00 175.76 177.81 2ej4 h LYS 75 N 4.41 -0.90 -0.94 0.00 1.63 -1.96 -2.71 116.57 116.09 2ej4 h LYS 75 Ca -0.49 0.06 0.07 0.00 -0.85 0.00 0.00 60.65 59.44 2ej4 h LYS 75 Cb 1.18 0.21 -0.07 0.00 -0.60 0.00 0.00 32.23 32.94 2ej4 h LYS 75 CO 0.57 -0.60 0.59 0.10 -3.45 0.00 0.00 179.45 176.65 2ej4 h TYR 76 N -0.94 1.10 -0.68 1.91 -0.00 -1.96 -2.41 116.97 113.99 2ej4 h TYR 76 Ca -0.07 0.03 0.13 0.00 0.00 0.00 0.00 58.73 58.83 2ej4 h TYR 76 Cb 0.78 -0.36 -0.13 0.00 0.00 0.00 0.00 36.73 37.02 2ej4 h TYR 76 CO -0.13 0.55 -0.19 0.87 -0.00 0.00 0.00 178.16 179.26 2ej4 h LYS 77 N 1.07 -0.02 0.04 0.10 1.57 -1.90 0.14 116.57 117.56 2ej4 h LYS 77 Ca 0.41 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.19 2ej4 h LYS 77 Cb 0.20 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 2ej4 h LYS 77 CO -0.18 -0.01 -0.05 1.25 -0.57 0.00 0.00 179.45 179.89 2ej4 h LEU 78 N -0.02 -0.13 -0.98 2.94 5.85 -1.22 -1.79 115.31 119.95 2ej4 h LEU 78 Ca 0.32 0.01 0.29 0.00 0.84 0.00 0.00 57.88 59.35 2ej4 h LEU 78 Cb 0.51 0.05 -0.14 0.00 0.37 0.00 0.00 40.66 41.44 2ej4 h LEU 78 CO -0.71 -0.06 0.53 0.58 -0.34 0.00 0.00 178.44 178.44 2ej4 h VAL 79 N -0.09 0.36 -0.55 1.05 2.07 -1.48 0.30 116.25 117.91 2ej4 h VAL 79 Ca -0.00 -0.13 0.07 0.00 0.82 0.00 0.00 66.70 67.46 2ej4 h VAL 79 Cb 0.08 -0.04 -0.06 0.00 -1.52 0.00 0.00 31.29 29.75 2ej4 h VAL 79 CO -0.01 0.07 0.22 -1.13 0.02 0.00 0.00 177.57 176.74 2ej4 h ASN 80 N 0.37 0.26 -0.33 0.57 -1.24 -0.28 -2.17 115.58 112.75 2ej4 h ASN 80 Ca 0.69 0.06 -0.13 0.00 0.71 0.00 0.00 56.30 57.63 2ej4 h ASN 80 Cb 1.49 0.02 -0.01 0.00 0.73 0.00 0.00 38.32 40.56 2ej4 h ASN 80 CO -0.58 0.17 -0.29 -0.74 -1.29 0.00 0.00 177.43 174.69 2ej4 h HIS 81 N 0.42 0.93 -0.97 0.67 2.76 0.40 -3.12 115.15 116.25 2ej4 h HIS 81 Ca 0.26 -0.27 0.21 0.00 -2.20 0.00 0.00 60.37 58.38 2ej4 h HIS 81 Cb 0.27 -0.20 -0.12 0.00 1.55 0.00 0.00 27.41 28.92 2ej4 h HIS 81 CO -0.15 1.04 0.55 0.82 -1.30 0.00 0.00 177.93 178.89 2ej4 h ILE 82 N 0.56 0.60 -0.70 6.26 2.04 -0.58 -0.56 117.51 125.12 2ej4 h ILE 82 Ca 0.06 -0.21 0.15 0.00 1.00 0.00 0.00 64.86 65.86 2ej4 h ILE 82 Cb 0.87 -0.07 -0.12 0.00 -0.74 0.00 0.00 36.82 36.76 2ej4 h ILE 82 CO 0.07 0.11 -0.04 0.03 0.00 0.00 0.00 178.15 178.32 2ej4 h ARG 83 N 0.61 0.07 -1.21 2.37 3.08 -1.36 0.52 114.38 118.46 2ej4 h ARG 83 Ca 0.59 -0.00 0.35 0.00 0.07 0.00 0.00 59.98 60.99 2ej4 h ARG 83 Cb 1.03 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 31.02 2ej4 h ARG 83 CO -0.44 0.05 0.87 -0.24 -1.07 0.00 0.00 179.97 179.13 2ej4 h VAL 84 N 0.08 0.40 0.17 2.04 3.04 -1.24 0.25 116.25 120.98 2ej4 h VAL 84 Ca 0.37 -0.00 -0.35 0.00 -1.01 0.00 0.00 66.70 65.70 2ej4 h VAL 84 Cb 0.62 0.39 0.00 0.00 -2.01 0.00 0.00 31.29 30.29 2ej4 h VAL 84 CO -0.64 0.00 -1.80 0.45 -1.01 0.00 0.00 177.57 174.57 2ej4 h HIS 85 N 0.01 0.66 -0.83 3.17 3.86 -0.11 -3.36 115.15 118.55 2ej4 h HIS 85 Ca 0.57 -0.48 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 2ej4 h HIS 85 Cb 2.30 -0.03 -0.04 0.00 1.06 0.00 0.00 27.41 30.70 2ej4 h HIS 85 CO -0.00 1.69 0.53 1.79 0.86 0.00 0.00 177.93 182.79 2ej4 h THR 86 N 0.10 1.22 0.00 2.45 1.35 0.44 -3.47 112.91 115.01 2ej4 h THR 86 Ca -0.36 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 2ej4 h THR 86 Cb 2.09 0.03 0.00 0.00 -1.73 0.00 0.00 68.15 68.54 2ej4 h THR 86 CO 0.16 0.22 0.00 0.61 -0.25 0.00 0.00 175.52 176.26 2ej4 n GLY 87 N -1.27 0.50 0.00 5.82 0.00 0.03 -5.08 105.19 105.19 2ej4 n GLY 87 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.76 2.25 -1.76 1.61 2.13 -1.25 -4.87 120.64 116.99 2ej4 n GLU 88 Ca 0.00 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.40 2ej4 n GLU 88 Cb 0.00 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.68 2ej4 n GLU 88 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2ej4 s LYS 89 N 0.00 4.15 -0.32 5.31 1.02 -1.26 -4.95 119.74 123.68 2ej4 s LYS 89 Ca 0.00 2.54 -0.06 0.00 0.02 0.00 0.00 55.97 58.46 2ej4 s LYS 89 Cb 0.00 -3.65 0.03 0.00 -0.52 0.00 0.00 37.83 33.69 2ej4 s LYS 89 CO 0.00 -0.83 0.09 -1.54 -0.92 0.00 0.00 175.35 172.15 2ej4 s SER 90 N 2.80 5.23 0.08 2.83 1.04 -1.26 -4.84 113.70 119.58 2ej4 s SER 90 Ca 0.80 -1.02 0.08 0.00 0.48 0.00 0.00 55.95 56.29 2ej4 s SER 90 Cb -0.44 -1.86 -0.04 0.00 0.10 0.00 0.00 66.02 63.78 2ej4 s SER 90 CO 0.36 -0.28 -0.17 -0.83 0.98 0.00 0.00 173.24 173.30 2ej4 s GLY 91 N 1.43 1.66 1.20 7.32 0.00 -1.26 -5.13 107.32 112.53 2ej4 s GLY 91 Ca -0.01 -1.26 -0.19 0.00 0.00 0.00 0.00 44.72 43.27 2ej4 s GLY 91 CO 0.02 -1.19 1.11 2.56 0.00 0.00 0.00 173.10 175.60 2ej4 s PRO 92 N -1.82 -1.20 0.08 2.90 0.04 -1.26 -5.04 135.00 128.71 2ej4 s PRO 92 Ca 0.17 -0.06 0.00 0.00 0.04 0.00 0.00 61.00 61.15 2ej4 s PRO 92 Cb -0.11 -1.60 0.00 0.00 0.04 0.00 0.00 34.50 32.84 2ej4 s PRO 92 CO 0.08 -3.70 0.00 0.43 0.04 0.00 0.00 177.00 173.86 2ej4 n SER 93 N -4.75 0.02 -2.77 6.66 7.64 -1.26 -5.04 113.62 114.13 2ej4 n SER 93 Ca 0.13 0.13 -0.22 0.00 1.01 0.00 0.00 58.87 59.93 2ej4 n SER 93 Cb 0.59 0.08 0.02 0.00 -1.01 0.00 0.00 64.21 63.90 2ej4 n SER 93 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2ej4 n SER 94 N -2.88 -6.07 0.00 6.43 7.64 -1.26 -5.34 113.62 112.14 2ej4 n SER 94 Ca 0.00 -0.19 0.00 0.00 1.01 0.00 0.00 58.87 59.69 2ej4 n SER 94 Cb 0.07 -4.95 0.00 0.00 -1.01 0.00 0.00 64.21 58.32 2ej4 n SER 94 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64